# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-03-16T21:28:18+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Acta Crystallographica C') 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
"1000031","3.8402","0.0001","3.8708","0.0001","27.2309","0.0003","90","","90","","90","","404.8","","295","","","","","","","","","","","4","A m m m","-A 2 2","65","","","","- Ba2 Cu4 O8 Y -","- Ba2 Cu4 O8 Y -","- Ba4 Cu8 O16 Y2 -","2","0.125","","Lightfoot, P.; Pei, S.; Jorgensen, J. D.; Yamada, Y.; Matsumoto, T.; Izumi, F.; Kodama, Y.","Redetermination of the structure of the 80 K superconductor YBa~2~Cu~4~O~8~ by time-of-flight neutron powder diffraction","Acta Crystallographica Section C","1991","47","","1143","1145","10.1107/S0108270190011271","","","","","","","","","","","","","","","","","","","","","has coordinates","198383","2020-10-21","18:00:00",""
"1000099","7.416","0.004","13.082","0.007","9.483","0.005","90","","90","","90","","920","","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Cobalt phosphinate chloride hydrate","","- Cl Co H4 O3 P -","- Cl Co H4 O3 P -","- Cl8 Co8 H32 O24 P8 -","8","1","","Marcos, M D; Ibanez, R; Amoros, P; Le Bail, A","Layer structure of (CoCl(H~2~PO~2~)) . H~2~O","Acta Crystallographica C (39,1983-)","1991","47","","1152","1155","","","","","","","0.025","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000100","9.32","0.001","9.32","0.001","3.9618","0.0005","90","","90","","120","","298","","","","","","","","","","","","","6","P -6 2 m","P -6 -2","189","","Dilead manganese diiron(III) fluoride trihydrate","","- F12 Fe2 H6 Mn O3 Pb2 -","- F12 Fe2.0001 H6 Mn0.9999 O3 Pb2 -","- F12 Fe2.0001 H6 Mn0.9999 O3 Pb2 -","1","0.0833333","","Le Bail, A; Mercier, A M","Structure of Pb~2~MnFe~2~F~12~(H~2~O)~2~","Acta Crystallographica C (39,1983-)","1992","48","","239","241","","","","","","","0.032","","","","","","","","","","","","","","","has coordinates","279153","2022-11-09","14:45:13",""
"1000202","10.711","0.002","6.638","0.001","4.008","0.001","90","","90","","90","","285","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Mercury iron(III) fluoride dihydrate","","- F5 Fe H4 Hg O2 -","- F5 Fe H4 Hg O2 -","- F10 Fe2 H8 Hg2 O4 -","2","0.25","","Fourquet, J L; Courant, E; Chevalier, P; de Pape, R","Structure of Mercury(II) Iron(III) Fluoride Dihydrate, Hg Fe F~5~ (H~2~ O)~2~","Acta Crystallographica C (39,1983-)","1985","41","","165","167","","","","","","","0.0291","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000206","7.559","0.004","7.575","0.004","12.754","0.008","90","","90","","90","","730.3","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ammonium tetrafluoroferrate(III)","","- F4 Fe H4 N -","- F4 Fe H0.5 N -","- F32 Fe8 H4 N8 -","8","1","","Leblanc, M; Ferey, G; Pape, R","Room-Temperature Structure of Ammonium Tetrafluorate(III), N H~4~ (Fe F~4~)","Acta Crystallographica C (39,1983-)","1985","41","","657","660","","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000251","5.662","0.001","5.809","0.001","8.758","0.002","90","","90","","90","","288.1","","","","","","","","","","","","","4","I m m a","-I 2b 2","74","","Lithium copper vanadate","","- Cu Li O4 V -","- Cu Li O4 V -","- Cu4 Li4 O16 V4 -","4","0.25","","Lafontaine, M A; Leblanc, M; Ferey, G","New refinement of the room-temperature structure of Li Cu V O~4~","Acta Crystallographica C (39,1983-)","1989","45","","1205","1206","","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000252","7.541","0.003","7.501","0.003","13.027","0.007","90","","90.52","0.04","90","","736.8","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquacopper diiron(III) octafluoride","","- Cu F8 Fe2 H4 O2 -","- Cu F8 Fe2 H4 O2 -","- Cu4 F32 Fe8 H16 O8 -","4","0.5","","Leblanc, M; Ferey, G","Room-temperature structure of diaquaoctafluorocopper(II) diiron(III)","Acta Crystallographica C (39,1983-)","1990","46","","13","15","","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","287513","2023-11-10","13:23:43",""
"1000253","7.444","0.001","6.658","0.001","7.759","0.001","90","","93.57","0.01","90","","383.8","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Tricopper oxide heptaoxodivanadate hydrate","","- Cu3 H2 O9 V2 -","- Cu3 H3 O9 V2 -","- Cu6 H6 O18 V4 -","2","0.5","","Leblanc, M; Ferey, G","Room-temperature structures of oxocopper(II) vanadate(V) hydrates, Cu~3~ V~2~ O~8~ (H~2~ O) and Cu V~2~ O~6~ (H2 O)2","Acta Crystallographica C (39,1983-)","1990","46","","15","18","","","","","","","0.047","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000254","5.617","0.001","5.595","0.001","11.333","0.002","90","","91.04","0.01","90","","356.1","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Copper hexaoxodivanadate dihydrate","","- Cu H4 O8 V2 -","- Cu H4 O8 V2 -","- Cu2 H8 O16 V4 -","2","0.5","","Leblanc, M; Ferey, G","Room-temperature structures of oxocopper(II) vanadate(V) hydrates, Cu~3~ V~2~ O~8~ (H~2~ O) and Cu V~2~ O~6~ (H2 O)2","Acta Crystallographica C (39,1983-)","1990","46","","15","18","","","","","","","0.045","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000255","7.78","0.002","8.423","0.003","4.993","0.001","90","","96.48","0.02","90","","325.1","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Thallium octaoxotrivanadate","","- O8 Tl V3 -","- O8 Tl V3 -","- O16 Tl2 V6 -","2","0.5","","Benchrifa, R; Leblanc, M; De Pape, R","Structure of the trivanadate Tl V~3~ O~8~","Acta Crystallographica C (39,1983-)","1990","46","","177","179","","","","","","","0.049","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:11:44",""
"1000270","7.703","0.005","10.703","0.007","12.216","0.007","97.68","0.05","118.76","0.05","99.81","0.05","842.5","","","","","","","","","","","","","3","P -1","-P 1","2","","Octathallium 34-oxo-decamolybdate","","- Mo10 O34 Tl8 -","- Mo10 O34 Tl8 -","- Mo10 O34 Tl8 -","1","0.5","","Benchrifa, R; de Pape, R","Isotypism of the triclinic Tl~8~Mo~10~O~34~ and (NH~4~)~8~Mo~10~O~34~ molybdates","Acta Crystallographica C (39,1983-)","1990","46","","728","728","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000271","7.75","0.001","11.038","0.001","12.421","0.001","98.52","0.01","119.87","0.01","99.18","0.01","876.9","","","","","","","","","","","","","4","P -1","-P 1","2","","Octaammonium 34-oxo-decamolybdate","","- H32 Mo10 N8 O34 -","- H32 Mo10 N8 O34 -","- H32 Mo10 N8 O34 -","1","0.5","","Benchrifa, R; de Pape, R","Isotypism of the triclinic Tl~8~Mo~10~O~34~ and (NH~4~)~8~Mo~10~O~34~ molybdates","Acta Crystallographica C (39,1983-)","1990","46","","728","728","","","","","","","","","","","","","","","","","","","","","","has coordinates","200452","2020-10-21","18:00:00",""
"1000280","13.215","0.002","5.943","0.001","5.938","0.001","90","","90","","90","","466.4","","","","","","","","","","","","","3","C m c e","-C 2ac 2","64","","Lanthanum oxide sulfide (2/2/2)","","- La2 O2 S2 -","- La2 O2 S2 -","- La8 O8 S8 -","4","0.25","","Ostorero, J; Leblanc, M","Room temperature structure of La~2~O~2~S~2~","Acta Crystallographica C (39,1983-)","1990","46","","1376","1378","","","","","","","0.017","","","","","","","","","","","","","","","has coordinates","287588","2023-11-14","18:05:45",""
"1000338","7.262","0.004","20.668","0.008","5.431","0.002","90","","90.76","0.01","90","","815.1","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Disodium tribarium tetrachromium fluoride","","- Ba3 Cr4 F20 Na2 -","- Ba3 Cr4 F20 Na2 -","- Ba6 Cr8 F40 Na4 -","2","0.5","","Abjean, P; Leblanc, M; De, Pape R; Ferey, G","Structure of Na~2~ Ba~3~ Cr~4~ F~20~","Acta Crystallographica C (39,1983-)","1985","41","","1696","1698","","","","","","","0.027","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000362","6.596","0.004","10.774","0.004","14.09","0.01","90","","90","","90","","1001.3","","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Disodium europium carbonate trifluoride","","- C Eu F3 Na2 O3 -","- C Eu F3 Na2 O3 -","- C8 Eu8 F24 Na16 O24 -","8","1","","Mercier, N; Leblanc, M","A new rare earth fluorocarbonate, Na~2~Eu(CO~3~)F~3~","Acta Crystallographica C (39,1983-)","1994","50","","1864","1865","","","","","","","0.018","","","","","","","","","","","","","","","has coordinates","208902","2020-10-21","18:00:00",""
"1000396","9.1546","0.0002","9.1546","0.0002","9.1546","0.0002","90","","90","","90","","767.2","","","","","","","","","","","","","3","P 21 3","P 2ac 2ab 3","198","","Zirconium tungstate","","- O8 W2 Zr -","- O8 W2 Zr -","- O32 W8 Zr4 -","4","0.333333","","Auray, M; Quarton, M; Leblanc, M","Zirconium tungstate","Acta Crystallographica C (39,1983-)","1995","51","","2210","2213","","","","","","","0.027","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000435","9.8232","0.0006","9.7376","0.0008","9.8716","0.0008","90","","102.803","0.008","90","","920.8","","","","","","","","","","","","synthetic","5","P 1 21/n 1","-P 2yn","14","","Diiron(III) ammonium hydroxide bis(phosphate(V)) dihydrate","Spheniscidite","- Fe2 H9 N O11 P2 -","- Fe2 H12.5 N O11 P2 -","- Fe8 H50 N4 O44 P8 -","4","1","","Cavellec, M; Riou, D; Ferey, G","Synthetic spheniscidite","Acta Crystallographica C (39,1983-)","1994","50","","1379","1381","","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000441","7.848","0.002","19.86699","0.004","10.773","0.003","90","","90","","90","","1679.7","","","","","","","","","","","","","5","C m c a","-C 2ac 2","64","","Distrontium pentfluoroferrate(III) aquapentafluoroferrate(III)","","- F10 Fe2 H2 O Sr2 -","- F10 Fe2 H2 O Sr2 -","- F80 Fe16 H16 O8 Sr16 -","8","","","Le Meins, J-M; Hemon-Ribaud, A; Courbion, G","Sr2 Fe2 F10 . (H2 O), the first hydrated strontium iron(III) fluoride","Acta Crystallographica C (39,1983-)","1997","53","","1165","1166","","","","","","","0.0772","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000459","5.7747","0.0014","8.4689","0.0011","9.923","0.003","64.77","0.02","82.75","0.02","81.43","0.02","433","","","","","","","","","","","","","5","P 1","P 1","1","","Tetracalcium dialuminium dodecahydroxide carbonate pentahydrate","","- C H22 Al2 Ca4 O20 -","- C H22 Al2 Ca4 O20 -","- C H22 Al2 Ca4 O20 -","1","1","","Francois, M; Renaudin, G; Evrard, O","A cementitious compound with composition 3CaO . Al2O3 . CaCO3 . 11H2O","Acta Crystallographica C (39,1983-)","1998","54","","1214","1217","","","","","","","0.027","","","","","","","","","","","","","","","has coordinates","208902","2020-10-21","18:00:00",""
"1000466","9.826","0.002","9.826","0.002","10.106","0.002","90","","90","","120","","845","","","","","","","","","","","","","5","R -3 :H","-R 3","148","","Hexaaquairon hexafluorostannate","","- F6 Fe H12 O6 Sn -","- F6 Fe H12 O6 Sn -","- F18 Fe3 H36 O18 Sn3 -","3","0.166667","","Benghalem, A; Leblanc, M; Calage, Y","Room-temperature structure of iron(II) hexafluorostannate(IV) hexahydrate","Acta Crystallographica C (39,1983-)","1990","46","","2453","2454","","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:11:44",""
"1001255","18.315","0.003","24.506","0.004","7.296","0.002","90","","90","","90","","3274.6","","","","","","","","","","","","","3","A m a m","-A 2 2a","63","","Caesium niobium oxide (3/5.96/16.4)","","- Cs3 Nb5.96 O16.4 -","- Cs3 Nb5.96 O16.4 -","- Cs24 Nb47.68 O131.2 -","8","0.5","","Saine, M C; Gasperin, M","Synthese et Structure d'un Niobate de Cesium non Stoechiometrique, Cs~3~ Nb~5.96~ O~16.4~","Acta Crystallographica C (39,1983-)","1983","39","","1153","1156","","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001269","10","0.003","9.959","0.003","7.315","0.002","90","","111.29","0.02","90","","678.8","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dibarium trititanium tetraniobium oxide","","- Ba2 Nb4 O18 Ti3 -","- Ba2 Nb4 O18 Ti3 -","- Ba4 Nb8 O36 Ti6 -","2","0.5","","Gasperin, M","Syntheses and Structure of a New Titanoniobate: The Trititanotetraniobate of Dibarium, Ba~2~ Ti~3~ Nb~4~ O~18~","Acta Crystallographica C (39,1983-)","1984","40","","9","11","","","","","","","0.043","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001271","17.788","0.011","5.277","0.004","6.607","0.005","90","","99.64","0.05","90","","611.4","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Sodium tungstate phosphate *","","- Na1.5 O32 P4 W8 -","- Na1.5 O32 P4 W8 -","- Na1.5 O32 P4 W8 -","1","0.25","","Benmmoussa, A; Groult, D; Labbe, Ph; Raveau, B","Two New Members of a Series of Monoclinic Sodium Phosphate Tungsten Bronzes Na~x~ P~4~ O~8~ (W O~3~)~2m~: Na~x~ P~4~ W~8~ O~32~ (m=4) and Na~x~ P~4~ W~12~ O~44~ (m=6)","Acta Crystallographica C (39,1983-)","1984","40","","573","576","","","","","","","0.055","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001272","23.775","0.017","5.291","0.001","6.588","0.002","90","","93.47","0.04","90","","827.2","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Sodium tungstate phosphate *","","- Na1.7 O44 P4 W12 -","- Na1.7 O44 P4 W12 -","- Na1.7 O44 P4 W12 -","1","0.25","","Benmmoussa, A; Groult, D; Labbe, Ph; Raveau, B","Two New Members of a Series of Monoclinic Sodium Phosphate Tungsten Bronzes Na~x~ P~4~ O~8~ (W O~3~)~2m~: Na~x~ P~4~ W~8~ O~32~ (m=4) and Na~x~ P~4~ W~12~ O~44~ (m=6)","Acta Crystallographica C (39,1983-)","1984","40","","573","576","","","","","","","0.043","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001330","13.477","0.015","10.031","0.008","8.428","0.002","90","","110.966","","90","","1063.9","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Magnesium dimanganese hexabromide dodecahydrate","","- Br6 H24 Mg Mn2 O12 -","- Br6 H24 Mg Mn2 O12 -","- Br12 H48 Mg2 Mn4 O24 -","2","0.25","","Leclaire, A","Structure de l'hexabromure de magnesium et de dimanganese dodecahydrate Mg Mn~2~ Br~6~ (H~2~ O)~12~","Acta Crystallographica C (39,1983-)","1985","41","","169","170","","","","","","","0.068","","","","","","","","","","","","","","","has coordinates","200452","2020-10-21","18:00:00",""
"1001332","12.023","0.005","11.723","0.005","8.435","0.004","90","","128.77","0.02","90","","926.9","","","","","","","","","","","","","4","C 1 m 1","C -2y","8","","Neptunium(IV) 12-fluoride hydrate","","- F12 H2 Np3 O -","- F12 H2.5 Np3 O -","- F48 H10 Np12 O4 -","4","1","","Cousson, A; Gasperin, M","Nouvelle description du tetrafluorure de neptunium hydrate, Np~3~ F~12~ H~2~ O","Acta Crystallographica C (39,1983-)","1985","41","","804","805","","","","","","","0.045","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001334","8.2642","0.0005","8.2642","0.0005","17.559","0.002","90","","90","","120","","1038.6","","","","","","","","","","","","","5","P -3 1 c","-P 3 2c","163","","Caesium molybdosilicophosphate *","","- Cs Mo3 O25 P5.8 Si2 -","- Cs Mo3 O25 P5.802 Si2 -","- Cs2 Mo6 O50 P11.604 Si4 -","2","0.166667","","Leclaire, A; Monier, J C; Raveau, B","Structure of Cs Mo~3~ P~5.8~ Si~2~ O~25~","Acta Crystallographica C (39,1983-)","1985","41","","1719","1720","","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001337","7.63","0.002","10.923","0.002","13.609","0.003","90","","90","","90","","1134.2","","","","","","","","","","","","","6","A m a m","-A 2 2a","63","","Caesium potassium niobium titanium uranium oxide (.75/.25/1/1/2/11)","","- Cs0.75 K0.25 Nb O11 Ti U2 -","- Cs0.75 K0.25 Nb O11 Ti U2 -","- Cs3 K Nb4 O44 Ti4 U8 -","4","0.25","","Gasperin, M","(Cs~.75~ K~.25~) (Nb, Ti) U~2~ O~11~: un Niobotitanouranate Alcalin de Type Sructural Nouveau","Acta Crystallographica C (39,1983-)","1986","42","","136","138","","","","","","","0.055","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001338","7.43","0.001","8.7","0.001","10.668","0.002","90","","105.08","0.01","90","","665.8","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Caesium niobium uranium hexaoxide","","- Cs Nb O6 U -","- Cs Nb O6 U -","- Cs4 Nb4 O24 U4 -","4","1","","Gasperin, M","Synthese et structure du niobouranate de cesium:CsNbUo~6~","Acta Crystallographica C (39,1983-)","1987","43","","404","406","","","","","","","0.052","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001345","12.504","0.003","4.183","0.001","10.453","0.003","90","","122.18","0.03","90","","462.7","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Uranium borate *","","- B2 O6 U -","- B2 O6 U -","- B8 O24 U4 -","4","0.5","","Gasperin, M","Structure du borate d'uranium U B~2~ O~6~","Acta Crystallographica C (39,1983-)","1987","43","","2031","2033","","","","","","","0.066","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001347","16.512","0.003","8.169","0.002","6.582","0.001","90","","96.97","0.03","90","","881.3","","","","","","","","","","","","","4","C 1 2 1","C 2y","5","","Calcium diboron diuranium decaoxide","","- B2 Ca O10 U2 -","- B2 Ca O10 U2 -","- B8 Ca4 O40 U8 -","4","1","","Gasperin, M","Synthese et structure du borouranate de calcium: Ca B~2~ U~2~ O~10~.","Acta Crystallographica C (39,1983-)","1987","43","","1247","1250","","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001349","17.6398","0.0014","9.1761","0.0004","12.3","0.0008","90","","90","","90","","1990.9","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Potassium dimolybdenophosphate(V)","","- K Mo2 O12 P3 -","- K Mo2 O12 P3 -","- K8 Mo16 O96 P24 -","8","1","","Leclaire, A; Raveau, B","Small atomic displacements in the molybdenophosphates A Mo~2~ P~3~ O~12~ (A = K, Rb, Tl).","Acta Crystallographica C (39,1983-)","1988","44","","226","229","","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001350","8.8314","0.0008","9.2368","0.0007","12.3051","0.0009","90","","90","","90","","1003.8","","","","","","","","","","","","","4","P b c m","-P 2c 2b","57","","Rubidium dimolybdenotriphosphate(V)","","- Mo2 O12 P3 Rb -","- Mo2 O12 P3 Rb -","- Mo8 O48 P12 Rb4 -","4","0.5","","Leclaire, A; Raveau, B","Small atomic displacements in the molybdenophosphates A Mo~2~ P~3~ O~12~ (A = K, Rb, Tl).","Acta Crystallographica C (39,1983-)","1988","44","","226","229","","","","","","","0.044","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001359","10.712","0.003","5.78","0.001","6.862","0.002","90","","90","","90","","424.9","","","","","","","","","","","","","4","P c a m","-P 2c 2ac","57","","Sodium borouranate","","- B Na O5 U -","- B Na O5 U -","- B4 Na4 O20 U4 -","4","0.5","","Gasperin, M","Synthese et structure du borouranate de sodium, Na B U O~5~.","Acta Crystallographica C (39,1983-)","1988","44","","415","416","","","","","","","0.075","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001360","9.747","0.003","7.315","0.002","7.911","0.002","90","","90","","90","","564","","","","","","","","","","prepared at 1473 K","","","4","P c a m","-P 2c 2ac","57","","Magnesium diborouranate - prepared at 1473 K","","- B2 Mg O7 U -","- B2 Mg O7 U -","- B8 Mg4 O28 U4 -","4","0.5","","Gasperin, M","Synthese et structure du diborouranate de magnesium, Mg B~2~ U O~7~.","Acta Crystallographica C (39,1983-)","1987","43","","2264","2266","","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001361","17.6398","0.0014","9.1761","0.0004","12.3","0.0008","90","","90","","90","","1990.9","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Potassium dimolybdotriphosphate","","- K Mo2 O12 P3 -","- K Mo2 O12 P3 -","- K8 Mo16 O96 P24 -","8","1","","Leclaire, A; Raveau, B","Small Atomic Displacements in the Molybdenophospates A Mo~2~ P~3~ O~12~ (A= K, Rb, Tl)","Acta Crystallographica C (39,1983-)","1988","44","","226","229","","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001363","14.705","0.004","14.705","0.004","7.3986","0.0005","90","","90","","120","","1385.5","","","","","","","","","","","","","4","P -3","-P 3","147","","Tetramolybdenum(III) tecto-hexaphosphodisilicate","","- Mo4 O25 P6 Si2 -","- Mo4 O25 P6 Si2 -","- Mo12 O75 P18 Si6 -","3","0.5","","Leclaire, A; Lamire, M; Raveau, B","Mo~4~ P~6~ Si~2~ O~25~, an Mo(^III^) phosphosilicate closely related to V~3~ P~5~ Si O~19~: oxygen non-stoichiometry in silicophosphates.","Acta Crystallographica C (39,1983-)","1988","44","","1181","1184","","","","","","","0.065","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001391","7.5237","0.0006","10.3537","0.0008","8.3998","0.0008","90","","105.832","0.0069","90","","629.5","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Rubidium molybdenum(III) diphosphate","","- Mo O7 P2 Rb -","- Mo O7 P2 Rb -","- Mo4 O28 P8 Rb4 -","4","1","","Riou, D; Leclaire, A; Grandin, A; Raveau, B","Structure of a diphosphate of trivalent molybdenum Rb Mo P~2~ O~7~","Acta Crystallographica C (39,1983-)","1989","45","","989","991","","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001392","5.861","0.002","20.2","0.006","4.501","","90","","90","","90","","532.9","","","","","","","","","","","","","4","P m n n","-P 2n 2","58","","Nickel borouranate * 00000100","","- B4 Ni7 O16 U -","- B4 Ni7 O16 U -","- B8 Ni14 O32 U2 -","2","0.25","","Gasperin, M","Synthese et structure du tetraborouranate de nickel, Ni~7~ B~4~ U O~16~","Acta Crystallographica C (39,1983-)","1989","45","","981","983","","","","","","","0.054","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001393","8.818","0.0006","9.1574","0.0008","12.3836","0.0008","90","","90","","90","","1000","","","","","","","","","","","","","5","P b c m","-P 2c 2b","57","","Potassium molybdenum(IV) tungsten(IV) phosphate *","","- K Mo O12 P3 W -","- K Mo O12 P3 W -","- K4 Mo4 O48 P12 W4 -","4","0.5","","Benmoussa, A; Leclaire, A; Grandin, A; Raveau, B","K Mo W P~3~ O~12~, a tunnel structure of the K Mo~2~ P~3~ O~12~ - type","Acta Crystallographica C (39,1983-)","1989","45","","1277","1279","","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001413","5.767","0.002","10.574","0.003","6.835","0.002","90","","105.04","0.03","90","","402.5","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Lithium borouranate","","- B Li O5 U -","- B Li O5 U -","- B4 Li4 O20 U4 -","4","1","","Gasperin, M","Synthese et structure du borouranate de lithium LiBUO~5~","Acta Crystallographica C (39,1983-)","1990","46","","372","374","","","","","","","0.062","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:11:44",""
"1001426","8.8518","0.0005","9.1453","0.0011","12.5174","0.0011","90","","90","","90","","1013.3","","","","","","","","","","","","","5","P b c m","-P 2c 2b","57","","Potassium molybdenum niobium oxide phosphate diphosphate *","","- K0.75 Mo Nb O12 P3 -","- K0.75 Mo Nb O12 P3 -","- K3 Mo4 Nb4 O48 P12 -","4","0.5","","Leclaire, A; Borel, M M; Grandin, A; Raveau, B","Non-stoichiometry in the KMo~2~P~3~O~12~-tunnel structure: the oxide K~0.75~MoNbP~3~O~12~","Acta Crystallographica C (39,1983-)","1990","46","","1381","1383","","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001427","4.8171","0.0008","7.133","0.002","7.998","0.002","90.53","0.02","92.95","0.02","105.18","0.02","264.8","","","","","","","","","","","","","5","P -1","-P 1","2","","Potassium molybdenum aluminium phosphate (1/1.5/.5/4)","","- Al0.5 K Mo1.5 O14 P4 -","- Al0.5 K Mo1.5 O14 P4 -","- Al0.5 K Mo1.5 O14 P4 -","1","0.5","","Leclaire, A; Borel, M M; Grandin, A; Raveau, B","K~2~Mo~3~AlP~8~O~28~: a tunnel structure isotypic with Na0.5MoP~2~O~7~","Acta Crystallographica C (39,1983-)","1990","46","","1368","1370","","","","","","","0.061","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:11:44",""
"1001430","7.3686","0.0003","10.0527","0.0005","8.1874","0.0004","90","","106.58","0.003","90","","581.3","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Potassium vanadium(III) diphosphate","","- K O7 P2 V -","- K O7 P2 V -","- K4 O28 P8 V4 -","4","1","","Benhamada, L; Grandin, A; Borel, M M; Leclaire, A; Raveau, B","Structure of KVP~2~O~7~","Acta Crystallographica C (39,1983-)","1991","47","","424","425","","","","","","","0.027","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001443","11.545","0.003","6.937","0.002","10.263","0.003","90","","101.5","0.3","90","","805.4","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Thorium diborate","","- B2 O5 Th -","- B2 O5 Th -","- B16 O40 Th8 -","8","1","","Cousson, A; Gasperin, M","Synthese et structure du borate de thorium: ThB~2~O~5~","Acta Crystallographica C (39,1983-)","1991","47","","10","12","","","","","","","0.07","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001464","12.764","0.0008","10.5153","0.0009","6.3648","0.0004","90","","90","","90","","854.3","","","","","","","","","","","","","4","P n 21 a","P -2ac -2n","33","","Potassium vanadium(IV) oxide phosphate","","- K O5 P V -","- K O5 P V -","- K8 O40 P8 V8 -","8","2","","Benhamada, L; Grandin, A; Borel, M M; Leclaire, A; Raveau, B","KVPO~5~, an intersecting tunnel structure closely related to the hexagonal tungsten bronze","Acta Crystallographica C (39,1983-)","1991","47","","1138","1141","","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001465","6.977","0.001","8.33","0.002","9.032","0.009","90","","113.74","0.01","90","","480.5","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Magnesium cobalt diphosphate (1.1/0.9/1)","","- Co0.92 Mg1.08 O7 P2 -","- Co0.92 Mg1.08 O7 P2 -","- Co3.68 Mg4.32 O28 P8 -","4","1","","Riou, D; Leclaire, A; Raveau, B","Structure of a cobalt magnesium diphosphate: (Mg~x~Co~1-x~)~2~P~2~O~7~","Acta Crystallographica C (39,1983-)","1991","47","","1583","1585","","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001466","5.3165","0.0004","8.2574","0.0005","12.6755","0.0007","90","","90.133","0.005","90","","556.5","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Strontium cobalt diphosphate","","- Co O7 P2 Sr -","- Co O7 P2 Sr -","- Co4 O28 P8 Sr4 -","4","1","","Riou, D; Raveau, B","Structure of SrCoP~2~O~7~","Acta Crystallographica C (39,1983-)","1991","47","","1708","1709","","","","","","","0.041","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001509","8.631","0.001","8.631","0.001","8.631","0.001","90","","90","","90","","643","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Nonapotassium bismuth hexauranium oxide","","- Bi K9 O24 U6 -","- Bi K9 O24 U6 -","- Bi K9 O24 U6 -","1","0.0208333","","Gasperin, M; Rebizant, J; Dancausse, J; Meyer, D; Cousson, A","Structure de K~9~BiU~6~O~24~","Acta Crystallographica C (39,1983-)","1991","47","","2278","2279","","","","","","","0.047","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001510","10.6213","0.0008","10.4685","0.0007","9.7063","0.0013","90","","103.074","0.009","90","","1051.3","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Barium divanadium(III) diphosphate","","- Ba O14 P4 V2 -","- Ba O14 P4 V2 -","- Ba4 O56 P16 V8 -","4","0.5","","Benhamada, L; Grandin, A; Borel, M M; Leclaire, A; Raveau, B","Structure of barium vanadium(III) diphosphate","Acta Crystallographica C (39,1983-)","1991","47","","2437","2438","","","","","","","0.038","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001529","15.639","0.002","15.639","0.002","3.8317","0.0004","90","","90","","90","","937.2","","","","","","","","","","","","","3","I 4/m","-I 4","87","","Phosphorus nonaniobium oxide","","- Nb9 O25 P -","- Nb9 O25 P -","- Nb18 O50 P2 -","2","0.125","","Benabbas, A; Borel, M M; Grandin, A; Leclaire, A; Raveau, B","Redetermination of the structure of PNb~9~O~25~","Acta Crystallographica C (39,1983-)","1991","47","","849","850","","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001534","5.2306","0.0004","8.5805","0.0009","16.79","0.001","90","","91.01","0.01","90","","753.4","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Lead divanado(IV)diphosphate","","- O10 P2 Pb V2 -","- O10 P2 Pb V2 -","- O40 P8 Pb4 V8 -","4","1","","Grandin, A; Chardon, J; Borel, M M; Leclaire, A; Raveau, B","Structure of PbV~2~P~2~O~1~0","Acta Crystallographica C (39,1983-)","1992","48","","1913","1915","","","","","","","0.032","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001535","10.6604","0.0008","10.6604","0.0008","6.4434","0.0004","90","","90","","90","","732.3","","","","","","","","","","","","","5","P -4 m 2","P -4 -2","115","","Barium rubidium tecto-octaniobopentaphosphate (0.84/3/1)","","- Ba0.84 Nb8 O34 P5 Rb3 -","- Ba0.84 Nb8 O34 P5 Rb3 -","- Ba0.84 Nb8 O34 P5 Rb3 -","1","0.125","","Gueho, C; Borel, M M; Grandin, A; Leclaire, A; Raveau, B","Structure of Ba~0.84~Rb~3~Nb~8~P~5~O~34~","Acta Crystallographica C (39,1983-)","1992","48","","2066","2067","","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001537","10.0451","0.0002","11.6905","0.0002","3.4086","0.00004","90","","90","","90","","400.3","","","","","","","","","","","","","3","P n a m","-P 2c 2n","62","","Strontium dithallium(III) oxide","","- O4 Sr Tl2 -","- O4 Sr Tl2 -","- O16 Sr4 Tl8 -","4","0.5","","Michel, C; Hervieu, M; Caignaert, V; Raveau, B","Structure Refinement of the semi-Metallic Oxide SrTl~2~O~4~: a Neutron Diffraction Study","Acta Crystallographica C (39,1983-)","1992","48","","1747","1749","","","","","","","0.048","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001541","10.605","0.0009","10.605","0.0009","6.4099","0.0005","90","","90","","90","","720.9","","","","","","","","","","","","","5","P -4 m 2","P -4 -2","115","","Potassium niobium silicophosphate *","","- K4 Nb8 O34 P4 Si -","- K4 Nb8 O34 P4 Si -","- K4 Nb8 O34 P4 Si -","1","0.125","","Leclaire, A; Borel, M M; Chardon, J; Grandin, A; Raveau, B","A niobium silicophosphate belonging to the niobium phosphate bronzeseries: K~4~Nb~8~P~4~SiO~34~","Acta Crystallographica C (39,1983-)","1992","48","","1744","1747","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001592","9.945","0.001","10.156","0.001","9.974","0.002","90","","97.64","0.01","90","","998.4","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dithallium tecto-dimolybdo(V)diphosphate","","- Mo2 O11 P2 Tl2 -","- Mo2 O11 P2 Tl2 -","- Mo8 O44 P8 Tl8 -","4","1","","Guesdon, A; Borel, M M; Grandin, A; Leclaire, A; Raveau, B","Structure of Tl~2~Mo~2~P~2~O~11~","Acta Crystallographica C (39,1983-)","1993","49","","1877","1879","","","","","","","0.044","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001596","4.7833","0.0006","6.9698","0.0008","7.7644","0.0008","89.41","0.01","87.77","0.01","73.16","0.01","247.6","","","","","","","","","","","","","4","P -1","-P 1","2","","Cadmium divanadium(III) bis(diphosphate)","","- Cd O14 P4 V2 -","- Cd O14 P4 V2 -","- Cd O14 P4 V2 -","1","0.5","","Boudin, S; Grandin, A; Leclaire, A; Borel, M M; Raveau, B","CdV~2~(P~2~O~7~)~2~","Acta Crystallographica C (39,1983-)","1994","50","","840","842","","","","","","","0.021","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001613","9.973","0.002","10.18","0.002","10.012","0.001","90","","97.7","0.01","90","","1007.3","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dirubidium dimolybdenum(V) bis(phosphate) trioxide","","- Mo2 O11 P2 Rb2 -","- Mo2 O11 P2 Rb2 -","- Mo8 O44 P8 Rb8 -","4","1","","Guesdon, A; Leclaire, A; Borel, M M; Grandin, A; Raveau, B","An Mo^V^ monophosphate, Rb~2~Mo~2~P~2~O~11~","Acta Crystallographica C (39,1983-)","1994","50","","1852","1854","","","","","","","0.041","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001656","14.192","0.001","6.424","0.001","7.317","0.001","90","","90","","90","","667.1","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Calcium divanadium(III) oxide diphosphate","","- Ca O9 P2 V2 -","- Ca O9 P2 V2 -","- Ca4 O36 P8 V8 -","4","0.5","","Boudin, S; Grandin, A; Leclaire, A; Borel, M - M; Raveau, B","Ca V2 O (P O4)2, isotypic with the Cd phase","Acta Crystallographica C (39,1983-)","1995","51","","796","798","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001731","8.6233","0.0006","8.6233","0.0006","5.6384","0.0007","90","","90","","90","","419.3","","","","","","","","","","","","","5","P 4 b m","P 4 -2ab","100","","Diammonium oxovanadium(IV) vanadophosphate(V)","","- H8 N2 O8 P V2 -","- H10 N2 O8 P1.02 V1.98 -","- H20 N4 O16 P2.04 V3.96 -","2","0.25","","Boudin, S; Grandin, A; Labbe, P; Raveau, B","(N H4)2 (V O) (V P) O7, a layered structure comprising tetrahedral VP O7 groups","Acta Crystallographica C (39,1983-)","1996","52","","2668","2670","","","","","","","0.046","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001767","4.8984","0.0004","8.3919","0.0008","7.034","0.001","90","","109.33","0.01","90","","272.8","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Lithium molybdenum(III) diphosphate","","- Li Mo O7 P2 -","- Li Mo O7 P2 -","- Li2 Mo2 O14 P4 -","2","1","","Ledain, S; Leclaire, A; Borel, M M; Raveau, B","Li Mo P2 O7","Acta Crystallographica C (39,1983-)","1996","52","","1593","1594","","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001843","8.022","0.005","8.022","0.005","16.51299","0.009","90","","90","","120","","920.3","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Sodium trineptunium(IV) fluoride","","- F13 Na Np3 -","- F13 Na Np3 -","- F52 Na4 Np12 -","4","0.166667","","Cousson, A; Abazli, H; Pages, M; Gasperin, M","Fluorure de neptunium et de sodium: Na Np3 F13","Acta Crystallographica C (39,1983-)","1983","39","","318","320","","","","","","","0.066","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001844","8.455","0.008","8.858","0.009","8.396","0.01","113.83","","116.64","","58.03","","465.2","","","","","","","","","","","","","4","P 1","P 1","1","","Trineptunium(IV) fluoride hydrate","","- F12 H2 Np3 O -","- F12 H2 Np3 O -","- F24 H4 Np6 O2 -","2","2","","Cousson, A; Abazli, H; Pages, M; Gasperin, M","Tetrafluorure de Neptunium Hydrate, Np3 F12 1. 1H H2 O","Acta Crystallographica C (39,1983-)","1983","39","","425","427","","","","","","","0.079","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001855","8.6974","0.0007","8.6974","0.0007","22.12299","0.002","90","","90","","120","","1449.3","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Niobium(IV) niobium(V) phosphate(V)","","- Nb2 O12 P3 -","- Nb2 O12 P3 -","- Nb12 O72 P18 -","6","0.166667","","Leclaire, A; Borel, M M; Grandin, A; Raveau, B","A mixed-valence niobium phosphate with an empty nasicon structure: Nb2 (P O4)3","Acta Crystallographica C (39,1983-)","1989","45","","699","701","","","","","","","0.0347","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1001857","8.2648","0.0009","8.2648","0.0009","17.03799","0.001","90","","90","","120","","1007.9","","","","","","","","","","","","","5","P -3 1 c","-P 3 2c","163","","Potassium titanium disilicohexaphosphate (1/3/1)","","- K O25 P6 Si2 Ti3 -","- K O25 P6 Si2 Ti3 -","- K2 O50 P12 Si4 Ti6 -","2","0.166667","","Benmoussa, A; Borel, M M; Grandin, A; Leclaire, A; Raveau, B","Structure of mixed-valent titanium silicophosphates, K Ti3 P6 Si2 O25 and Cs Ti3 P6 Si2 O25","Acta Crystallographica C (39,1983-)","1991","47","","936","938","","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001858","8.2145","0.0006","8.2145","0.0006","17.24899","0.001","90","","90","","120","","1008","","","","","","","","","","","","","5","P -3 1 c","-P 3 2c","163","","Caesium titanium disilicohexaphosphate (1/3/1)","","- Cs O25 P6 Si2 Ti3 -","- Cs O25 P6 Si2 Ti3 -","- Cs2 O50 P12 Si4 Ti6 -","2","0.166667","","Benmoussa, A; Borel, M M; Grandin, A; Leclaire, A; Raveau, B","Structure of mixed-valent titanium silicophosphates, K Ti3 P6 Si2 O25 and Cs Ti3 P6 Si2 O25","Acta Crystallographica C (39,1983-)","1991","47","","936","938","","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001860","9.1584","0.0005","9.1584","0.0005","12.0404","0.0004","90","","90","","120","","874.6","","","","","","","","","","","","","3","P 63/m c m","-P 6c 2","193","","Tripotassium tecto-octaniobate","","- K3 Nb8 O21 -","- K3 Nb8 O21 -","- K6 Nb16 O42 -","2","0.0833333","","Benabbas, A; Borel, M M; Grandin, A; Leclaire, A; Raveau, B","Single-crystal structure of K3 Nb8 O21","Acta Crystallographica C (39,1983-)","1993","49","","439","441","","","","","","","0.044","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001861","9.046","0.001","9.046","0.001","27.883","0.001","90","","90","","120","","1976","","","","","","","","","","","","","5","P 63/m c m","-P 6c 2","193","","Potassium calcium siliconiobate *","","- Ca0.75 K6.5 Nb14 O47 Si4 -","- Ca0.75 K6.5001 Nb14 O47 Si4 -","- Ca1.5 K13.0002 Nb28 O94 Si8 -","2","0.0833333","","Borel, M M; Chardon, J; Grandin, A; Leclaire, A; Raveau, B","Structure of a new siliconiobate K6.5 Ca0.75 Nb14 Si4 O47","Acta Crystallographica C (39,1983-)","1993","49","","570","571","","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004072","7.891","0.012","10.39","0.005","10.39","0.005","90","","90","","90","","851.9","","","","","","","","","","","","","3","P n n a","-P 2a 2bc","52","","Potassium tetrabromoindate","","- Br4 In K -","- Br4 In K -","- Br16 In4 K4 -","4","0.5","","Wignacourt, J P; Mairesse, G; Abraham, F","Potassium Tetrabromoindate(III), K (In Br~4~)","Acta Crystallographica C (39,1983-)","1984","40","","2006","2007","","","","","","","0.052","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1005005","9.829","0.001","9.829","0.001","9.829","0.001","90","","90","","90","","949.6","","","","","","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","Lithium niobium nitride","","- Li7 N4 Nb -","- Li7 N4 Nb -","- Li56 N32 Nb8 -","8","0.333333","","Vennos, D A; DiSalvo, F J","Structure of lithium niobium nitride","Acta Crystallographica C (39,1983-)","1992","48","","610","612","","","","","","","0.031","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1005006","3.8862","0.0001","10.2118","0.0002","10.2624","0.0003","90","","90","","90","","407.3","","","","","","","","","","","","","2","C m c m","-C 2c 2","63","","Tritantalum nitride","","- N5 Ta3 -","- N5 Ta3 -","- N20 Ta12 -","4","0.25","","Brese, N E; O'Keefe, M; Rauch, P; DiSalvo, F J","Structure of Ta~3~N~5~ at 16 K by time-of-flight neutron diffraction","Acta Crystallographica C (39,1983-)","1991","47","","2291","2294","","","","","","","0.043","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1005032","6.201","0.0012","10.511","0.002","10.07","0.002","90","","90","","90","","656.3","","","","","","","","","","","","","3","P n n a","-P 2a 2bc","52","","Tribarium digallium nitride","","- Ba3 Ga2 N4 -","- Ba3 Ga2 N4 -","- Ba12 Ga8 N16 -","4","0.5","","Yamane, H; DiSalvo, F J","Ba3 Ga2 N4","Acta Crystallographica C (39,1983-)","1996","52","","760","761","","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007094","15.23","0.01","15.23","0.01","15.23","0.01","90","","90","","90","","3532.6","","","","","","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","Ammonium cerium cyclo-tetraphosphate","","- Ce H4 N O12 P4 -","- Ce H5.33333 N O12 P4 -","- Ce12 H64 N12 O144 P48 -","12","0.25","","Rzaigui, M; Averbuch-Pouchot, M T; Durif, A","Affinement de la Structure du Tetrametaphosphate d'Ammonium et de Cerium, Ce N H~4~ P~4~ O~12~. Relation Entre la Forme Cubique des Composes du Type Ln M^I^ P~4~ O~12~ et le Tetrametaphosphate d'Aluminium Al~4~ (P~4~ O~12~)~3~","Acta Crystallographica C (39,1983-)","1983","39","","1612","1613","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007095","9.734","0.002","8.889","0.002","4.963","0.001","90","","108.49","0.05","90","","407.3","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Zinc catena-phosphate","","- O6 P2 Zn -","- O6 P2 Zn -","- O24 P8 Zn4 -","4","0.5","","Averbuch-Pouchot, M T; Durif, A; Bagieu-Beucher, M","Structure d'un Polyphosphate de Zinc, Zn (P O~3~)~2~","Acta Crystallographica C (39,1983-)","1983","39","","25","26","","","","","","","0.021","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007096","15.98","0.08","7.226","0.005","6.253","0.005","109.49","0.06","84.34","0.07","101.83","0.07","665.9","","","","","","","","","","","","","5","P -1","-P 1","2","","Potassium hydrogendiphosphate (telluric acid) hydrate","","- H9 K3 O14 P2 Te -","- H9 K3 O14 P2 Te -","- H18 K6 O28 P4 Te2 -","2","1","","Averbuch-Pouchot, M T; Durif, A","Structure of a potassium diphosphate tellurate hydrate (K~3~ H P~2~ O~7~) (Te (O H)~6~) (H~2~ O)","Acta Crystallographica C (39,1983-)","1983","39","","27","28","","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007098","7.788","0.005","7.809","0.005","7.129","0.005","116.69","0.05","103.41","0.05","81.94","0.05","376.5","","","","","","","","","","","","","4","P -1","-P 1","2","","Disodium hydrogencyclo-triphosphate","","- H Na2 O9 P3 -","- H Na2 O9 P3 -","- H2 Na4 O18 P6 -","2","1","","Averbuch-Pouchot, M T; Guitel, J C; Durif, A","Structure d'un Trimetaphosphate Acide de Sodium: Na~2~ H P~3~ O~9~","Acta Crystallographica C (39,1983-)","1983","39","","809","810","","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007099","9.838","0.005","9.838","0.005","5.003","0.003","90","","90","","90","","484.2","","","","","","","","","","","","","4","P 4/n b m :2","-P 4a 2b","125","","Strontium disodium cyclo-tetraphosphate","","- Na2 O12 P4 Sr -","- Na2 O12 P4 Sr -","- Na4 O24 P8 Sr2 -","2","0.125","","Averbuch-Pouchot, M T; Durif, A","Structure d'un Tetrametaphosphate de Sodium-Strontium: Sr Na~2~ P~4~ O~12~","Acta Crystallographica C (39,1983-)","1983","39","","811","812","","","","","","","0.02","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1007100","18.82","0.004","10.89","0.03","13.925","0.003","90","","90","","90","","2853.9","","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Silver divanadate","","- Ag4 O7 V2 -","- Ag4 O7 V2 -","- Ag64 O112 V32 -","16","2","","Masse, R; Averbuch-Pouchot, M T; Durif, A; Guitel, J C","Chemical Preparation and Crystal Structure of Silver Pyrovanadate, Ag~4~ V~2~ O~7~","Acta Crystallographica C (39,1983-)","1983","39","","1608","1610","","","","","","","0.048","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007135","15.052","0.008","9.234","0.003","14.767","0.008","90","","90.03","0.05","90","","2052.5","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Copper trisodium triphosphate dodecahydrate","","- Cu H24 Na3 O22 P3 -","- Cu H24 Na3 O22 P3 -","- Cu4 H96 Na12 O88 P12 -","4","1","","Jouini, O; Dabbabi, M; Averbuch-Pouchot, MT; Guitel, J C; Durif, A","Structure du Phosphate de Cuivre(II) et de Trisodium Dodecahydrate, Cu Na~3~ P~3~ O~10~ (H~2~ O)~12~","Acta Crystallographica C (39,1983-)","1984","40","","728","730","","","","","","","0.045","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007144","9.606","0.005","6.236","0.005","7.738","0.005","90","","109.07","0.05","90","","438.1","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Rubidium dihydrogenphosphate","","- H2 O4 P Rb -","- H2 O4 P Rb -","- H8 O16 P4 Rb4 -","4","1","","Averbuch-Pouchot, M T; Durif, A","Structure of a New Form of Rubidium Dihydrogenphosphate, Rb H~2~ P O~4~","Acta Crystallographica C (39,1983-)","1985","41","","665","667","","","","","","","0.032","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007145","28.57","0.06","10.277","0.005","6.09","0.003","90","","90","","90","","1788.1","","","","","","","","","","","","","4","P n a m","-P 2c 2n","62","","Pentarubidium heptahydrogentetrakis(phosphate)","","- H7 O16 P4 Rb5 -","- H7 O16 P4 Rb5 -","- H28 O64 P16 Rb20 -","4","0.5","","Averbuch-Pouchot, M T; Durif, A","Structure of pentarubidium heptahydrogentetrakis(phosphate)","Acta Crystallographica C (39,1983-)","1985","41","","1555","1556","","","","","","","0.056","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007146","15.455","0.005","15.455","0.005","15.455","0.005","90","","90","","90","","3691.5","","","","","","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","Tetracaesium tristrontium dihydrogentris(tetrametaphosphate)","","- Cs4 H2 O36 P12 Sr3 -","- Cs4 H4 O36 P12 Sr3 -","- Cs16 H16 O144 P48 Sr12 -","4","0.0833333","","Averbuch-Pouchot, M T; Durif, A","Cs~4~ Sr~3~ H~2~ (P~4~ O~12~)~3~, a new derivative of Al~4~ (P~4~ O~12~)~3~","Acta Crystallographica C (39,1983-)","1985","41","","1557","1558","","","","","","","0.031","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007147","11.95","0.01","7.66","0.005","9.658","0.006","90","","92.4","0.01","90","","883.3","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diammonium trihydrogenarsenate sulfate","","- As H11 N2 O8 S -","- As H5.5 N2 O8 S -","- As4 H22 N8 O32 S4 -","4","1","","Boubia, M; Averbuch-Pouchot, M T; Durif, A","Ordered As O~4~ and S O~4~ tetrahedra in diammonium trihydrogenarsenate sulfate","Acta Crystallographica C (39,1983-)","1985","41","","1562","1564","","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007148","9.061","0.003","9.061","0.003","10.284","0.005","90","","90","","90","","844.3","","","","","","","","","","","","","4","I -4","I -4","82","","Tetrapotassium tetrametaphosphate tetrahydrate","","- H8 K4 O16 P4 -","- H8 K4 O16 P4 -","- H16 K8 O32 P8 -","2","0.25","","Averbuch-Pouchot, M T; Durif, A","Structure of tetrapotassium tetrametaphosphate tetrahydrate","Acta Crystallographica C (39,1983-)","1985","41","","1564","1566","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007150","6.644","0.003","7.365","0.004","8.618","0.004","101.62","0.05","109.98","0.05","95.65","0.05","381.7","","","","","","","","","","","","","4","P -1","-P 1","2","","Distrontium tetrametaphosphate hexahydrate","","- H12 O18 P4 Sr2 -","- H12 O18 P4 Sr2 -","- H12 O18 P4 Sr2 -","1","0.5","","Durif, A; Averbuch-Pouchot, M T","Structure of strontium tetrametaphosphate hexahydrate","Acta Crystallographica C (39,1983-)","1986","42","","927","928","","","","","","","0.042","","","","","","","","","","","","","","","has coordinates","186542","2020-10-21","18:00:00",""
"1007151","11.164","0.006","12.46","0.01","5.622","0.002","90","","90","","90","","782","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Mercury potassium trimetaphosphate","","- Hg K O9 P3 -","- Hg K O9 P3 -","- Hg4 K4 O36 P12 -","4","1","","Averbuch-Pouchot, M T; Durif, A","Structure of mercury potassium trimetaphosphate","Acta Crystallographica C (39,1983-)","1986","42","","930","931","","","","","","","0.042","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007152","17.073","0.008","17.029","0.008","13.554","0.006","90","","127.32","0.01","90","","3133.8","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tetralithium cyclo-tetraphosphate pentahydrate","","- H10 Li4 O17 P4 -","- H10 Li4 O17 P4 -","- H80 Li32 O136 P32 -","8","1","","Averbuch-Pouchot, M T; Durif, A","Structure of Tetralithium Tetrametaphosphate Pentahydrate","Acta Crystallographica C (39,1983-)","1986","42","","129","131","","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","200452","2020-10-21","18:00:00",""
"1007153","7.067","0.003","9.071","0.003","9.906","0.004","116.46","0.05","95.97","0.05","74.03","0.05","546.4","","","","","","","","","","","","","5","P -1","-P 1","2","","Barium sodium trimetaphosphate trihydrate","","- Ba H6 Na O12 P3 -","- Ba H6 Na O12 P3 -","- Ba2 H12 Na2 O24 P6 -","2","1","","Averbuch-Pouchot, M T; Durif, A","Structure du trimataphosphate de barium - sodium trihydrate","Acta Crystallographica C (39,1983-)","1987","43","","390","392","","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007159","17.073","0.008","17.029","0.008","13.554","0.006","90","","127.32","0.01","90","","3133.8","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tetralithium cyclo-tetraphosphate pentahydrate","","- H10 Li4 O17 P4 -","- H10 Li4 O17 P4 -","- H80 Li32 O136 P32 -","8","1","","Averbuch-Pouchot, M T; Durif, A","Structure of tetralithium tetrametaphosphate pentahydrate.","Acta Crystallographica C (39,1983-)","1986","42","","129","131","","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007160","7.83","0.005","7.347","0.005","10.215","0.008","104.35","0.01","101.81","0.01","94.27","0.01","552.4","","","","","","","","","","","","","3","P -1","-P 1","2","","Trilead tetraphosphate","","- O13 P4 Pb3 -","- O13 P4 Pb3 -","- O26 P8 Pb6 -","2","1","","Averbuch-Pouchot, M T; Durif, A","Structure of lead tetrapolyphosphate.","Acta Crystallographica C (39,1983-)","1987","43","","631","632","","","","","","","0.048","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007163","13.094","0.01","8.365","0.008","15.796","0.012","90","","90","","90","","1730.2","","","","","","","","","","","","","4","P n a m","-P 2c 2n","62","","Cadmium ditantalum tris(diphosphate)","","- Cd O21 P6 Ta2 -","- Cd O21 P6 Ta2 -","- Cd4 O84 P24 Ta8 -","4","0.5","","Averbuch-Pouchot, M T; Durif, A","Structure of tantalum cadmium diphosphate, Ta~2~ Cd (P~2~ O~7~)~3~","Acta Crystallographica C (39,1983-)","1987","43","","1861","1863","","","","","","","0.032","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007164","8.51","0.005","14.303","0.008","8.487","0.005","90","","96.51","0.02","90","","1026.4","","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Tetrapotassium copper bis(cyclo-triphosphate) tetrahydrate","","- Cu H8 K4 O22 P6 -","- Cu H8 K4 O22 P6 -","- Cu2 H16 K8 O44 P12 -","2","0.5","","Durif, A; Averbuch-Pouchot, M T","Structure of tetrapotassium copper cyclo-triphosphate tetrahydrate.","Acta Crystallographica C (39,1983-)","1987","43","","819","821","","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","186542","2020-10-21","18:00:00",""
"1007166","9.466","0.005","9.466","0.005","21.933","0.003","90","","90","","90","","1965.3","","","","","","","","","","","","","4","P 41","P 4w","76","","Tetracaesium cyclo-tetraphosphate tetrahydrate","","- Cs4 H8 O16 P4 -","- Cs4 H8 O16 P4 -","- Cs16 H32 O64 P16 -","4","1","","Averbuch-Pouchot, M T; Durif, A","Structure of tetracaesium tetrametaphosphate tetrahydrate.","Acta Crystallographica C (39,1983-)","1986","42","","131","133","","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007167","9.731","0.005","11.43","0.01","17.16","0.01","90","","99.45","0.05","90","","1882.7","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetrapotassium cyclo-tetraphosphate telluric acid dihydrate","","- H10 K4 O20 P4 Te -","- H10 K4 O20 P4 Te -","- H40 K16 O80 P16 Te4 -","4","0.5","","Averbuch-Pouchot, M T; Durif, A","Structure of a new adduct between telluric acid and a condensed phosphate: K~4~ P~4~ O~12~ * Te (O H)~6~ * ~2~ H~2~ O.","Acta Crystallographica C (39,1983-)","1987","43","","1245","1247","","","","","","","0.024","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007168","18.42","0.01","10.644","0.005","12.348","0.008","90","","119.76","0.05","90","","2101.7","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Trisodium tripotassium cyclo-triphosphate telluric acid","","- H6 K3 Na3 O24 P6 Te -","- H6 K3 Na3 O24 P6 Te -","- H24 K12 Na12 O96 P24 Te4 -","4","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal structure of a new adduct between telluric acid and alkali cyclo-triphosphates: Te (O H)~6~ * Na~3~ P~3~ O~9~ * K~3~ P~3~ O~9~.","Acta Crystallographica C (39,1983-)","1987","43","","1653","1655","","","","","","","0.017","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007178","20.38","0.01","12.683","0.005","7.83","0.002","90","","89.31","0.05","90","","2023.7","","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Tetracalcium tetrapotassium tris(cyclo-tetraphosphate) octahydrate","","- Ca4 H16 K4 O44 P12 -","- Ca4 H16 K4 O44 P12 -","- Ca8 H32 K8 O88 P24 -","2","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal structures of two new types of cyclo-tetraphosphates: tetracalcium tetrapotassium tris(cyclo-tetraphosphate) octahydrate and calcium disodium cyclo-tetraphosphate 5.5-hydrate","Acta Crystallographica C (39,1983-)","1988","44","","212","216","","","","","","","0.031","","","","","","","","","","","","","","","has coordinates","186542","2020-10-21","18:00:00",""
"1007179","27.88","0.1","7.536","0.005","7.378","0.005","90","","90","","90","","1550.1","","","","","","","","","","","","","5","P m a 2","P 2 -2a","28","","Calcium disodium cyclo-tetraphosphate 5.5-hydrate","","- Ca H11 Na2 O17.5 P4 -","- Ca H11 Na2 O17.5 P4 -","- Ca4 H44 Na8 O70 P16 -","4","1","","Averbuch-Pouchot, M T; Durif, A","Crystal structures of two new types of cyclo-tetraphosphates: tetracalcium tetrapotassium tris(cyclo-tetraphosphate) octahydrate and calcium disodium cyclo-tetraphosphate 5.5-hydrate","Acta Crystallographica C (39,1983-)","1988","44","","212","216","","","","","","","0.066","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007190","10.365","0.005","9.278","0.004","7.28","0.003","108.39","0.05","100.3","0.05","96.02","0.05","643.8","","","","","","","","","","","","","4","P -1","-P 1","2","","Hydroxylammonium cyclo-hexaphosphate tetrahydrate","","- H32 N6 O28 P6 -","- H32 N6 O28 P6 -","- H32 N6 O28 P6 -","1","0.5","","Durif, A; Averbuch-Pouchot, M T","Crystal chemistry of cyclo-Hexaphosphates. VIII. Structure of Hydroxylammonium cyclo-Hexaphosphate Tetrahydrate","Acta Crystallographica C (39,1983-)","1990","46","","2026","2028","","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007192","7.767","0.002","10.144","0.003","7.225","0.002","105.17","0.04","102.76","0.04","84.95","0.04","535.6","","","","","","","","","","","","","5","P -1","-P 1","2","","Dicalcium dilithium cyclo-hexaphosphate octahydrate","","- Ca2 H16 Li2 O26 P6 -","- Ca2 H16 Li2 O26 P6 -","- Ca2 H16 Li2 O26 P6 -","1","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal chemistry of cyclo-hexaphosphates. X.Structure of dicalcium dilithium cyclo-hexaphosphate octahydrate","Acta Crystallographica C (39,1983-)","1990","46","","968","970","","","","","","","0.023","","","","","","","","","","","","","","","has coordinates","186542","2020-10-21","18:00:00",""
"1007193","13.363","0.007","11.58","0.012","6.809","0.005","90","","101.87","0.05","90","","1031.1","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Disodium tetraammonium cyclo-hexaphosphate dihydrate","","- H20 N4 Na2 O20 P6 -","- H20 N4 Na2 O20 P6 -","- H40 N8 Na4 O40 P12 -","2","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal chemistry of cyclo-hexaphosphates. XV.Structures of sodium ammonium cyclo-hexaphosphate dihydrate and sodium rubidium cyclo- hexaphosphate hexahydrate","Acta Crystallographica C (39,1983-)","1991","47","","932","936","","","","","","","0.023","","","","","","","","","","","","","","","has coordinates","186518","2020-10-21","18:00:00",""
"1007194","7.532","0.003","9.752","0.003","8.73","0.003","113.92","0.04","102.29","0.04","85","0.04","572.7","","","","","","","","","","","","","5","P -1","-P 1","2","","Tetrasodium dirubidium cyclo-hexaphosphate hexahydrate","","- H12 Na4 O24 P6 Rb2 -","- H12 Na4 O24 P6 Rb2 -","- H12 Na4 O24 P6 Rb2 -","1","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal chemistry of cyclo-hexaphosphates. XV.Structures of sodium ammonium cyclo-hexaphosphate dihydrate and sodium rubidium cyclo- hexaphosphate hexahydrate","Acta Crystallographica C (39,1983-)","1991","47","","932","936","","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","186542","2020-10-21","18:00:00",""
"1007195","7.413","0.003","9.334","0.004","9.634","0.004","116.23","0.05","107.98","0.05","83.1","","568.7","","","","","","","","","","","","","5","P -1","-P 1","2","","Dicopper diammonium cyclo-hexaphosphate octahydrate","","- Cu2 H24 N2 O26 P6 -","- Cu2 H48 N2 O26 P6 -","- Cu2 H48 N2 O26 P6 -","1","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal chemistry of cyclo-hexaphosphates. XI.Structure of ammoniumcopper cyclo-hexaphosphate octahydrate","Acta Crystallographica C (39,1983-)","1991","47","","1148","1150","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007196","8.408","0.002","7.602","0.002","7.566","0.002","107.47","0.03","106.09","0.03","72.64","0.03","430.8","","","","","","","","","","","","","5","P -1","-P 1","2","","Tetrasilver dilithium cyclo-hexaphosphate dihydrate","","- Ag4 H4 Li2 O20 P6 -","- Ag4 H8 Li2 O20 P6 -","- Ag4 H8 Li2 O20 P6 -","1","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal chemistry of cyclo-hexaphosphates. XIII.Structure of silver lithium cyclo-hexaphosphate dihydrate","Acta Crystallographica C (39,1983-)","1991","47","","1150","1152","","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007197","11.222","0.008","8.077","0.006","11.731","0.009","111.11","0.02","104.66","0.02","83.25","0.02","959.2","","","","","","","","","","","","","5","P -1","-P 1","2","","Rubidium cyclo-hexaphosphate tris(hexahydrogentellurate) trihydrate","","- H26 O40 P6 Rb6 Te3 -","- H26 O40 P6 Rb6 Te3 -","- H26 O40 P6 Rb6 Te3 -","1","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal chemistry of cyclo-hexaphosphates. XVI.Structures of potassium cyclo-hexaphosphate ditellurate trihydrate and rubidium cyclo- hexaphosphate tritellurate tetrahydrate","Acta Crystallographica C (39,1983-)","1991","47","","1576","1579","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","186542","2020-10-21","18:00:00",""
"1007198","8.175","0.008","7.926","0.008","8.457","0.007","105.05","0.02","102.08","0.02","86.42","0.02","517.4","","","","","","","","","","","","","4","P -1","-P 1","2","","Dihydrazinium dihydrazinedium cyclo-hexaphosphate","","- H22 N8 O18 P6 -","- H22 N8 O18 P6 -","- H22 N8 O18 P6 -","1","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal chemistry of cyclo-hexaphosphates.XVIII.Structures of ethylammonium cyclo-hexaphosphate tetrahydrate and hydrazinium(1+) hydrazinium(2+) cyclo-hexaphosphate","Acta Crystallographica C (39,1983-)","1991","47","","1579","1583","","","","","","","0.032","","","","","","","","","","","","","","","has coordinates","186520","2020-10-21","18:00:00",""
"1007199","20.98","0.02","7.227","0.003","17.44","0.01","90","","119.56","0.03","90","","2300.1","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Barium cyclo-hexaphosphate octahydrate","","- Ba3 H16 O26 P6 -","- Ba3 H16 O26 P6 -","- Ba12 H64 O104 P24 -","4","0.5","","Rzaigui, M; Averbuch-Pouchot, M; Durif, A","Crystal chemistry of cyclo-hexaphosphates. XIX. Structure of barium cyclo-hexaphosphate octahydrate","Acta Crystallographica C (39,1983-)","1992","48","","241","243","","","","","","","0.041","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007200","17.254","0.005","7.543","0.001","23.465","0.005","90","","90","","90","","3053.9","","","","","","","","","","","","","6","C m c m","-C 2c 2","63","","Nonasilver sodium cyclo-octaphosphate bis(nitrate) tetrahydrate","","- Ag9 H8 N2 Na O34 P8 -","- Ag9 H8 N2 Na O34 P8 -","- Ag36 H32 N8 Na4 O136 P32 -","4","0.25","","Averbuch-Pouchot, M T; Durif, A","Structure of nonasilver sodium cyclooctaphosphate dinitrate tetrahydrate: Ag~9~NaP~8~O~24~(NO~3~)~2~ . 4H~2~O","Acta Crystallographica C (39,1983-)","1992","48","","1173","1176","","","","","","","0.044","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007206","7.332","0.005","7.663","0.005","14.408","0.008","90","","90","","90","","809.5","","","","","","","","","","","","","5","I 2 m m","I -2 2","44","","Disodium strontium cyclo-tetraphosphate hexahydrate","","- H12 Na2 O18 P4 Sr -","- H12 Na2 O18 P4 Sr -","- H24 Na4 O36 P8 Sr2 -","2","0.25","","Durif, A; Averbuch-Pouchot, M T; Guitel, J C","Structure of Disodium Strontium Tetrametaphosphate Hexahydrate, Sr Na~2~ P~4~ O~12~ (H~2~ O)~6~","Acta Crystallographica C (39,1983-)","1983","39","","812","813","","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","186636","2020-10-21","18:00:00",""
"1007210","15.146","0.006","11.049","0.006","12.189","0.006","117.15","0.04","109.72","0.04","90.54","0.04","1675.8","","","","","","","","","","","","","5","P -1","-P 1","2","","Ammonium cyclo-octaphosphate - telluric acid dihydrate (1/1)","","- H42 N8 O32 P8 Te -","- H42 N8 O32 P8 Te -","- H84 N16 O64 P16 Te2 -","2","1","","Averbuch-Pouchot, M - T; Durif, A","Ammonium cyclo-octaphosphate-telluric acid dihydrate adduct","Acta Crystallographica C (39,1983-)","1993","49","","361","363","","","","","","","0.031","","","","","","","","","","","","","","","has coordinates","186518","2020-10-21","18:00:00",""
"1007219","20.38","0.01","12.683","0.005","7.83","0.002","90","","89.31","","90","","2023.7","","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Tetracalcium tetrapotassium cyclo-tetraphosphate octahydrate","","- Ca4 H16 K4 O44 P12 -","- Ca4 H16 K4 O44 P12 -","- Ca8 H32 K8 O88 P24 -","2","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal Structures of Two New Types of cyclo-Tetraphosphates: Tetracalcium tetrapotassium tris(cyclo-tetraphosphate) octahydrate and Calcium disodium cyclo-tetraphosphate 5.5-hydrate","Acta Crystallographica C (39,1983-)","1988","44","","212","216","","","","","","","0.031","","","","","","","","","","","","","","","has coordinates","186542","2020-10-21","18:00:00",""
"1007248","11.549","0.005","11.549","0.005","9.114","0.005","90","","90","","120","","1052.8","","","","","","","","","","","","","4","P 3 1 c","P 3 -2c","159","","Barium tetracaesium hexakis(phosphate(V))","","- Ba Cs4 O18 P6 -","- Ba Cs4 O18 P6 -","- Ba2 Cs8 O36 P12 -","2","0.333333","","Averbuch-Pouchot, M T; Durif, A","Structure of monobarium tetracaesium polyphosphate","Acta Crystallographica C (39,1983-)","1986","42","","928","930","","","","","","","0.05","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007249","13.084","0.005","13.084","0.005","34.79999","0.02","90","","90","","120","","5159.3","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","Potassium cyclo-hexaphosphate(V) bis(hexahydrogentellurate) trihydrate","","- H18 K6 O33 P6 Te2 -","- H31 K6 O33 P6 Te2 -","- H186 K36 O198 P36 Te12 -","6","0.166667","","Averbuch-Pouchot, M T; Durif, A","Crystal chemistry of cyclo-hexaphosphates. XVI.Structures of potassium cyclo-hexaphosphate ditellurate trihydrate and rubidium cyclo- hexaphosphate tritellurate tetrahydrate","Acta Crystallographica C (39,1983-)","1991","47","","1576","1579","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1007259","11.813","0.008","7.292","0.003","20.2","0.08","90","","105.19","0.05","90","","1679.2","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetraammonium sodium triphosphate(V) tetrahydrate","","- H24 N4 Na O14 P3 -","- H24 N4 Na O14 P3 -","- H96 N16 Na4 O56 P12 -","4","0.5","","Averbuch-Pouchot, M T; Durif, A","Structure of tetraammonium monosodium triphosphate tetrahydrate","Acta Crystallographica C (39,1983-)","1985","41","","1553","1555","","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007260","20.29799","0.02","8.73","0.003","8.766","0.003","90","","109.98","0.06","90","","1459.9","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tribarium dibismuth tetrakis(phosphate(V))","","- Ba3 Bi2 O16 P4 -","- Ba3 Bi2 O16 P4 -","- Ba12 Bi8 O64 P16 -","4","0.5","","Masse, R; Durif, A","Structure of tribarium dibismuth tetrakis(phosphate)","Acta Crystallographica C (39,1983-)","1985","41","","1717","1718","","","","","","","0.038","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007261","13.524","0.008","8.362","0.005","14.39","0.008","90","","92.58","0.05","90","","1625.7","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diammonium disodium mercury bis(triphosphate(V))","","- H8 Hg N2 Na2 O18 P6 -","- H12 Hg0.9999 N2 Na2.0001 O18 P6 -","- H48 Hg3.9996 N8 Na8.0004 O72 P24 -","4","0.5","","Averbuch-Pouchot, M T; Durif, A","Structure of diammonium disodium mercury(II) trimetaphosphate","Acta Crystallographica C (39,1983-)","1986","42","","932","933","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008202","11.16","","11.16","","17.86","","90","","90","","120","","1926.4","","","","","","","","","","","","","5","R -3 :H","-R 3","148","","Hexaammonium cyclo-triphosphate telluric acid","","- H30 N6 O24 P6 Te -","- H30 N6 O24 P6 Te -","- H90 N18 O72 P18 Te3 -","3","0.166667","","Boudjada, N; Boudjada, A; Guitel, J C","Structure du Trimetaphosphate-Tellurate d'Ammonium, 2(N H~4~)~3~ P~3~ O~9~ * Te (O H)~6~","Acta Crystallographica C (39,1983-)","1983","39","","656","658","","","","","","","0.019","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1008218","15.43","0.01","5.512","0.005","13.72","0.01","90","","108.53","0.05","90","","1106.4","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Lithium potassium catena-phosphate","","- K Li O6 P2 -","- K Li O6 P2 -","- K8 Li8 O48 P16 -","8","2","","El Horr, N; Bagieu, M; Tordjman, I","Structure d'un polyphosphate mixte de lithium et de potassium, Li K (P O~3~)~2~","Acta Crystallographica C (39,1983-)","1983","39","","1597","1599","","","","","","","0.031","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008240","12.372","0.008","10.438","0.008","8.191","0.005","90","","92.32","0.05","90","","1056.9","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Mercury dipotassium dichloride dichromate","","- Cl2 Cr2 Hg K2 O7 -","- Cl2 Cr2 Hg K2 O7 -","- Cl8 Cr8 Hg4 K8 O28 -","4","1","","Averbuch-Pouchot, M T; El-Horr, N; Guitel, J C","Structures of Mercury Dichloride - Dipotassium Dichromate (1/1), Hg Cl~2~ K~2~ Cr~2~ O~7~, and Mercury Dichloride - Diammonium Dichromate (1/1), Hg Cl~2~ ((N H~4~)~2~ Cr~2~ O~7~)","Acta Crystallographica C (39,1983-)","1984","40","","725","728","","","","","","","0.042","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008241","14.891","0.005","7.604","0.005","9.62","0.006","90","","96.02","0.05","90","","1083.3","","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","Mercury diammonium dichloride dichromate","","- Cl2 Cr2 H8 Hg N2 O7 -","- Cl2 Cr2 H8 Hg N2 O7 -","- Cl8 Cr8 H32 Hg4 N8 O28 -","4","1","","Averbuch-Pouchot, M T; El-Horr, N; Guitel, J C","Structures of Mercury Dichloride - Dipotassium Dichromate (1/1), Hg Cl~2~ K~2~ Cr~2~ O~7~, and Mercury Dichloride - Diammonium Dichromate (1/1), Hg Cl~2~ ((N H~4~)~2~ Cr~2~ O~7~)","Acta Crystallographica C (39,1983-)","1984","40","","725","728","","","","","","","0.032","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008305","","","","","","","","","","","","","","","","","","","","","","","","","","2","","","","","Tin diselenide","","- Se2 Sn -","","","","","","Pałosz, B.; Gierlotka, S.; Lévy, F.","Polytypism of Sn Se~2~ Crystals Grown by Chemical Transport: Structures of Six Large-Period Polytypes of Sn Se~2~","Acta Cryst C","1985","41","","1404","1406","10.1107/s0108270185007958","","","","","","","","","","","","","","","","","","","","","","176229","2020-10-21","18:00:00",""
"1008306","","","","","","","","","","","","","","","","","","","","","","","","","","2","","","","","Tin diselenide","","- Se2 Sn -","","","","","","Pałosz, B.; Gierlotka, S.; Lévy, F.","Polytypism of Sn Se~2~ Crystals Grown by Chemical Transport: Structures of Six Large-Period Polytypes of Sn Se~2~","Acta Cryst C","1985","41","","1404","1406","10.1107/s0108270185007958","","","","","","","","","","","","","","","","","","","","","","176229","2020-10-21","18:00:00",""
"1008307","","","","","","","","","","","","","","","","","","","","","","","","","","2","","","","","Tin diselenide","","- Se2 Sn -","","","","","","Pałosz, B.; Gierlotka, S.; Lévy, F.","Polytypism of Sn Se~2~ Crystals Grown by Chemical Transport: Structures of Six Large-Period Polytypes of Sn Se~2~","Acta Cryst C","1985","41","","1404","1406","10.1107/s0108270185007958","","","","","","","","","","","","","","","","","","","","","","176229","2020-10-21","18:00:00",""
"1008308","","","","","","","","","","","","","","","","","","","","","","","","","","2","","","","","Tin diselenide","","- Se2 Sn -","","","","","","Pałosz, B.; Gierlotka, S.; Lévy, F.","Polytypism of Sn Se~2~ Crystals Grown by Chemical Transport: Structures of Six Large-Period Polytypes of Sn Se~2~","Acta Cryst C","1985","41","","1404","1406","10.1107/s0108270185007958","","","","","","","","","","","","","","","","","","","","","","176229","2020-10-21","18:00:00",""
"1008309","","","","","","","","","","","","","","","","","","","","","","","","","","2","","","","","Tin diselenide","","- Se2 Sn -","","","","","","Pałosz, B.; Gierlotka, S.; Lévy, F.","Polytypism of Sn Se~2~ Crystals Grown by Chemical Transport: Structures of Six Large-Period Polytypes of Sn Se~2~","Acta Cryst C","1985","41","","1404","1406","10.1107/s0108270185007958","","","","","","","","","","","","","","","","","","","","","","176229","2020-10-21","18:00:00",""
"1008310","","","","","","","","","","","","","","","","","","","","","","","","","","2","","","","","Tin diselenide","","- Se2 Sn -","","","","","","Pałosz, B.; Gierlotka, S.; Lévy, F.","Polytypism of Sn Se~2~ Crystals Grown by Chemical Transport: Structures of Six Large-Period Polytypes of Sn Se~2~","Acta Cryst C","1985","41","","1404","1406","10.1107/s0108270185007958","","","","","","","","","","","","","","","","","","","","","","176229","2020-10-21","18:00:00",""
"1008336","19.44","0.005","19.027","0.005","13.222","0.005","90","","90","","90","","4890.6","","","","","","","","","","","","","4","F d d 2","F 2 -2d","43","","Lithium caesium polyphosphate","","- Cs Li O6 P2 -","- Cs Li O6 P2 -","- Cs32 Li32 O192 P64 -","32","2","","El-Horr, N; Bagieu, M","Structure d'un polyphosphate mixte de lithium et de cesium: LiCs(PO~3~)~2~","Acta Crystallographica C (39,1983-)","1987","43","","603","605","","","","","","","0.042","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008368","7.279","0.002","13.984","0.008","17.071","0.004","90","","90.42","0.02","90","","1737.6","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tricaesium cyclo-triphosphate telluric acid hydrate","","- Cs3 H8 O16 P3 Te -","- Cs3 H8 O16 P3 Te -","- Cs12 H32 O64 P12 Te4 -","4","1","","Averbuch-Pouchot, M T","Structure of a new adduct between telluric acid and a condensed phosphate: (Cs~3~ P~3~ O~9~) (Te (O H)~6~ (H~2~ O)).","Acta Crystallographica C (39,1983-)","1988","44","","1166","1168","","","","","","","0.024","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008370","13.984","0.009","8.297","0.006","15.81","0.01","90","","99.11","0.01","90","","1811.2","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(ammonium) molybdenyl diphosphate","","- H8 Mo N2 O9 P2 -","- H4 Mo N2 O9 P2 -","- H32 Mo8 N16 O72 P16 -","8","1","","Averbuch-Pouchot, M T","Structure of an ammonium molybdenyl diphosphate (N H~4~)~2~ Mo O~2~ P~2~ O~7~","Acta Crystallographica C (39,1983-)","1988","44","","2046","2048","","","","","","","0.021","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008427","13.486","0.002","10.688","0.001","6.8616","0.0007","90","","90","","90","","989","","","","","","","","","","","","","4","P n 21 a","P -2ac -2n","33","","Caesium titanium oxide arsenate","","- As Cs O5 Ti -","- As Cs O5 Ti -","- As8 Cs8 O40 Ti8 -","8","2","","Protas, J; Marnier, G; Boulanger, B; Menaert, B","Structure cristalline de Cs Ti O (As O~4~)","Acta Crystallographica C (39,1983-)","1989","45","","1123","1125","","","","","","","0.027","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008428","15.753","0.006","15.753","0.006","15.753","0.006","90","","90","","90","","3909.2","","","","","","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","Potassium cyclo-hexaphosphate","","- K6 O18 P6 -","- K6 O18 P6 -","- K48 O144 P48 -","8","0.333333","","Averbuch-Pouchot, M T","Crystal chemistry of cyclo-hexaphosphates. I. Structure of anhydrous potassium cyclo-hexaphosphate","Acta Crystallographica C (39,1983-)","1989","45","","1273","1275","","","","","","","0.023","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008433","7.286","0.005","9.761","0.007","10.026","0.006","118.31","0.05","110.62","0.05","86.27","0.05","583","","","","","","","","","","","","","5","P -1","-P 1","2","","Dilithium dimanganese cyclo-hexaphosphate decahydrate","","- H20 Li2 Mn2 O28 P6 -","- H40 Li2 Mn2 O28 P6 -","- H40 Li2 Mn2 O28 P6 -","1","0.5","","Averbuch-Pouchot, M T","Crystal chemistry of cyclo-hexaphosphates. III. Structure of dilithium dimanganese cyclo-hexaphosphate decahydrate","Acta Crystallographica C (39,1983-)","1989","45","","1856","1858","","","","","","","0.027","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008454","12.821","","12.537","0.006","7.029","0.002","90","","90","","90","","1129.8","","","","","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","Dicalcium diammonium cyclo-hexaphosphate hexahydrate","","- Ca2 H20 N2 O24 P6 -","- Ca2 H20 N2 O24 P6 -","- Ca4 H40 N4 O48 P12 -","2","0.5","","Averbuch-Pouchot, M T","Crystal chemistry of cyclo-Hexaphosphates. XII. Structure of Ammonium Calcium cyclo-Hexaphosphate Hexahydrate","Acta Crystallographica C (39,1983-)","1990","46","","2005","2007","","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","186518","2020-10-21","18:00:00",""
"1008460","3.7541","0.0001","5.7442","0.0001","11.3019","0.0002","90","","90","","90","","243.7","","","","","","","","","","","","","4","I m m m","-I 2 2","71","","Dierbium barium catena-niccolate","","- Ba Er2 Ni O5 -","- Ba Er2 Ni O4.99 -","- Ba2 Er4 Ni2 O9.98 -","2","0.125","","Alonso, J A; Amador, J; Rasines, I; Soubeyroux, J L","Er~2~BaNiO~5~: Structure refinement using neutron powder diffraction data","Acta Crystallographica C (39,1983-)","1991","47","","249","251","","","","","","","0.075","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008480","7.709","0.001","11.028","0.006","9.231","0.002","108.25","0.05","110.06","0.05","79.77","0.05","697.9","","","","","","","","","","","","","5","P -1","-P 1","2","","Dicadmium disodium cyclo-hexaphosphate 14-hydrate","","- Cd2 H28 Na2 O32 P6 -","- Cd2 H56 Na2 O32 P6 -","- Cd2 H56 Na2 O32 P6 -","1","0.5","","Averbuch-Pouchot, M T","Crystal chemistry of cyclo-hexaphosphates. V. Structure of cadmium sodium cyclo-hexaphosphate tetradecahydrate","Acta Crystallographica C (39,1983-)","1990","46","","10","13","","","","","","","0.019","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008494","12.062","0.001","14.679","0.001","11.816","0.001","90","","97.31","0.01","90","","2075.1","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Tetracarbonylbis(pentacarbonylrhenio)iron","","- C14 Fe O14 Re2 -","- C14 Fe O14 Re2 -","- C56 Fe4 O56 Re8 -","4","0.5","","Agron, P A; Ellison, R D; Levy, H A","Structure of iron dirhenium tetradecacarbonyl, (Re(CO)~5~Fe(CO)~4~Re(CO)~5~)","Acta Crystallographica C (39,1983-)","1991","47","","913","916","","","","","","","0.049","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008496","19.052","0.01","19.052","0.01","19.052","0.01","90","","90","","90","","6915.5","","","","","","","","","","","","","4","P -4 3 n","P -4n 2 3","218","","Dichromium cyclo-hexaphosphate 21-water","","- Cr2 H42 O39 P6 -","- Cr2 H75.75 O39 P6 -","- Cr16 H606 O312 P48 -","8","0.333333","","Bagieu-Bacher, M; Averbuch-Pouchot, M T; Rzaigui, M","Crystal chemistry of cyclo-hexaphosphates.XVII.Structure of chromium cyclo-hexaphosphate henicosahydrate","Acta Crystallographica C (39,1983-)","1991","47","","1364","1366","","","","","","","0.053","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008497","12.45","0.008","12.755","0.008","8.154","0.006","90","","90","","90","","1294.9","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Ammonium cyclo-trithiohexaoxotriphosphate","","- H12 N3 O6 P3 S3 -","- H12 N3 O6 P3 S3 -","- H48 N12 O24 P12 S12 -","4","0.5","","Meisel, M; Wolf, G U; Averbuch-Pouchot, M T","Structure of ammonium trithio-cyclo-triphosphate","Acta Crystallographica C (39,1983-)","1991","47","","1368","1370","","","","","","","0.041","","","","","","","","","","","","","","","has coordinates","186518","2020-10-21","18:00:00",""
"1008552","7.275","0.002","9.452","0.001","13.569","0.002","90","","90","","90","","933","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Dicaesium oxotitanium diphosphate","","- Cs2 O8 P2 Ti -","- Cs2 O8 P2 Ti -","- Cs8 O32 P8 Ti4 -","4","1","","Protas, J; Menaert, B; Marnier, G; Boulanger, B","Structure cristalline de Cs~2~TiO(P~2~O~7~)","Acta Crystallographica C (39,1983-)","1991","47","","698","701","","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008577","8.9018","0.0002","8.9018","0.0002","22.2021","0.0006","90","","90","","120","","1523.6","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Copper(I) dizirconium phosphate","","- Cu O12 P3 Zr2 -","- Cu1.0002 O12 P3 Zr2 -","- Cu6.0012 O72 P18 Zr12 -","6","0.166667","","Bussereau, I; Belkhiria, M S; Gravereau, P; Boireau, A; Soubeyroux, J L; Olazcuaga, R; Le Flem, G","Structure of CuZr~2~(PO~4~)~3~ by X-ray and neutron powder diffraction","Acta Crystallographica C (39,1983-)","1992","48","","1741","1744","","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1008578","8.892","0.001","8.892","0.001","22.19","0.001","90","","90","","120","","1519.5","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Copper(I) dizirconium phosphate","","- Cu O12 P3 Zr2 -","- Cu1.0002 O12 P3 Zr2 -","- Cu6.0012 O72 P18 Zr12 -","6","0.166667","","Bussereau, I; Belkhiria, M S; Gravereau, P; Boireau, A; Soubeyroux, J L; Olazcuaga, R; Le Flem, G","Structure of CuZr~2~(PO~4~)~3~ by X-ray and neutron powder diffraction","Acta Crystallographica C (39,1983-)","1992","48","","1741","1744","","","","","","","0.056","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1008807","12.555","0.002","6.258","0.002","10.554","0.002","90","","90","","90","","829.2","","","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","Sodium potassium oxotitanium phosphate(V) (0.99/0.01/1/1)","","- K0.008 Na0.992 O5 P Ti -","- K0.008 Na0.992 O5 P Ti -","- K0.064 Na7.936 O40 P8 Ti8 -","8","2","","Dahaoui, S; Hansen, N K; Menaert, B","Na Ti O P O4 and K Ti O P O4 at 110 K","Acta Crystallographica C (39,1983-)","1997","53","","1173","1176","","","","","","","0.013","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008827","9.3938","0.0008","9.3938","0.0008","6.9013","0.0005","90","","90","","120","","527.4","","","","","","","","","","","","exchanged) - synthetic","6","P 63/m","-P 6c","176","","Calcium neodymium phosphate(V) silicate fluoride oxide (9/1/5/1/1.5/0.25)","Britholite (N","- Ca9 F1.5 Nd O24.25 P5 Si -","- Ca9 F1.54 Nd O24.28 P4.9998 Si1.0002 -","- Ca9 F1.54 Nd O24.28 P4.9998 Si1.0002 -","1","0.0833333","","Boyer, L; Savariault, J-M; Carpena, J; Lacout, J-L","A neodymium-substituted britholite compound","Acta Crystallographica C (39,1983-)","1998","54","","1057","1057","","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008828","7.1486","0.0014","11.163","0.002","10.145","0.002","90","","90","","90","","809.6","0.3","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","dilead(II) diiron(III) digermanium(IV) oxide","","- Fe1.78 Ge2.11 Mg0.11 O9 Pb2 -","- Fe1.786 Ge2.107 Mg0.107 O9 Pb2 -","- Fe7.144 Ge8.428 Mg0.428 O36 Pb8 -","4","0.5","TA1174","Barbier, J; Levy, D","Pb~2~Fe~2~Ge~2~O~9~, the Germanate Analogue of the Silicate Mineral Melanotekite","Acta Crystallographica Section C","1998","54","1","2","5","10.1107/S0108270197012687","","","0.56086","AgKα","","0.032","0.0317","","","","0.0633","","","","0.926","0.926","0.868","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008829","8.8978","0.0003","13.7057","0.0004","7.5532","0.0002","90","","115.867","0.001","90","","828.8","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Potassium iron trigermanate","","- Fe Ge3 K O8 -","- Fe Ge3 K O8 -","- Fe4 Ge12 K4 O32 -","4","0.5","","Levy, D; Barbier, J","A sanidine feldspar analogue: K Fe Ge3 O8","Acta Crystallographica C (39,1983-)","1998","54","8","1","1","","","","","","","0.053","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008850","15.445","0.01","15.445","0.01","7.553","0.007","90","","90","","120","","1560.4","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Hexaammonium cyclo-hexaphosphate(V) hydrate","","- H26 N6 O19 P6 -","- H26 N6 O19 P6 -","- H78 N18 O57 P18 -","3","0.166667","","Averbuch-Pouchot, M T","Structure of ammonium cyclo-hexaphosphate monohydrate","Acta Crystallographica C (39,1983-)","1989","45","","539","540","","","","","","","0.018","","","","","","","","","","","","","","","has coordinates","200452","2020-10-21","18:00:00",""
"1008854","15.172","0.005","15.172","0.005","13.994","0.005","90","","90","","120","","2789.7","","","","","","","","","","","","","5","R -3 :H","-R 3","148","","Trisilver triammonium cyclo-hexaphosphate(V) hydrate","","- Ag3 H14 N3 O19 P6 -","- Ag3 H26.3335 N3 O19 P6 -","- Ag18 H158.001 N18 O114 P36 -","6","0.333333","","Averbuch-Pouchot, M T","Crystal chemistry of cyclo-hexaphosphates. XIV.Structure of silver ammonium cyclo-hexaphosphate monohydrate","Acta Crystallographica C (39,1983-)","1991","47","","930","932","","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008945","9.82","0.008","9.973","0.006","17.87","0.01","90.14","0.02","90.01","0.01","119.46","0.04","1523.8","","","","","","","","","","","","","4","P -1","-P 1","2","","Thallium phosphate hydrate *","","- H23.5 O36.5 P8 Tl3.5 -","- H21.25 O36.5 P8 Tl3.5 -","- H42.5 O73 P16 Tl7 -","2","1","","Chiadmi, M; Vicat, J; Tran Qui, D; Boudjada, A","Structure de l'orthophosphate acide de thallium a valence mixte, (Tl3 (Tl0.5 (H3 O)0.5) H14 (P O4)8) (H2 O)4","Acta Crystallographica C (39,1983-)","1985","41","","811","814","","","","","","","0.07","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008946","13.753","0.005","13.818","0.005","11.865","0.005","90","","90.34","0.05","90","","2254.8","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Lithium potassium bis(catena-phosphate(V))","","- K Li O6 P2 -","- K Li O6 P2 -","- K16 Li16 O96 P32 -","16","2","","El Horr, N; Bagieu, M","Structure de la forme de haute temperature du polyphosphate de lithium et de potassium: Li K (P O3)2","Acta Crystallographica C (39,1983-)","1985","41","","1157","1159","","","","","","","0.023","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100044","3.8227","0.0001","3.8227","0.0001","6.2607","0.0001","90","","90","","120","","79.2","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Zinc sulfide","Wurtzite","- S Zn -","- S Zn -","- S2 Zn2 -","2","0.166667","","Kisi, E. H.; Elcombe, M. M.","u parameters for the wurtzite structure of ZnS and ZnO using powder neutron diffraction","Acta Crystallographica Section C","1989","45","12","1867","1870","10.1107/S0108270189004269","","","","","","0.0575","","","","","","","","","","","","","","","has coordinates","278161","2022-09-26","15:31:04",""
"1100078","9.324","0.002","14.461","0.004","6.862","0.001","90","","90","","90","","925.2","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Magnesium thiosulfate hexahydrate","","- H12 Mg O9 S2 -","- H12 Mg O9 S2 -","- H48 Mg4 O36 S8 -","4","0.5","","Elerman, Y; Bats, J W; Fuess, H","Deformation Density in Complex Anions. IV. Magnesium Thiosulfate Hexahydrate, Mg S~2~ O~3~ * 6H2 O","Acta Crystallographica C (39,1983-)","1983","39","","515","518","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100079","9.324","0.002","14.461","0.004","6.862","0.001","90","","90","","90","","925.2","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Magnesium thiosulfate hexahydrate","","- H12 Mg O9 S2 -","- H12 Mg O9 S2 -","- H48 Mg4 O36 S8 -","4","0.5","","Elerman, Y; Bats, J W; Fuess, H","Deformation Density in Complex Anions. IV. Magnesium Thiosulfate Hexahydrate, Mg S~2~ O~3~ * 6H2 O","Acta Crystallographica C (39,1983-)","1983","39","","515","518","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100907","10.7589","0.0009","17.8696","0.0017","22.667","0.0018","90","","90","","90","","4357.9","0.7","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S)-3-(4-hydroxyphenyl)-2-(1-oxoisoindolin-2-yl)propanoic acidd","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C204 H180 N12 O48 -","12","3","","Brady, Fiona; Gallagher, John F.","Intermolecular O-H...O hydrogen bonding in the three independent molecules of (2S)-3-(4-hydroxyphenyl)-2-(1-oxoisoindolin-2-yl)propanoic acid","Acta Crystallographica, Section C","2000","56","","1407","1410","10.1107/S010827010001163X","","","0.7107","MoKα","","0.086","0.045","","","","0.116","","","","","","1.02","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100908","15.922","0.002","5.7331","0.0008","21.341","0.003","90","","91.097","0.011","90","","1947.6","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Aqua-bis(trans-2-butenoate)- bis(pyridine)copper(II)","","- C18 H22 Cu N2 O5 -","- C18 H22 Cu N2 O5 -","- C72 H88 Cu4 N8 O20 -","4","0.5","","Baggio, Ricardo; Foxman, Bruce; Garland, Maria Teresa; Perec, Mireille; Shang, Wen","Aquabis(crotonato)bis(pyridine)copper(II)","Acta Crystallographica Section C","2000","56","11","e505","e506","10.1107/S0108270100013937","","","0.71073","MoKα","","0.041","0.031","","","","0.082","","","","","","1.068","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"1100910","7.496","0.001","6.308","0.001","10.125","0.002","90","","100.11","0.01","90","","471.32","0.13","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","Bismuth(V)iron(III) oxophosphate","Bismuth(V) iron(III) tris(phosphate) oxide","","- Bi0.4 Fe3 O13 P3 -","- Bi0.4 Fe3 O13 P3 -","- Bi0.8 Fe6 O26 P6 -","2","0.5","","Benabad, Aicha; Bakhous, Karima; Cherkaoui, Fatima; Holt, Elizabeth M.","Bismuth(V) iron(III) tris(phosphate) oxide","Acta Crystallographica, Section C","2000","56","","1292","1293","10.1107/S010827010000977X","","","0.71073","MoKα","","0.099","0.058","","","","0.128","","","","","","0.835","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1100911","6.207","0.003","11.915","0.005","15.583","0.006","90","","90","","90","","1152.5","0.9","293","2","293","2","","","","","","","","6","P n n m","-P 2 2n","58","Sodium nitroprusside, deuterated","disodium pentacyanonitrosylferrate(III) bis(dideuterium oxide)","","- C5 D4 Fe N6 Na2 O3 -","- C5 D4 Fe N6 Na2 O3 -","- C20 D16 Fe4 N24 Na8 O12 -","4","0.5","","Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N.","Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction","Acta Crystallographica, Section C","2000","56","","1289","1291","10.1107/S0108270100008763","","","0.71073","MoKα","","0.02","0.019","","","","0.051","","","","","","1.227","","","","has coordinates","277833","2022-09-14","15:22:10",""
"1100912","6.124","0.002","11.837","0.005","15.547","0.006","90","","90","","90","","1127","0.7","11","1","11","2","","","","","","","","6","P n n m","-P 2 2n","58","Sodium nitroprusside, deuterated","disodium pentacyanonitrosylferrate(III) bis(dideuterium oxide)","","- C5 D4 Fe N6 Na2 O3 -","- C5 D4 Fe N6 Na2 O3 -","- C20 D16 Fe4 N24 Na8 O12 -","4","0.5","","Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N.","Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction","Acta Crystallographica, Section C","2000","56","","1289","1291","10.1107/S0108270100008763","","","0.71073","MoKα","","0.025","0.02","","","","0.054","","","","","","1.081","","","","has coordinates","277833","2022-09-14","15:22:10",""
"1100913","6.124","0.002","11.837","0.005","15.547","0.006","90","","90","","90","","1127","0.7","11","","15","","","","","","","","","7","P n n m","-P 2 2n","58","Sodium nitroprusside, deuterated","disodium pentacyanonitrosylferrate(III) bis(dideuterium oxide)","","- C5 H1.1 D2.9 Fe N6 Na2 O3 -","- C5 H1.102 D2.898 Fe N6 Na2 O3 -","- C20 H4.408 D11.592 Fe4 N24 Na8 O12 -","4","0.5","","Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N.","Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction","Acta Crystallographica, Section C","2000","56","","1289","1291","10.1107/S0108270100008763","","neutron","","pulsedneutron","","","0.058","","","0.051","","","","3.75","","","","","","","has coordinates","277831","2022-09-14","14:31:32",""
"1100916","5.5462","0.0003","5.6028","0.0004","15.6365","0.0013","90","","90","","90","","485.9","0.06","292","1","","","","","","","","","","3","P b c m","-P 2c 2b","57","","silver niobate","","- Ag Nb O3 -","- Ag Nb O3 -","- Ag8 Nb8 O24 -","8","1","","Fabry, Jan; Zikmund, Zdenek; Kania, Antoni; Petricek, Vaclav","Structural study of AgNbO~3~ at room temperature","Acta Crystallographica, Section C","2000","56","","916","918","10.1107/S0108270100006806","","","0.71073","MoKα","","","0.034","","","","0.053","","","2.69","","","2.84","","","","has coordinates","134621","2020-10-21","18:00:00",""
"1200001","15.9407","0.0015","9.1737","0.001","19.015","0.002","90","","90","","90","","2780.7","0.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","8,9-Dimethoxy-10b-methyl-1-oxo-6,10b-dihydro-5H- thiazolo[2,3-a]isoquinolin-3-one","","- C14 H17 N O4 S -","- C14 H17 N O4 S -","- C112 H136 N8 O32 S8 -","8","1","","Gzella, Andrzej; Rozwadowska, Maria D.; Sulima, Agnieszka","Two dihydro-5H-thiazolinono[2,3-a]isoquinoline S-oxides","Acta Crystallographica, Section C","2001","57","12","1454","1456","10.1107/S0108270101016638","","","1.54178","CuKα","","0.0404","0.0327","","","0.0939","0.098","","","","","","1.064","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2000000","8.243","0.002","10.368","0.003","11.497","0.003","111.64","0.01","107.94","0.01","93.45","0.01","851.974","","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H44 Co Nd2 O26 -","- C16 H44 Co Nd2 O26 -","- C16 H44 Co Nd2 O26 -","1","0.5","PA0193","A. Gonzalez; A. Beltran; A. le Bail","Structure of the decahydrated octaacetate of dineodymium(III) and cobalt(II)","Acta Crystallographica Section C","1991","47","","1624","1627","10.1107/S0108270191002184","","","","","","","0.024","","","0.024","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:42",""
"2000007","7.257","0.003","14.474","0.006","19.88","0.01","90","","103.38","0.04","90","","2031.5","1.6","","","250","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(±)-Methyltrachelogenin","3,4-Bis[(3,4-dimethoxyphenyl)methyl]-3-hydoxydihydro-2(3H)-furanone","","- C22 H26 O7 -","- C22 H26 O7 -","- C88 H104 O28 -","4","1","PA0040","K. Khamlach; R. Dhal; E. Brown; M. Leblanc; G. Ferey","Room-temperature structure of (±)-methyltrachelogenin","Acta Crystallogr.,Sect.C:Cryst.Struct.Commun.","1989","45","","1746","1748","10.1107/S0108270189004403","","","","","","","0.051","","","0.051","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000109","17.863","0.015","15.317","0.013","13.109","0.01","90","","90","","90","","3586.72","","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","strontium ethylenediammonium cyclo-tetraphosphate hydrate","","- C2 H20 N2 O17 P4 Sr -","- C2 H20 N2 O17 P4 Sr -","- C16 H160 N16 O136 P32 Sr8 -","8","1","","M. Bagieu-Beucher; A. Durif; J. C. Guitel","Structure of a strontium ethylenediammonium cyclo-tetraphosphate hydrate","Acta Crystallogr.,Sect.C:Cryst.Struct.Commun.","1988","44","","2063","2065","10.1107/S0108270188008479","","","","","","","0.034","","","0.034","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000136","16.42","0.005","8.545","0.002","19.001","0.004","90","","90.3","0.01","90","","2666","1.2","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C11 H12 Cl2 Cu N2 O3 -","- C11 H12 Cl2 Cu N2 O3 -","- C88 H96 Cl16 Cu8 N16 O24 -","8","2","MU0245","Koman, M.; Baran, P.; Valigura, D.","Structure of (2,2'-bipyridine <i>N</i>,<i>N</i>'-dioxide)dichloro(methanol)copper(II), [Cu(bpyO~2~)(MeOH)Cl~2~]","Acta Crystallographica Section C","1991","47","12","2529","2531","10.1107/S0108270191007424","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000137","11.341","0.001","16.551","0.001","16.429","0.001","90","","92.11","0.006","90","","3081.7","0.4","","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","","","","","- C20 H20 Co3 I In N O12 -","- C20 H20 Co3 I In N O12 -","- C80 H80 Co12 I4 In4 N4 O48 -","4","1","MU0266","Clarkson, L. M.; Farrugia, L. J.; Norman, N. C.","Structure of [Et~4~N][InI{Co(CO)~4~}~3~]","Acta Crystallographica Section C","1991","47","12","2525","2526","10.1107/S0108270191007795","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000138","9.2","0.001","8.658","0.001","12.654","0.001","90","","98.82","0.01","90","","996.02","0.18","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C16 H18 N8 Ni O6 -","- C16 H18 N8 Ni O6 -","- C32 H36 N16 Ni2 O12 -","2","0.5","AB0218","Ciunik, Z.; Wolny, J. A.; Rudolf, M. F.","Structure of bis(1-ethyl-3-<i>p</i>-nitrophenyltriazene 1-oxide)nickel(II)","Acta Crystallographica Section C","1991","47","12","2539","2541","10.1107/S0108270191006613","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000139","17.992","0.002","10.612","0.001","9.373","0.001","90","","94.22","0.02","90","","1784.7","0.3","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","","","","","- C16 H12 As F6 O4 S2 -","- C20 H20 As F12 O4 S2 -","- C80 H80 As4 F48 O16 S8 -","4","0.5","AB0221","Noreland, J.; Olovsson, G.; Olovsson, I.","Structure of the organic semiconducting radical cation salt [2,3;7,8-bis(ethylenedioxy)thianthrene] hexafluoroarsenate","Acta Crystallographica Section C","1991","47","12","2542","2545","10.1107/S0108270191007849","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000140","10.973","0.001","11.875","0.001","14.211","0.001","108.03","0.01","105.41","0.01","100.92","0.01","1621.3","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C37 H47 N4 Rh -","- C37 H47 N4 Rh -","- C74 H94 N8 Rh2 -","2","1","AS0498","Whang, D.; Kim, K.","Structure of a new form of octaethylporphyrinato(methyl)rhodium(III)","Acta Crystallographica Section C","1991","47","12","2547","2550","10.1107/S0108270191008053","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","278247","2022-09-28","15:09:31",""
"2000141","6.455","0.009","19.99","0.006","16.43","0.01","90","","101.4","1","90","","2078","8","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C18 H28 N4 S Se2 -","- C18 H28 N4 S Se2 -","- C72 H112 N16 S4 Se8 -","4","1","HU0351","Billing, D. G.; Boeyens, J. C. A.; Denner, L.; Hellyar, M. D.; Lai, L.-L.; Matthee, A. J.; Reid, D. H.","Structure of 2,3-dicyclohexyl-6,7-dihydro-5<i>H</i>-2aλ^4^-thia-2,3,4a,7a-tetraazacyclopent[<i>cd</i>]indene-1(2<i>H</i>),4(2<i>H</i>)-diselone","Acta Crystallographica Section C","1991","47","12","2564","2567","10.1107/S0108270191004262","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000142","5.163","0.002","23.472","0.013","5.458","0.003","90","","97.08","0.04","90","","656.4","0.6","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H8 N2 O2 -","- C5 H8 N2 O2 -","- C20 H32 N8 O8 -","4","1","LI0070","Fawcett, S. M.; Sawyer, L.; Blake, A. J.","Structure of β-ammoniumpropionitrile hemifumarate","Acta Crystallographica Section C","1991","47","12","2569","2572","10.1107/S0108270191004420","","","1.54179","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000143","7.1026","0.0009","9.404","0.002","21.372","0.002","90","","108.246","0.009","90","","1355.7","0.4","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C12 H10 N6 O5 -","- C12 H10 N6 O5 -","- C48 H40 N24 O20 -","4","1","HE0016","Peters, D. A.; Beddoes, R. L.; Allway, P. A.; Joule, J. A.","Structure of 3-methoxypyrazine-2-carbaldehyde 2,4-dinitrophenylhydrazone","Acta Crystallographica Section C","1991","47","12","2588","2591","10.1107/S0108270191005942","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000144","30.638","0.006","6.234","0.002","15.262","0.003","90","","93.95","0.02","90","","2908.1","1.2","","","","","","","","","","","","4","C 1 2 1","C 2y","","","","","- C32 H38 N2 O5 -","- C32 H38 N2 O5 -","- C128 H152 N8 O20 -","4","1","CR0326","Czerwinski, E. W.","Structure of cortivazol, 11β,17α,21-trihydroxy-6,16α-dimethyl-2'-phenyl-2'<i>H</i>-pregna-2,4,6-trieno[3,2-<i>c</i>]pyrazol-20-one 21-acetate","Acta Crystallographica Section C","1991","47","12","2598","2603","10.1107/S0108270191006200","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000145","26.331","0.002","9.472","0.001","8.311","0.001","90","","92.5","0.01","90","","2070.9","0.4","","","","","","","","","","","","5","C 1 2 1","C 2y","","","","","- C20 H22 Br2 N2 O4 -","- C20 H22 Br2 N2 O4 -","- C80 H88 Br8 N8 O16 -","4","1","HA0043","Mackay, M. F.; Sengupta, S.; Lacey, E.; Burden, P.","Structures of colchicine analogues. IV. An aminodibromoallocolchicine, C~20~H~22~Br~2~N~2~O~4~","Acta Crystallographica Section C","1991","47","12","2615","2618","10.1107/S0108270191006534","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000146","4.301","0.001","22.832","0.003","16.531","0.002","90","","95.09","0.01","90","","1616.9","0.5","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C18 H15 Cl O6 -","- C18 H15 Cl O6 -","- C72 H60 Cl4 O24 -","4","1","HA0068","Blaser, D.; Stoeckli-Evans, H.","Structure of pannarin: a natural depsidone","Acta Crystallographica Section C","1991","47","12","2624","2626","10.1107/S010827019100776X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000147","11.219","0.008","12.136","0.007","12.324","0.007","90","","90","","90","","1678","1.8","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C14 H19 N3 O7 -","- C14 H19 N3 O7 -","- C56 H76 N12 O28 -","4","1","HA0047","Van Meervelt, L.","Structure of 3',5'-di-<i>O</i>-acetyl-<i>N</i>^4^-methoxycytosine","Acta Crystallographica Section C","1991","47","12","2635","2637","10.1107/S0108270191007187","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000148","8.021","0.001","9.952","0.002","7.995","0.002","103.05","0.02","104.37","0.01","90.08","0.01","601.2","0.2","","","","","","","","","","","","2","P -1","-P 1","2","","","","- I4 Te4 -","- I4 Te4 -","- I8 Te8 -","2","1","HE0011","Cai, G.-L.; Liu, S.-X.; Huang, J.-L.","High-temperature synthesis and structure redetermination of Te~4~I~4~","Acta Crystallographica Section C","1991","47","12","2642","2644","10.1107/S0108270191005656","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000149","9.087","0.003","9.087","0.003","9.087","0.003","115.73","0.03","115.73","0.03","115.73","0.03","390.6","0.8","","","","","","","","","","","","4","R -3 :R","-P 3*","","","","","- C Ag N O -","- C Ag N O -","- C6 Ag6 N6 O6 -","6","1","CR0363","Britton, D.","A redetermination of the trigonal silver fulminate structure","Acta Crystallographica Section C","1991","47","12","2646","2647","10.1107/S0108270191008855","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000150","8.966","0.002","14.552","0.005","13.085","0.004","90","","90","","90","","1707.2","0.9","","","","","","","","","","","","5","P n a 21","P 2c -2n","","","","","- C19 H15 N S Sn -","- C19 H15 N S Sn -","- C76 H60 N4 S4 Sn4 -","4","1","AS0502","Khoo, L. E.; Chen, X.-M.; Mak, T. C. W.","Structure of a new form of triphenyltin(IV) isothiocyanate","Acta Crystallographica Section C","1991","47","12","2647","2649","10.1107/S0108270191007710","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000151","10.188","0.008","11.202","0.009","9.22","0.005","99.92","0.06","113.39","0.05","68.31","0.07","897","1.2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C36 H62 Li2 O4 -","- C36 H62 Li2 O4 -","- C36 H62 Li2 O4 -","1","0.5","MU0264","Kociok-Köhn, G.; Pickardt, J.; Schumann, H.","Structure of dimeric lithium 2,6-di-<i>tert</i>-butylphenoxide–diethyl ether (1/1)","Acta Crystallographica Section C","1991","47","12","2649","2651","10.1107/S0108270191007783","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000152","8.379","0.001","8.379","0.001","15.832","0.004","90","","90","","90","","1111.5","0.3","","","","","","","","","","","","6","P n n m","-P 2 2n","","","","","- C20 H16 Cu F6 N2 O4 -","- C40 Cu2 F24 N4 O8 -","- C40 Cu2 F24 N4 O8 -","1","0.125","LI0072","Yu, K.-B.; Gou, S.-H.; You, X.-Z.; Xu, Z.","Structure of <i>catena</i>-poly{bis(1,1,1-trifluoro-2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')copper-μ-[(4,4'-bipyridine)-κ<i>N</i>:κ<i>N</i>']}","Acta Crystallographica Section C","1991","47","12","2653","2654","10.1107/S0108270191007928","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000153","5.726","0.001","12.302","0.002","17.01","0.002","90","","97.92","0.01","90","","1186.8","0.3","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C2 H17 N Ni O12 S -","- C2 H17 N Ni O12 S -","- C8 H68 N4 Ni4 O48 S4 -","4","1","AB0219","Peterková, J.; Podlahová, J.; Loub, J.; Mička, Z.","Structure of pentaaqua(glycine)nickel(II) sulfate monohydrate","Acta Crystallographica Section C","1991","47","12","2664","2666","10.1107/S0108270191006625","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","190730","2020-10-21","18:00:00",""
"2000154","14.941","0.005","7.05","0.001","24.832","0.004","90","","90.48","0.02","90","","2615.6","1","","","","","","","","","","","","6","A 1 2/a 1","","","","","","- C22 H26 N4 O2 P2 S4 -","- C22 H26 N4 O2 P2 S4 -","- C88 H104 N16 O8 P8 S16 -","4","0.5","AB0216","Wang, J.-L.; Sun, M.; Miao, F. M.; Chen, Q.-J.; Jin, S.-J.","Structure of 6,13-bis(butylthio)-5,12-dioxa-6,13-dithioxo-6a,7,13a,14-tetraaza-6,13-diphosphadibenz[<i>a</i>,<i>h</i>]anthracene","Acta Crystallographica Section C","1991","47","12","2676","2677","10.1107/S010827019100639X","","","0.71073","Mo","","","","","","","","","","","","","","","","warnings","has coordinates","249446","2020-10-21","18:00:00",""
"2000155","8.717","0.002","6.927","0.001","10.95","0.002","90","","113.01","0.02","90","","608.6","0.2","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","(11aS)-1,2,3,10,11,11a-Hexahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11-dione dihydrate","","- C12 H16 N2 O4 -","- C12 H16 N2 O4 -","- C24 H32 N4 O8 -","2","1","LI0076","Neidle, S.; Webster, G. D.; Jones, G. B.; Thurston, D. E.","Structures of two DNA minor-groove binders, based on pyrrolo[2,1-<i>c</i>][1,4]benzodiazepines","Acta Crystallographica Section C","1991","47","12","2678","2680","10.1107/S0108270191005966","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000156","6.633","0.001","13.435","0.002","19.246","0.002","90","","90","","90","","1715.1","0.4","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","(2R,11aS)-2,8-Diacetoxy-7-methoxy-1,2,3,10,11,11a-hexahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11-dione","","- C17 H18 N2 O7 -","- C17 H18 N2 O7 -","- C68 H72 N8 O28 -","4","1","LI0076","Neidle, S.; Webster, G. D.; Jones, G. B.; Thurston, D. E.","Structures of two DNA minor-groove binders, based on pyrrolo[2,1-<i>c</i>][1,4]benzodiazepines","Acta Crystallographica Section C","1991","47","12","2678","2680","10.1107/S0108270191005966","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","205891","2020-10-21","18:00:00",""
"2000157","27.89","0.02","6.327","0.002","22.04","0.01","90","","114.65","0.04","90","","3535","3","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C8 H13 N O3 -","- C8 H13 N O3 -","- C128 H208 N16 O48 -","16","2","LI0082","Michael, J. P.; Maqutu, T. L.; Denner, L.","Structure of (±)-<i>exo</i>-6-methyl-<i>endo</i>-6-nitrobicyclo[2.2.1]heptan-<i>exo</i>-2-ol","Acta Crystallographica Section C","1991","47","12","2680","2682","10.1107/S010827019100793X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","296843","2024-12-11","14:15:24",""
"2000158","21.713","0.005","13.524","0.004","7.259","0.002","90","","95.2","0.02","90","","2122.8","1","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C29 H21 N O -","- C29 H21 N O -","- C116 H84 N4 O4 -","4","1","AS0496","Mori, Y.; Maeda, K.","2,4,4,6-Tetraphenyl-3(4<i>H</i>)-pyridinone","Acta Crystallographica Section C","1991","47","12","2682","2683","10.1107/S0108270191007485","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000159","9.524","0.001","11.8187","0.0008","12.615","0.001","66.512","0.007","83.321","0.009","88.758","0.008","1293","0.2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H28 N2 O10 -","- C26 H28 N2 O10 -","- C52 H56 N4 O20 -","2","1","CR0348","Ammon, H. L.; DeShong, P.; Simpson, D.","Structure of a lactone, 2,4,6-trideoxy-4,6-dimethyl-2-(oxopropyl)-7-<i>O</i>-(phenylmethyl)-<small>L</small>-<i>glycero</i>-<small>D</small>-<i>manno</i>-heptono-1,5-lactone 3-(3,5-dinitrobenzoate)","Acta Crystallographica Section C","1991","47","12","2693","2695","10.1107/S010827019100625X","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000160","5.826","0.001","8.862","0.001","12.517","0.002","100.29","0.01","102.67","0.01","104.22","0.01","592.44","0.16","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H28 O2 P2 -","- C28 H28 O2 P2 -","- C28 H28 O2 P2 -","1","0.5","LI0086","Fontes, M. R. M.; Oliva, G.; Zukerman-Schpector, J.; Queiroz, S. L.; Batista, A. A.","Structure of 1,4-bis(diphenylphosphinoyl)butane","Acta Crystallographica Section C","1991","47","12","2699","2700","10.1107/S0108270191007205","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000161","9.389","0.005","35.542","0.007","8.899","0.004","90","","114.25","0.03","90","","2708","2","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H42 O5 Si -","- C27 H42 O5 Si -","- C108 H168 O20 Si4 -","4","1","AS0503","Sakai, Y.; Kojima, Y.; Ohashi, Y.; Morihira, K.; Furukawa, T.; Horiguchi, Y.; Kuwajima, I.","Structure of <i>endo</i>-(5<i>R</i>*,6<i>R</i>*,11<i>R</i>*,12<i>S</i>*)-5,6,11,12-tetrahydro-4,11,12-trimethoxy-9,13,13-trimethyl-5-(triethylsiloxy)-6,10-methano-8(7<i>H</i>)benzocyclodecenone","Acta Crystallographica Section C","1991","47","12","2700","2702","10.1107/S0108270191007916","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000162","7.0329","0.0007","9.983","0.002","22.644","0.006","90","","90","","90","","1589.8","0.6","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C14 H20 Cl2 O3 -","- C14 H20 Cl2 O3 -","- C56 H80 Cl8 O12 -","4","1","LI0087","Zukerman-Schpector, J.; Castellano, E. E.; Brocksom, T. J.; Moreira, L. A.","Structure and absolute configuration of (3<i>S</i>)-[(1<i>S</i>,2<i>R</i>,4<i>S</i>)-2-acetoxy-4-methyl-1-cyclohexyl]-2,2-dichloro-3-methylcyclobutanone","Acta Crystallographica Section C","1991","47","12","2706","2708","10.1107/S0108270191007941","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000163","15.108","0.003","4.636","0.001","28.819","0.003","90","","98.62","0.01","90","","1995.7","0.6","","","","","","","","","","","","5","I 1 2/a 1","-I 2ya","","","","","- C6 H16 N O6 P -","- C6 H16 N O6 P -","- C48 H128 N8 O48 P8 -","8","1","MU0267","Macíček, J.; Vladkova, T.","Structure of {εpsilon}-ammoniohexanoic acid dihydrogenphosphate","Acta Crystallographica Section C","1991","47","12","2709","2711","10.1107/S0108270191007801","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000164","19.423","0.005","8.478","0.005","18.327","0.005","90","","90.67","0.02","90","","3018","2","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C18 H16 O1.5 P -","- C18 H16 O1.5 P -","- C144 H128 O12 P8 -","8","1","CR0323","Baures, P. W.","Monoclinic triphenylphosphine oxide hemihydrate","Acta Crystallographica Section C","1991","47","12","2715","2716","10.1107/S0108270191004018","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","178231","2020-10-21","18:00:00",""
"2000165","7.6025","0.001","13.948","0.002","14.428","0.003","90","","90","","90","","1529.9","0.4","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C18 H16 O4 -","- C18 H16 O4 -","- C72 H64 O16 -","4","1","ST0498","Huang, E. T.; Evans, K. L.; Fronczek, F. R.; Gandour, R. D.","Methyl 2-[(2,6-dimethoxyphenyl)ethynyl]benzoate","Acta Crystallographica Section C","1991","47","12","2727","2729","10.1107/S0108270191004171","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000166","7.887","0.0007","7.815","0.0009","27.478","0.004","90","","91.229","0.01","90","","1693.3","0.3","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 O4 -","- C20 H20 O4 -","- C80 H80 O16 -","4","1","ST0499","Evans, K. L.; Fronczek, F. R.; Gandour, R. D.","1,3-Bis(2,6-dimethoxyphenyl)butenyne","Acta Crystallographica Section C","1991","47","12","2729","2731","10.1107/S0108270191004183","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000167","11.4064","0.0007","13.098","0.002","20.848","0.002","90","","90","","90","","3114.7","0.6","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","","","","","- C18 H16 O5 -","- C18 H16 O5 -","- C144 H128 O40 -","8","1","ST0501","Evans, K. L.; Fronczek, F. R.; Gandour, R. D.","Methyl 2-(2,6-dimethoxyphenyl)benzofuran-4-carboxylate","Acta Crystallographica Section C","1991","47","12","2731","2733","10.1107/S0108270191004195","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000168","16.23","0.01","5.88","0.01","29.88","0.02","90","","96.61","0.07","90","","2833","5","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C16 H17.76 N O5.38 -","- C16 H17.76 N O5.38 -","- C128 H142.08 N8 O43.04 -","8","1","CR0361","Hua, D. H.; Saha, S.; Robinson, P. D.","Structure of methyl-8,9-methylenedioxy-2-oxo-1,2,3,4,4aα,5,6,10bβ-octahydrophenanthridine-5-carboxylate","Acta Crystallographica Section C","1991","47","12","2737","2739","10.1107/S0108270191008259","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","200465","2020-10-21","18:00:00",""
"2000169","5.959","0.001","14.956","0.001","19.737","0.003","90","","90","","90","","1759","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","trans-3-Benzoyl-2-(tert-butyl)-4-(iso-butyl)-1,3-oxazolidin-5-one","","- C18 H25 N O3 -","- C18 H25 N O3 -","- C72 H100 N4 O12 -","4","1","HL0007","Willis, Anthony C.; Beckwith, Athelstan L. J.; Tozer, Matthew J.","<i>trans</i>-3-Benzoyl-2-<i>tert</i>-butyl-4-isobutyl-1,3-oxazolidin-5-one","Acta Crystallographica Section C","1991","47","11","2276","2277","10.1107/S0108270191009630","","","1.5418","CuKα","","0.038","0.034","","0.044","0.042","","","","1.462","1.515","1.515","","","","","has coordinates","199444","2020-10-21","18:00:00",""
"2000170","11.097","0.002","11.097","0.002","21.114","0.004","90","","90","","120","","2251.7","0.7","","","","","","","","","","","","4","R 3 2","R 3 2""","","","","","- B4 H9.4 Na2 O11.7 -","- B4 H12 Na2 O13 -","- B36 H108 Na18 O117 -","9","","ST0510","Powell, D. R.; Gaines, D. F.; Zerella, P. J.; Smith, R. A.","Refinement of the structure of tincalconite","Acta Crystallographica Section C","1991","47","11","2279","2282","10.1107/S0108270191006054","","","1.54184","Cu","","","","","","","","","","","","","","","","warnings","has coordinates","249446","2020-10-21","18:00:00",""
"2000171","7.284","0.001","3.881","0.001","15.143","0.001","90","","90","","90","","428.08","0.13","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Dy2 S3 -","- Dy2 S3 -","- Dy8 S12 -","4","0.5","AL0424","Meetsma, A.; Wiegers, G. A.; Haange, R. J.; de Boer, J. L.; Boom, G.","Structure of two modifications of dysprosium sesquisulfide, Dy~2~S~3~","Acta Crystallographica Section C","1991","47","11","2287","2291","10.1107/S0108270191006303","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2000172","13.601","0.003","13.966","0.003","12.341","0.003","100.1","0.02","99.56","0.02","115.19","0.02","2010.7","0.9","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C31 H38 Fe2 N6 O6 -","- C31 H38 Cl2 Fe2 N6 O22 -","- C62 H76 Cl4 Fe4 N12 O44 -","2","1","ST0483","O'Brien, R. J.; Richardson, J. F.; Buchanan, R. M.","Structure of di-μ-acetato-μ-oxo-bis[bis(2-pyridylmethyl)amine]diiron(III) diperchlorate 0.9-acetone solvate","Acta Crystallographica Section C","1991","47","11","2307","2310","10.1107/S0108270191005759","","","0.7093","mo","","","","","","","","","","","","","","","","","has coordinates","206341","2020-10-21","18:00:00",""
"2000173","12.125","0.003","12.379","0.003","20.438","0.005","90","","92.07","0.02","90","","3065.6","1.3","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H28 F12 N2 Ni O7 -","- C21 F17 N2 Ni O7 -","- C84 F68 N8 Ni4 O28 -","4","1","ST0479","Cervantes-Lee, F.; Porter, L. C.","Structure of (4-amino-2,2,6,6-tetramethylpiperidinyl-1-oxy)bis(hexafluoroacetylacetonato)(methanol)nickel(II) methanol solvate","Acta Crystallographica Section C","1991","47","11","2312","2315","10.1107/S0108270191002834","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000174","6.142","0.001","8.144","0.003","20.527","0.004","90","","93.97","0.01","90","","1024.3","0.5","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 Na4 O16 -","- C14 H20 Na4 O16 -","- C28 H40 Na8 O32 -","2","0.5","ST0515","Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E.","Structure of tetrasodium 1,4,5,8-naphthalenetetracarboxylate octahydrate","Acta Crystallographica Section C","1991","47","11","2315","2319","10.1107/S0108270191006066","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000175","10.158","0.001","10.663","0.001","12.766","0.002","100.93","0.01","109.55","0.01","99.1","0.01","1242.2","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H32 Li O7 P -","- C27 H32 Li O7 P -","- C54 H64 Li2 O14 P2 -","2","1","CR0313","Burns, J. H.; Sachleben, R. A.","Complexes of lithium and sodium with <i>sym</i>-(dibenzo-14-crown-4)methylphenyl phosphinic acid","Acta Crystallographica Section C","1991","47","11","2339","2343","10.1107/S0108270191005802","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","199646","2020-10-21","18:00:00",""
"2000176","10.493","0.006","11.77","0.005","13.162","0.005","98.16","0.03","108.73","0.04","108.81","0.04","1401.5","1.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C25 H36 Na O11 P -","- C25 H36 Na O11 P -","- C50 H72 Na2 O22 P2 -","2","1","CR0313","Burns, J. H.; Sachleben, R. A.","Complexes of lithium and sodium with <i>sym</i>-(dibenzo-14-crown-4)methylphenyl phosphinic acid","Acta Crystallographica Section C","1991","47","11","2339","2343","10.1107/S0108270191005802","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","199644","2020-10-21","18:00:00",""
"2000177","8.586","0.002","10.508","0.002","10.676","0.002","90","","95.64","0.02","90","","958.5","0.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C5 H8 N4 O3 S2 -","- C5 H8 N4 O3 S2 -","- C20 H32 N16 O12 S8 -","4","1","AB0197","Alzuet, G.; Ferrer, S.; Borrás, J.; Solans, X.","Structure of methazolamide: an inhibitor of carbonic anhydrase","Acta Crystallographica Section C","1991","47","11","2377","2379","10.1107/S0108270191005462","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000178","10.186","0.001","11.494","0.001","8.535","0.001","90","","99.71","0.008","90","","984.94","0.17","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H11 N O3 -","- C10 H11 N O3 -","- C40 H44 N4 O12 -","4","1","LI0071","De, A.; Kitagawa, Y.","Structure of 3,3-dimethoxyindolin-2-one","Acta Crystallographica Section C","1991","47","11","2384","2386","10.1107/S0108270191005814","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000179","24.595","0.004","24.595","0.004","6.398","0.002","90","","90","","90","","3870.2","1.5","","","","","","","","","","","","6","P 42/n","-P 4bc","","","","","- C17.5 H19 Cl F6 N2 O1.5 -","- C17 H17 Cl F6 N2 O -","- C136 H136 Cl8 F48 N16 O8 -","8","","CR0310","Karle, J. M.; Karle, I. L.","Structure of the antimalarial (±)-mefloquine hydrochloride","Acta Crystallographica Section C","1991","47","11","2391","2395","10.1107/S0108270191005796","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","189068","2020-10-21","18:00:00",""
"2000180","13.289","0.003","13.289","0.003","13.289","0.003","90","","90","","90","","2346.8","0.9","","","","","","","","","","","","5","P 21 3","P 2ac 2ab 3","","","","","- C18 H21 Cl3 N4 O12 -","- C18 H21 Cl3 N4 O12 -","- C72 H84 Cl12 N16 O48 -","4","0.333333","CR0325","Britton, D.; Norman, R. E.; Que, Jnr, L.","Tris[(2-pyridinium)methyl]amine perchlorate","Acta Crystallographica Section C","1991","47","11","2415","2417","10.1107/S0108270191006194","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000181","16.157","0.002","9.189","0.003","9.996","0.003","90","","95.8","0.02","90","","1476.5","0.7","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","4-(4-bromophenyl)-4-phenylcyclohex-2-en-1-one","","- C18 H15 Br O -","- C18 H15 Br O -","- C72 H60 Br4 O4 -","4","1","CR0329","Chen, J.; Hwang, C.; Scheffer, J. R.; Trotter, J.","Structure and photochemistry of a cyclohexenone and its solid-state photoproduct","Acta Crystallographica Section C","1991","47","11","2417","2419","10.1107/S0108270191006212","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","199613","2020-10-21","18:00:00",""
"2000182","17.607","0.004","8.213","0.002","19.976","0.005","90","","93.09","0.03","90","","2884.5","1.2","","","","","","","","","","","","4","I 1 2/a 1","-I 2ya","","","","","- C18 H15 Br O -","- C18 H15 Br O -","- C144 H120 Br8 O8 -","8","1","CR0329","Chen, J.; Hwang, C.; Scheffer, J. R.; Trotter, J.","Structure and photochemistry of a cyclohexenone and its solid-state photoproduct","Acta Crystallographica Section C","1991","47","11","2417","2419","10.1107/S0108270191006212","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000183","10.251","0.001","8.37","0.001","12.548","0.001","90","","95.98","0.05","90","","1070.8","0.2","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C18 H26 O12 -","- C18 H26 O12 -","- C36 H52 O24 -","2","1","AB0200","Kopf, J.; Topf, C.; Morf, M.; Zimmer, B.; Köll, P.","Structure of 1,2,3,4,5,6-hexa-<i>O</i>-acetyl-<small>D</small>-glucitol (sorbitol hexaacetate)","Acta Crystallographica Section C","1991","47","11","2425","2428","10.1107/S0108270191004924","","","0.70926","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000184","7.3964","0.0003","12.8372","0.0005","13.6726","0.0004","90","","90","","90","","1298.2","0.08","","","","","","","","","","","","6","C m c m","-C 2c 2","","","","","- C6 H8 Fe Gd N6 O4 -","- C6 Fe Gd N6 O4 -","- C24 Fe4 Gd4 N24 O16 -","4","0.25","ST0519","Mullica, D. F.; Sappenfield, E. L.","Structure of gadolinium hexacyanoferrate(III) tetrahydrate","Acta Crystallographica Section C","1991","47","11","2433","2435","10.1107/S0108270191006364","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000185","8.8723","0.0012","5.4921","0.0004","4.8495","0.0006","90","","90","","90","","236.3","0.05","","","","","","","","","","","","3","C m c 21","C 2c -2","","","","","- N2 O Si2 -","- N2 O Si2 -","- N8 O4 Si8 -","4","0.5","AB0210","Sjöberg, J.; Helgesson, G.; Idrestedt, I.","Refinement of the structure of Si~2~N~2~O","Acta Crystallographica Section C","1991","47","11","2438","2441","10.1107/S0108270191006236","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000186","9.182","0.003","9.64","0.002","10.384","0.002","107.56","0.02","89.7","0.02","110.48","0.02","815.7","0.4","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C37 H30 Cl O P2 Rh -","- C37 H30 Cl O P2 Rh -","- C37 H30 Cl O P2 Rh -","1","0.5","CR0301","Chen, Y.-J.; Wang, J.-C.; Wang, Yu","Structure of <i>trans</i>-[Rh(CO)Cl{P(C~6~H~5~)~3~}~2~]: a centrosymmetric triclinic phase","Acta Crystallographica Section C","1991","47","11","2441","2442","10.1107/S0108270191005589","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","278247","2022-09-28","15:09:31",""
"2000187","15.328","0.002","13.994","0.002","18.26","0.002","90","","114","0.01","90","","3578.1","0.8","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H10 N6 O4 W -","- C16 H10 N6 O4 W -","- C128 H80 N48 O32 W8 -","8","2","AB0179","Hage, R.; de Graaff, R. A. G.; Haasnoot, J. G.; Russell, G.; Long, C.; Vos, J. G.","Structure of tetracarbonyl[3,6-bis(pyridin-2-yl)-2,5-dihydro-1,2,4,5-tetrazine]tungsten(0)","Acta Crystallographica Section C","1991","47","11","2448","2451","10.1107/S0108270191004729","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000188","61.35","0.004","10.437","0.0004","17.7387","0.0014","90","","99.742","0.006","90","","11194.5","1.2","","","","","","","","","","","","5","C 1 2/c 1","","","","","","- C26 H34 Mo N2 O12 -","- C26 Mo N2 O12 -","- C416 Mo16 N32 O192 -","16","2","CR0302","Wang, J.-C.; Sun, C.-H.; Chow, T. J.; Liu, L.-K.","Structure of dicarbonylbis(η^2^-dimethyl 7-acetyl-7-azabicyclo[2.2.1]hept-2-ene-2,3-dicarboxylate-κ<i>N</i>)molybdenum(0)","Acta Crystallographica Section C","1991","47","11","2459","2461","10.1107/S0108270191007217","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000189","9.967","0.003","10.912","0.003","12.258","0.003","71.07","0.02","67.26","0.02","75.61","0.02","1151.4","0.6","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C29 H24 N2 O2 S -","- C29 H24 N2 O2 S -","- C58 H48 N4 O4 S2 -","2","1","ST0511","Zhang, H.; Self, J.; Khanapure, S. P.; Biehl, E.","Structure of 10-benzyl-2-[(3,4-dimethoxyphenyl)methyl]phenothiazine-1-carbonitrile","Acta Crystallographica Section C","1991","47","11","2465","2466","10.1107/S0108270191005346","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","200473","2020-10-21","18:00:00",""
"2000190","8.436","0.002","16.739","0.006","11.698","0.003","90","","97.69","0.02","90","","1637","0.8","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C40 H44 O4 -","- C40 H44 O4 -","- C80 H88 O8 -","2","1","AB0208","van Eijck, B. P.","Structure of (<i>Z</i>)-1,2-dimesitylvinylene bis(mesitylenecarboxylate)","Acta Crystallographica Section C","1991","47","11","2470","2472","10.1107/S0108270191005334","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000191","10.266","0.003","14.848","0.006","11.537","0.003","90","","108.83","0.03","90","","1664.5","1","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C8 Cl F3 N2 -","- C8 Cl F3 N2 -","- C64 Cl8 F24 N16 -","8","2","CR0343","Britton, D.","Structure of 5-chloro-2,4,6-trifluoroisophthalonitrile","Acta Crystallographica Section C","1991","47","11","2472","2474","10.1107/S0108270191005747","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000192","4.479","0.001","9.955","0.001","19.304","0.002","90","","107.9","0.01","90","","819.1","0.2","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H8 Cl N5 O2 -","- C5 H8 Cl N5 O2 -","- C20 H32 Cl4 N20 O8 -","4","1","AB0161","Maixner, J.; Zachová, J.","Redetermination of the structure of guanine hydrochloride monohydrate","Acta Crystallographica Section C","1991","47","11","2474","2476","10.1107/S0108270191005322","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000193","22.46","0.009","17.52","0.008","9.04","0.01","90","","90","","90","","3557","4","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C36 H56 N4 O6 -","- C36 H56 N4 O6 -","- C144 H224 N16 O24 -","4","0.5","LI0069","Cheetham, G. M. T.; Harding, M. M.","<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>'''-Bis(<i>m</i>-xylyl)bis(4,13-diaza-1,7,10-trioxacyclopentadecane): a multidentate macrocyclic complexing agent containing two 15-crown-5 rings","Acta Crystallographica Section C","1991","47","11","2478","2479","10.1107/S010827019100598X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000194","11.194","0.004","10.944","0.003","14.815","0.005","90","","95.01","0.03","90","","1808","1","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C15 H28 O4 Si -","- C15 H28 O4 Si -","- C60 H112 O16 Si4 -","4","1","CR0344","Ammon, H. L.; DeShong, P.; Simpson, D.","Structure of a lactone, (3α,4α,6α)-4-(<i>tert</i>-butyldimethylsiloxy)-3,4,5,6-tetrahydro-6-methyl-3-(2-oxopropyl)-2<i>H</i>-pyran-2-one","Acta Crystallographica Section C","1991","47","11","2482","2484","10.1107/S0108270191006030","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000195","9.665","0.002","7.981","0.001","19.071","0.002","90","","90","","90","","1471.1","0.4","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C8 H9 N O -","- C8 H9 N O -","- C64 H72 N8 O8 -","8","1","AL0471","Bedford, R. B.; Chaloner, P. A.; Hitchcock, P. B.","Structure of <i>N</i>-methyl benzaldehyde nitrone","Acta Crystallographica Section C","1991","47","11","2484","2485","10.1107/S0108270191007199","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000196","5.5385","0.0006","8.543","0.001","10.373","0.001","113.329","0.009","100.78","0.01","99.82","0.01","426.13","0.09","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C9 H12 O3 -","- C9 H12 O3 -","- C18 H24 O6 -","2","1","CR0339","Ammon, H. L.; DeShong, P.; Lessen, T. A.","Structure of (2'<i>R</i>*,5<i>S</i>*)-(±)-5-(tetrahydro-2'<i>H</i>-pyran-2'-yl)-2(5<i>H</i>)-furanone","Acta Crystallographica Section C","1991","47","11","2488","2489","10.1107/S0108270191006248","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000197","11.6","0.01","20.44","0.02","7.657","0.006","91.19","0.08","95.53","0.08","89.55","0.07","1807","3","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H20 O5 -","- C22 H20 O5 -","- C88 H80 O20 -","4","2","CR0333","Robinson, P. D.; Hua, D. H.; Roche, D.; Saha, S.","Structure of 8-ethyl-4,10,12-trimethoxy-6<i>H</i>-benzo[<i>d</i>]naphtho[1,2-<i>b</i>]pyran-6-one","Acta Crystallographica Section C","1991","47","11","2490","2492","10.1107/S0108270191005863","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000198","10.8","0.01","6","0.01","5.41","0.005","113.16","0.06","77.21","0.05","92.84","0.07","314","0.7","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C12 H22 N4 -","- C12 H22 N4 -","- C12 H22 N4 -","1","0.5","LI0084","Small, R. W. H.","Structure of 2-azacycloheptanone azine","Acta Crystallographica Section C","1991","47","11","2505","2506","10.1107/S0108270191007047","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000199","7.389","0.001","13.255","0.001","14.448","0.002","88.6","0.01","78.58","0.01","81.48","0.01","1371.7","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H39 N O11 -","- C26 H39 N O11 -","- C52 H78 N2 O22 -","2","1","HA0066","Vichet, A.; Galy, J. P.; Baldy, A.; Barbe, J.; Feneau-Dupont, J.; Declercq, J.-P.","Structures of two crown-ether derivatives of 9-acridone","Acta Crystallographica Section C","1991","47","11","2508","2510","10.1107/S0108270191007151","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000200","8.426","0.002","11.42","0.002","11.739","0.004","87.2","0.03","79.33","0.03","77.88","0.02","1085.3","0.5","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H29 N O7 -","- C24 H29 N O7 -","- C48 H58 N2 O14 -","2","1","HA0066","Vichet, A.; Galy, J. P.; Baldy, A.; Barbe, J.; Feneau-Dupont, J.; Declercq, J.-P.","Structures of two crown-ether derivatives of 9-acridone","Acta Crystallographica Section C","1991","47","11","2508","2510","10.1107/S0108270191007151","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000201","11.503","0.003","15.932","0.002","9.133","0.002","90","","102.17","0.02","90","","1636.2","0.6","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C18 H19 N O2 S -","- C18 H19 N O2 S -","- C72 H76 N4 O8 S4 -","4","1","LI0075","McKenna, R.; Neidle, S.; Wilson, W. D.","Structures of 1-(3,3-dimethylamino)propyl naphtho[2,1-<i>b</i>]thiophene-4-carboxylate and <i>N</i>-(3,3-dimethylamino)propyl-8-methoxynaphtho[2,1-<i>b</i>]thiophene-4-carboxamide, intercalators into double-helical DNA","Acta Crystallographica Section C","1991","47","11","2511","2513","10.1107/S0108270191005991","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000202","9.873","0.002","13.163","0.003","14.065","0.003","101.33","0.03","94.3","0.03","91.35","0.03","1785.8","0.7","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H21 N O3 S -","- C19 H22 N2 O2 S -","- C76 H88 N8 O8 S4 -","4","2","LI0075","McKenna, R.; Neidle, S.; Wilson, W. D.","Structures of 1-(3,3-dimethylamino)propyl naphtho[2,1-<i>b</i>]thiophene-4-carboxylate and <i>N</i>-(3,3-dimethylamino)propyl-8-methoxynaphtho[2,1-<i>b</i>]thiophene-4-carboxamide, intercalators into double-helical DNA","Acta Crystallographica Section C","1991","47","11","2511","2513","10.1107/S0108270191005991","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000203","7.974","0.002","7.974","0.002","4.875","0.001","90","","90","","120","","268.45","0.11","","","","","","","","","","","","5","P 3 2 1","P 3 2""","","","","","- Al3.5 N1.5 Nd3 O12.5 Si2.5 -","- Al4 Nd3 O14 Si2 -","- Al4 Nd3 O14 Si2 -","1","0.166667","AB0206","Käll, P.-O.; Grins, J.; Nygren, M.","Structure of the Nd U-phase, Nd~3~Al~3.5~Si~2.5~O~12.5~N~1.5~; a nitrogen-containing phase of the La~3~Ga~5~GeO~14~ structure type","Acta Crystallographica Section C","1991","47","10","2015","2019","10.1107/S0108270191005024","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000204","10.324","0.0006","10.324","0.0006","10.324","0.0006","90","","90","","90","","1100.38","0.11","","","","","","","","","","","","4","P a -3","-P 2ac 2ab 3","","","","","- Br2 Cu H12 O12 -","- Br2 Cu H12 O12 -","- Br8 Cu4 H48 O48 -","4","0.166667","CR0311","Blackburn, A. C.; Gallucci, J. C.; Gerkin, R. E.","Structure of hexaaquacopper(II) bromate","Acta Crystallographica Section C","1991","47","10","2019","2023","10.1107/S0108270191005048","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000205","15.02","0.009","7.555","0.002","18.134","0.015","90","","112.22","0.06","90","","1905","2","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C23 H19 Fe N3 O2 -","- C23 H19 Fe N3 O2 -","- C92 H76 Fe4 N12 O8 -","4","1","MU0246","Coe, B. J.; Foulon, J.-D.; Hamor, T. A.; Jones, C. J.; McCleverty, J. A.","Synthesis and structure of 4-ferrocenyl-2'-methyl-4'-nitroazobenzene","Acta Crystallographica Section C","1991","47","10","2032","2035","10.1107/S0108270191003748","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000206","9.171","0.001","8.999","0.001","26.677","0.003","90","","94.08","0.01","90","","2196.1","0.4","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H21 Cl2 Cu N7 O8 -","- C14 H21 Cl2 Cu N7 O15 -","- C56 H84 Cl8 Cu4 N28 O60 -","4","1","ST0482","Oberhausen, K. J.; Easley, W. D.; Richardson, J. F.; Buchanan, R. M.","Structure of {bis[(1-methylimidazol-2-yl)methyl]amine}(1-methylimidazole)copper(II) diperchlorate","Acta Crystallographica Section C","1991","47","10","2037","2040","10.1107/S010827019100344X","","","0.71093","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000207","15.739","0.005","7.466","0.001","20.286","0.005","90","","97.21","0.02","90","","2364.9","1","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 O6 Ti -","- C26 H24 O6 Ti -","- C104 H96 O24 Ti4 -","4","1","MU0235","Bracke, B.; Dang, Y.; Lenstra, A. T. H.; Geise, H. J.","Bis(cyclopentadienyl)bis(<i>m</i>-methoxybenzoato)titanium(IV)","Acta Crystallographica Section C","1991","47","10","2043","2047","10.1107/S0108270191003864","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000208","7.73","0.004","13.408","0.009","30.59","0.03","90","","94.9","0.07","90","","3159","4","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H30 N3 Nd O18 S3 -","- C21 H30 N3 Nd O18 S3 -","- C84 H120 N12 Nd4 O72 S12 -","4","1","MU0227","Starynowicz, P.","Structure of octaaquasaccharinatoneodymium disaccharinate hydrate","Acta Crystallographica Section C","1991","47","10","2063","2065","10.1107/S0108270191003967","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000209","12.737","0.001","39.46","0.004","12.765","0.001","90","","116.4","0.01","90","","5746.6","1","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C57 H82 Mn O12 S2 -","- C61 H38 Mn O12 S2 -","- C244 H152 Mn4 O48 S8 -","4","1","CR0288","Burns, J. H.; Lumetta, G. J.","Complexes of manganese and zinc di-<i>tert</i>-butylnaphthalenesulfonate with cyclohexano-15-crown-5 ether toluene solvate","Acta Crystallographica Section C","1991","47","10","2069","2073","10.1107/S0108270191003797","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000210","12.766","0.002","39.083","0.005","12.771","0.002","90","","116.44","0.01","90","","5705.4","1.5","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C57 H82 O3 S2 Zn -","- C61 H38 O12 S2 Zn -","- C244 H152 O48 S8 Zn4 -","4","1","CR0288","Burns, J. H.; Lumetta, G. J.","Complexes of manganese and zinc di-<i>tert</i>-butylnaphthalenesulfonate with cyclohexano-15-crown-5 ether toluene solvate","Acta Crystallographica Section C","1991","47","10","2069","2073","10.1107/S0108270191003797","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000211","6.623","0.002","9.723","0.002","12.658","0.003","85.98","0.02","79.72","0.02","79.95","0.02","789.1","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H16 Cl2 Cu S16 -","- C20 H16 Cl2 Cu S16 -","- C20 H16 Cl2 Cu S16 -","1","0.5","CR0332","Bu, X.; Coppens, P.; Lederle, B.; Naughton, M. J.","Structure and conductivity of a new phase of di[3,4;3',4'-bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalenium] dichlorocuprate(I); β-(BEDT-TTF)~2~CuCl~2~","Acta Crystallographica Section C","1991","47","10","2082","2085","10.1107/S010827019100505X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000212","8.893","0.001","9.712","","12.745","0.003","90","","103.38","0.01","90","","1070.9","0.3","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C10 H28 Cl4 P4 Pd2 -","- C10 H28 Cl4 P4 Pd2 -","- C20 H56 Cl8 P8 Pd4 -","2","0.5","CR0322","Davies, J. A.; Pinkerton, A. A.; Vilmer, M.","<i>cis</i>,<i>cis</i>-[Bis(dimethylphosphino)methane]tetrachlorodipalladium(II)","Acta Crystallographica Section C","1991","47","10","2092","2094","10.1107/S0108270191004869","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000213","9.006","0.001","14.209","0.002","10.908","0.002","90","","117.88","0.01","90","","1233.8","0.3","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C4 H12 N2 O8 Pt S2 -","- C4 H12 N2 O8 Pt S2 -","- C16 H48 N8 O32 Pt4 S8 -","4","1","AB0214","Boström, D.; Strandberg, R.; Norén, B.; Oskarsson, Å.","<i>cis</i>/<i>trans</i> influences on square-planar platinum(II) complexes. Structure of <i>cis</i>-bis(dimethyl sulfoxide)dinitratoplatinum(II)","Acta Crystallographica Section C","1991","47","10","2101","2104","10.1107/S010827019100567X","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","199646","2020-10-21","18:00:00",""
"2000214","6.926","0.001","9.084","0.002","18.602","0.003","90","","90","","90","","1170.4","0.4","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H14 N3 O6 P -","- C8 H14 N3 O6 P -","- C32 H56 N12 O24 P4 -","4","1","AB0159","Symerský, J.; Holý, A.","Structure of 1-(<i>S</i>)-(3-hydroxy-2-phosphonylmethoxypropyl)cytosine; an antiviral agent","Acta Crystallographica Section C","1991","47","10","2104","2107","10.1107/S0108270190013257","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000215","27.479","0.004","5.128","0.001","21.811","0.003","90","","139.35","0.01","90","","2002.2","0.7","","","","","","","","","","","","5","C 1 c 1","C -2yc","","","","","- C20 H24 Br N O6 -","- C20 H24 Br N O6 -","- C80 H96 Br4 N4 O24 -","4","1","AB0186","Arrieta, J. M.; Domínguez, E.; Lete, E.; Villa, M. J.; Germain, G.; Vlassi, M.; Prewo, R.; Bieri, J. H.","<i>N</i>-2-(2-Bromo-4,5-dimethoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethylformamide","Acta Crystallographica Section C","1991","47","10","2115","2118","10.1107/S0108270191003141","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","199646","2020-10-21","18:00:00",""
"2000216","9.881","0.001","12.687","0.002","15.438","0.005","109.65","0.01","90.94","0.02","95.78","0.01","1810.7","0.7","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H25 N3 O4 -","- C18 H25 N3 O4 -","- C72 H100 N12 O16 -","4","2","CR0270","Punte, G.; Rivero, B. E.","Investigation of the geometry of substituted dinitroanilines. III. Structural study of <i>N</i>,<i>N</i>-dicyclohexyl-2,4-dinitroaniline","Acta Crystallographica Section C","1991","47","10","2118","2122","10.1107/S0108270191002901","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000217","22.525","0.002","11.73","0.002","7.568","0.002","90","","90","","90","","1999.6","0.7","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C13 H8 F N -","- C13 H8 F N -","- C104 H64 F8 N8 -","8","1","ST0506","Gleason, W. B.; Brostrom, M.; Etter, M. C.; Johnson, R. B.","Structure of 4-cyano-4'-fluorobiphenyl","Acta Crystallographica Section C","1991","47","10","2131","2134","10.1107/S0108270191003451","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000218","6.589","0.001","9.784","0.002","14.394","0.002","90","","95.69","0.01","90","","923.4","0.3","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C13 H8 O2 -","- C13 H8 O2 -","- C52 H32 O8 -","4","1","ST0505","Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E.; Rawal, V. H.","Structure of 4-dibenzofurancarboxaldehyde, C~13~H~8~O~2~","Acta Crystallographica Section C","1991","47","10","2134","2137","10.1107/S0108270191003384","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000219","13.378","0.007","6.614","0.001","23.04","0.015","90","","92.53","0.05","90","","2036.6","1.7","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H11 N O4 -","- C12 H11 N O4 -","- C96 H88 N8 O32 -","8","2","CR0314","Ammon, H. L.; Paquette, L. A.","Structure of 9-nitro-[4]peristylane-1,5-dione","Acta Crystallographica Section C","1991","47","10","2156","2159","10.1107/S0108270191003980","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000220","11.467","0.001","8.756","0.001","11.9339","0.0008","90","","90","","90","","1198.22","0.19","","","","","","","","","","","","4","P n a 21","P 2c -2n","","","","","- C12 H11 N3 O6 -","- C12 H11 N3 O6 -","- C48 H44 N12 O24 -","4","1","CR0315","Ammon, H. L.; Paquette, L. A.","Structure of 1,5,9-trinitrobishomopentaprismane","Acta Crystallographica Section C","1991","47","10","2159","2164","10.1107/S0108270191003803","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000221","7.618","0.004","22.321","0.01","8.311","0.003","90","","90.14","0.04","90","","1413.2","1.1","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H13 N O12 P2 -","- C6 H13 N O12 P2 -","- C24 H52 N4 O48 P8 -","4","2","MU0238","Weichsel, A.; Lis, T.; Kuczek, M.","Structure of ammonium hydrogen bis(phosphoenolpyruvate)","Acta Crystallographica Section C","1991","47","10","2164","2167","10.1107/S0108270191003979","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000222","10.2585","0.0003","19.7992","0.0007","9.9408","0.0004","90","","92.009","0.004","90","","2017.84","0.12","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H26 N4 O3 -","- C22 H26 N4 O3 -","- C88 H104 N16 O12 -","4","2","AB0201","Csöregh, I.; Ertan, A.; Moberg, C.; Wärnmark, K.","Structures of novel macrocyclic dipyridylmethaneamides","Acta Crystallographica Section C","1991","47","10","2171","2176","10.1107/S0108270191004596","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000223","10.336","0.001","18.478","0.002","19.048","0.002","115.906","0.001","101.773","0.005","98.575","0.004","3084.1","0.6","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H26 N4 O3 -","- C22 H26 N4 O3 -","- C132 H156 N24 O18 -","6","3","AB0201","Csöregh, I.; Ertan, A.; Moberg, C.; Wärnmark, K.","Structures of novel macrocyclic dipyridylmethaneamides","Acta Crystallographica Section C","1991","47","10","2171","2176","10.1107/S0108270191004596","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000224","20.888","0.001","4.858","0.001","9.221","0.001","90","","99.888","0.005","90","","921.8","0.2","","","","","","","","","","","","3","C 1 c 1","C -2yc","","","","","- C7 H16 O7 -","- C7 H16 O7 -","- C28 H64 O28 -","4","1","AB0193","Kopf, J.; Morf, M.; Zimmer, B.; Bischoff, M.; Köll, P.","Structure of racemic perseitol (<small>D</small>,<small>L</small>-<i>glycero</i>-<small>D</small>,<small>L</small>-<i>galacto</i>-heptitol)","Acta Crystallographica Section C","1991","47","10","2186","2188","10.1107/S0108270191003724","","","1.54051","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000225","9.385","0.005","12.702","0.009","8.261","0.005","90","","110.94","0.04","90","","919.7","1","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","","","","","- C2 Cs N3 -","- C2 Cs N3 -","- C16 Cs8 N24 -","8","1","MU0242","Starynowicz, P.","Structure of caesium dicyanamide","Acta Crystallographica Section C","1991","47","10","2198","2199","10.1107/S0108270191003700","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000226","9.023","0.003","12.081","0.005","16.72","0.011","90","","97.06","0.04","90","","1808.8","1.5","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 Fe2 O7 S2 -","- C14 H10 Fe2 O7 S2 -","- C56 H40 Fe8 O28 S8 -","4","1","AB0169","Liu, X. L.; Chen, H. L.; Miao, F. M.; Song, L. C.; Hu, Q. M.","Structure of an Fe–S cluster complex","Acta Crystallographica Section C","1991","47","10","2199","2201","10.1107/S0108270191003062","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000227","12.032","0.003","7.288","0.004","16.933","0.004","90","","90.44","0.04","90","","1484.8","1","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H36 Ag2 N8 S4 -","- C22 H34 Ag2 N8 S4 -","- C44 H68 Ag4 N16 S8 -","2","0.5","AB0168","Wang, J.-L.; Sun, M.; Miao, F. M.; Wu, S.-Y.; Gong, F.-S.; Duan, X.-H.","Structure of an inclusion compound of Ag~2~(SCN)~4~ and 5,7,7,12,14,14-hexamethyl-1,4,8,11-tetraazatricyclo[9.3.1.1^4,8^]hexadecane","Acta Crystallographica Section C","1991","47","10","2203","2205","10.1107/S0108270191003888","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000228","8.783","0.002","9.304","0.003","26.993","0.005","90","","90","","90","","2205.8","1","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","","","","","- C10 H8 Cl Cu N O4 -","- C10 H8 Cl Cu N O4 -","- C80 H64 Cl8 Cu8 N8 O32 -","8","1","AB0196","Wang, J.-L.; Tian, G.-H.; Miao, F. M.; Liu, H.-Q.; Chen, R.-T.","Structure of the complex [<i>N</i>-(<i>p</i>-chlorophenyl)iminodiacetato]copper(II)","Acta Crystallographica Section C","1991","47","10","2205","2207","10.1107/S010827019100389X","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000229","9.129","0.001","14.207","0.001","11.003","0.001","90","","102.36","0.01","90","","1394","0.2","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C11 H18 Br N3 O2 Zn -","- C11 H18 Br N3 O2 Zn -","- C44 H72 Br4 N12 O8 Zn4 -","4","1","AB0195","Kratochvíl, B.; Ondráček, J.; Novotný, J.; Haber, V.","Structure of a zinc(II) complex with a non-symmetrical tetradentate Schiff base","Acta Crystallographica Section C","1991","47","10","2207","2209","10.1107/S0108270191003207","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","187457","2020-10-21","18:00:00",""
"2000230","9.107","0.001","9.632","0.002","21.53","0.002","90","","90","","90","","1888.6","0.5","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C6 H18 Cr P3 S6 -","- C6 H18 Cr P3 S6 -","- C24 H72 Cr4 P12 S24 -","4","1","CR0330","Skrzypczak-Jankun, E.; Pinkerton, A. A.","Tris(dimethyldithiophosphinato)chromium(III) ‒ orthorhombic form","Acta Crystallographica Section C","1991","47","10","2211","2212","10.1107/S0108270191005073","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000231","7.702","0.001","9.343","0.001","11.275","0.001","99.24","0.01","103.36","0.01","102.08","0.01","753.07","0.16","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H14 Cu N4 O9 -","- C10 H14 Cu N4 O10 -","- C20 H28 Cu2 N8 O20 -","2","1","AB0192","Mathews, I. I.; Manohar, H.","Redetermination of the structure of triaqua(2,2'-bipyridine)nitratocopper(II) nitrate","Acta Crystallographica Section C","1991","47","10","2213","2214","10.1107/S0108270191003591","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000232","6.862","0.001","6.923","0.002","11.215","0.002","82.65","0.01","83.27","0.01","61.3","0.01","462.53","0.18","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C6 H7 Cl3 Ti -","- C6 H7 Cl3 Ti -","- C12 H14 Cl6 Ti2 -","2","1","CR0327","Kirschbaum, K.; Giolando, D. M.","Structure of trichloro(η^5^-methylcyclopentadienyl)titanium(IV)","Acta Crystallographica Section C","1991","47","10","2216","2218","10.1107/S0108270191005061","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000233","17.662","0.003","5.9287","0.0007","8.4003","0.001","90","","99.857","0.013","90","","866.6","0.2","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 O2 -","- C11 H10 O2 -","- C44 H40 O8 -","4","1","ST0497","Prince, P.; Fronczek, F. R.; Gandour, R. D.","7-Methoxy-2-naphthol","Acta Crystallographica Section C","1991","47","10","2218","2220","10.1107/S0108270191003992","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000234","8.4835","0.0007","11.801","0.002","12.036","0.002","82.321","0.01","76.56","0.008","73.261","0.008","1119.4","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H20 O6 S2 -","- C24 H20 O6 S2 -","- C48 H40 O12 S4 -","2","1","ST0495","Prince, P.; Fronczek, F. R.; Gandour, R. D.","2,7-Naphthalenediyl bis(<i>p</i>-toluenesulfonate)","Acta Crystallographica Section C","1991","47","10","2220","2222","10.1107/S0108270191003608","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000235","3.9886","0.0002","11.7995","0.0009","22.789","0.003","90","","92.748","0.006","90","","1071.3","0.17","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C13 H12 O3 -","- C13 H12 O3 -","- C52 H48 O12 -","4","1","ST0500","Prince, P.; Fronczek, F. R.; Gandour, R. D.","Methyl 7-methoxy-2-naphthoate","Acta Crystallographica Section C","1991","47","10","2226","2227","10.1107/S010827019100361X","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000236","11.737","0.002","21.244","0.004","22.932","0.003","90","","90","","90","","5717.9","1.6","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C13 H24 O3 S -","- C13 H24 O3 S -","- C208 H384 O48 S16 -","16","4","HA0034","Declercq, J.-P.; Feneau-Dupont, J.; Huart, C.; Nemery, I.","Structures of (2<i>S</i>,3<i>R</i>)-<i>exo</i>-1,7,7-trimethyl-3-propylsulfonylbicyclo[2.2.1]heptan-2-ol (I) and (2<i>S</i>,3<i>R</i>)-<i>exo</i>-1,3,7,7-tetramethyl-3-propylsulfonylbicyclo[2.2.1]heptan-2-ol(II)","Acta Crystallographica Section C","1991","47","10","2234","2236","10.1107/S0108270191002226","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","199646","2020-10-21","18:00:00",""
"2000237","8.651","0.002","11.92","0.004","14.256","0.003","90","","90","","90","","1470.1","0.7","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C14 H26 O3 S -","- C14 H26 O3 S -","- C56 H104 O12 S4 -","4","1","HA0034","Declercq, J.-P.; Feneau-Dupont, J.; Huart, C.; Nemery, I.","Structures of (2<i>S</i>,3<i>R</i>)-<i>exo</i>-1,7,7-trimethyl-3-propylsulfonylbicyclo[2.2.1]heptan-2-ol (I) and (2<i>S</i>,3<i>R</i>)-<i>exo</i>-1,3,7,7-tetramethyl-3-propylsulfonylbicyclo[2.2.1]heptan-2-ol(II)","Acta Crystallographica Section C","1991","47","10","2234","2236","10.1107/S0108270191002226","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","199646","2020-10-21","18:00:00",""
"2000238","9.434","0.008","6.11","0.004","13.322","0.01","90","","105.02","0.06","90","","741.7","1","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C20 H14 N4 -","- C20 H14 N4 -","- C40 H28 N8 -","2","0.5","AB0207","Honey, G. E.; Steel, P. J.","Structures of two modifications of 2,2':4',4'':2'',2'''-quaterpyridine","Acta Crystallographica Section C","1991","47","10","2247","2249","10.1107/S0108270191005085","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000239","7.224","0.005","11.53","0.006","8.978","0.006","90","","91.21","0.05","90","","747.6","0.8","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 N4 -","- C20 H14 N4 -","- C40 H28 N8 -","2","0.5","AB0207","Honey, G. E.; Steel, P. J.","Structures of two modifications of 2,2':4',4'':2'',2'''-quaterpyridine","Acta Crystallographica Section C","1991","47","10","2247","2249","10.1107/S0108270191005085","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000240","9.666","0.002","9.933","0.002","16.023","0.003","90","","106.01","0.02","90","","1478.7","0.5","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C37 H40 B N O -","- C37 H40 B N O -","- C74 H80 B2 N2 O2 -","2","1","CR0304","King, Jnr, J. A.; Bryant, Jnr, G. L.","Structures of two <i>N</i>-acyl triethyl ammonium salts and one simple triethyl ammonium salt","Acta Crystallographica Section C","1991","47","10","2249","2252","10.1107/S0108270191005152","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000241","9.196","0.003","13.442","0.003","12.718","0.003","90","","104.46","0.02","90","","1522.3","0.7","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C13 H20 B F4 N O2 -","- C13 H20 B F4 N O2 -","- C52 H80 B4 F16 N4 O8 -","4","1","CR0304","King, Jnr, J. A.; Bryant, Jnr, G. L.","Structures of two <i>N</i>-acyl triethyl ammonium salts and one simple triethyl ammonium salt","Acta Crystallographica Section C","1991","47","10","2249","2252","10.1107/S0108270191005152","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000242","9.282","0.002","14.338","0.006","9.551","0.004","90","","109.71","0.03","90","","1196.6","0.8","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C30 H36 B N -","- C30 H36 B N -","- C60 H72 B2 N2 -","2","0.5","CR0304","King, Jnr, J. A.; Bryant, Jnr, G. L.","Structures of two <i>N</i>-acyl triethyl ammonium salts and one simple triethyl ammonium salt","Acta Crystallographica Section C","1991","47","10","2249","2252","10.1107/S0108270191005152","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","205956","2020-10-21","18:00:00",""
"2000243","7.5552","0.0008","7.763","0.001","9.073","0.001","110.742","0.009","99.57","0.009","100.309","0.009","474.12","0.11","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C10 H6 N2 O4 -","- C10 H6 N2 O4 -","- C20 H12 N4 O8 -","2","1","CR0316","Ammon, H. L.","Structure of 1,3-dinitronaphthalene","Acta Crystallographica Section C","1991","47","10","2252","2254","10.1107/S0108270191003463","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000244","10.2987","0.0006","10.2987","0.0006","10.2987","0.0006","90","","90","","90","","1092.31","0.11","","","","","","","","","","","","4","P a -3","-P 2ac 2ab 3","","","","","- Br2 H12 Ni O12 -","- Br2 H12 Ni O12 -","- Br8 H48 Ni4 O48 -","4","0.166667","CR0303","Blackburn, A. C.; Gallucci, J. C.; Gerkin, R. E.","Structure of hexaaquanickel(II) bromate","Acta Crystallographica Section C","1991","47","9","1786","1789","10.1107/S0108270191002196","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000246","5.0148","0.0005","5.0148","0.0005","14.324","0.001","90","","90","","120","","360.22","0.06","","","","","","","","","","","","3","R -3 :H","-R 3","148","","","","- Ge Mn O3 -","- Ge Mn O3 -","- Ge6 Mn6 O18 -","6","0.333333","LI0067","Ross, N. L.; Reynard, B.; Guyot, F.","Structure of high-pressure MnGeO~3~ ilmenite","Acta Crystallographica Section C","1991","47","9","1794","1796","10.1107/S0108270191003153","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","281832","2023-03-13","07:36:37",""
"2000247","3.85","0.001","23.73","0.03","13.667","0.009","90","","90","","90","","1248.6","1.8","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H12 O5 -","- C16 H12 O5 -","- C64 H48 O20 -","4","1","AB0156","Ulický, L.; Kožíšek, J.; Ječný, J.","Structure of an anthracene derivative","Acta Crystallographica Section C","1991","47","9","1879","1881","10.1107/S0108270191001166","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000248","23.95","0.02","6.55","0.006","26.59","0.02","90","","96.4","0.1","90","","4145","6","","","","","","","","","","","","4","I 1 2/a 1","-I 2ya","","","","","- C25 H18 Cl2 O -","- C25 H18 Cl2 O -","- C200 H144 Cl16 O8 -","8","1","LI0064","Barnes, J. C.; Horspool, W. M.; Mackie, F. I.","6,6-Dichloro-1-methyl-3,4,5-triphenylbicyclo[3.1.0]hex-3-en-2-one and 3-chloro-2-methyl-4,5,6-triphenylphenol","Acta Crystallographica Section C","1991","47","9","1881","1885","10.1107/S0108270191001932","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000249","12.211","0.008","26.5","0.02","12.477","0.009","90","","99.12","0.01","90","","3986","5","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H19 Cl O -","- C25 H19 Cl O -","- C200 H152 Cl8 O8 -","8","2","LI0064","Barnes, J. C.; Horspool, W. M.; Mackie, F. I.","6,6-Dichloro-1-methyl-3,4,5-triphenylbicyclo[3.1.0]hex-3-en-2-one and 3-chloro-2-methyl-4,5,6-triphenylphenol","Acta Crystallographica Section C","1991","47","9","1881","1885","10.1107/S0108270191001932","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000250","13.107","0.012","11.828","0.008","7.74","0.006","90","","109.93","0.06","90","","1128.1","1.6","","","","","","","","","","","","3","P 1 21 1","","","","","","- C10 H16 O4 -","- C10 H16 O4 -","- C40 H64 O16 -","4","2","LI0059","Barnes, J. C.; Paton, J. D.; Blyth, C. S.; Howie, R. A.","Camphoric acid and ammonium hydrogen camphorate monohydrate","Acta Crystallographica Section C","1991","47","9","1888","1892","10.1107/S0108270191001713","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","199646","2020-10-21","18:00:00",""
"2000251","13.013","0.005","13.013","0.005","6.326","0.007","90","","90","","120","","927.7","1.1","","","","","","","","","","","","4","P 32","","","","","","- C10 H21 N O5 -","- C10 H21 N O5 -","- C30 H63 N3 O15 -","3","1","LI0059","Barnes, J. C.; Paton, J. D.; Blyth, C. S.; Howie, R. A.","Camphoric acid and ammonium hydrogen camphorate monohydrate","Acta Crystallographica Section C","1991","47","9","1888","1892","10.1107/S0108270191001713","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","199646","2020-10-21","18:00:00",""
"2000252","12.69","0.003","6.14","0.001","19.66","0.004","90","","106.74","0.02","90","","1466.9","0.5","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 O2 -","- C20 H16 O2 -","- C80 H64 O8 -","4","1","CR0275","Badejo, I. T.; Fry, J. L.; Karaman, R.; Nadkarni, D.; Pinkerton, A. A.","9-(Cyclohepta-2,4,6-trien-1-yl)xanthen-9-ol. X-ray crystal structure and computationally optimized structures compared","Acta Crystallographica Section C","1991","47","9","1895","1898","10.1107/S0108270191001038","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000253","8.975","0.001","14.727","0.001","13.151","0.003","90","","93.46","0.01","90","","1735.1","0.5","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H6 O S4 -","- C5 H6 O S4 -","- C40 H48 O8 S32 -","8","2","AB0174","Mogensen, P. K.; Simonsen, O.; Wainwright, C. E.; Underhill, A. E.","Structures of 4,5-bis(methylthio)-3<i>H</i>-1,2-dithiole-3-thione and 1,2-dithiole-3-thione[5,4-<i>b</i>]-5,6-dihydro-1,4-dithiin","Acta Crystallographica Section C","1991","47","9","1905","1908","10.1107/S0108270191001786","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000254","12.099","0.002","17.613","0.002","8.201","0.003","90","","108.43","0.02","90","","1658","0.7","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C5 H4 S5 -","- C5 H4 S5 -","- C40 H32 S40 -","8","2","AB0174","Mogensen, P. K.; Simonsen, O.; Wainwright, C. E.; Underhill, A. E.","Structures of 4,5-bis(methylthio)-3<i>H</i>-1,2-dithiole-3-thione and 1,2-dithiole-3-thione[5,4-<i>b</i>]-5,6-dihydro-1,4-dithiin","Acta Crystallographica Section C","1991","47","9","1905","1908","10.1107/S0108270191001786","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000255","6.678","0.003","9.635","0.003","9.947","0.005","114.79","0.03","106.01","0.04","90.39","0.04","553","0.5","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H13 N3 O -","- C12 H13 N3 O -","- C24 H26 N6 O2 -","2","1","LI0065","Bird, C. W.; Nyburg, S. C.; Parkins, A. W.","2,2-Dimethyl-1,2,3,4-tetrahydrobenzimidazo[3,2-<i>a</i>]pyrimid-4-one","Acta Crystallographica Section C","1991","47","9","1943","1945","10.1107/S0108270191002780","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000256","9.127","0.001","9.371","0.001","14.893","0.001","85.665","0.006","79.203","0.005","62.109","0.007","1105.8","0.2","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C24 H19 N O2 P Rh S -","- C24 N O2 P Rh S -","- C48 N2 O4 P2 Rh2 S2 -","2","1","AB0187","Basson, S. S.; Leipoldt, J. G.; Roodt, A.; Preston, H.","Structure of carbonyl(2-pyridinethiolato <i>N</i>-oxide-κ<i>O</i>,κ<i>S</i>)(triphenylphosphine)rhodium(I)","Acta Crystallographica Section C","1991","47","9","1961","1963","10.1107/S0108270191002512","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000257","9.97","0.004","9.9","0.002","19.79","0.01","90","","102.09","","90","","1910","1.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H47 Li2 O13 -","- C22 H21 Li O9 -","- C88 H84 Li4 O36 -","4","1","ST0494","Sachleben, R. A.; Burns, J. H.","Lithium dibenzo-14-crown-4-acetate–ethanol (2/1)","Acta Crystallographica Section C","1991","47","9","1968","1969","10.1107/S0108270191002858","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000258","12.07","0.02","9.976","0.01","22.76","0.04","90","","91.6","0.1","90","","2739","7","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 O4 Sn -","- C28 H40 O4 Sn -","- C112 H160 O16 Sn4 -","4","1","CR0312","Garbauskas, M. F.; Wengrovius, J. H.","Structure of dibutanidobis(2,4,6-trimethylbenzoato)tin","Acta Crystallographica Section C","1991","47","9","1969","1971","10.1107/S0108270191002950","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000259","6.623","0.001","10.81","0.002","15.297","0.002","90","","96.82","0.01","90","","1087.4","0.3","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 F N O2 -","- C12 H12 F N O2 -","- C48 H48 F4 N4 O8 -","4","1","CR0268","Kwiatkowski, W.; Karolak-Wojciechowska, J.","Structure of <i>N</i>-ethyl-<i>m</i>-fluorophenylsuccinimide","Acta Crystallographica Section C","1991","47","9","1978","1980","10.1107/S0108270191000872","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000260","11.196","0.002","16.49","0.003","7.733","0.001","90","","108.64","0.02","90","","1352.8","0.4","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 N2 O3 -","- C13 H18 N2 O3 -","- C52 H72 N8 O12 -","4","1","CR0290","Shoja, M.; Saba, S.","3-Isopropyl-2-(4-nitrophenyl)-2,3,4,5-tetrahydro-1,3-oxazine","Acta Crystallographica Section C","1991","47","9","1994","1996","10.1107/S0108270191001658","","","1.54184","cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000261","9.324","0.002","12.038","0.003","11.252","0.003","90","","90","","90","","1263","0.5","","","","","","","","","","","","6","P c a 21","P 2c -2ac","","","","","- C10 H14 F3 N O3 S -","- C10 F3 N O3 S -","- C40 F12 N4 O12 S4 -","4","1","HA0039","Tinant, B.; Declercq, J.-P.; Maliverney, C.; Viehe, H. G.","5-Methyl-4-(1-piperidyl)-5-trifluoromethyl-1,2-oxathiole","Acta Crystallographica Section C","1991","47","9","2000","2002","10.1107/S0108270191002238","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000262","10.428","0.003","24.094","0.007","16.197","0.004","90","","98.5","0.02","90","","4024.8","1.9","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H29 N S Si -","- C19 H29 N S Si -","- C152 H232 N8 S8 Si8 -","8","2","HA0040","Tinant, B.; Declercq, J.-P.; Roekens, B.","4-Phenylthio-2-(triisopropylsilyl)but-2-enenitrile","Acta Crystallographica Section C","1991","47","9","2007","2008","10.1107/S010827019100224X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000263","16.439","0.003","9.448","0.002","7.478","0.002","90","","90","","90","","1161.5","0.4","","","","","","","","","","","","3","P b c n","-P 2n 2ab","","","","","- C14 H10 N4 -","- C14 H10 N4 -","- C56 H40 N16 -","4","0.5","ST0509","Huang, N.-T.; Pennington, W. T.; Petersen, J. D.","Structure of 2,3-bis(2-pyridyl)pyrazine","Acta Crystallographica Section C","1991","47","9","2011","2012","10.1107/S010827019100272X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000264","16.17","0.01","8.15","0.01","32.01","0.01","90","","93.52","0.04","90","","4210","6","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C4 H22 N8 O15 S2 Th -","- C4 H22 N8 O15 S2 Th -","- C32 H176 N64 O120 S16 Th8 -","8","1","MU0237","Habash, J.; Beddoes, R. L.; Smith, A. J.","Structure of aquabis(sulfato)tetrakis(urea)thorium(IV) dihydrate","Acta Crystallographica Section C","1991","47","8","1595","1597","10.1107/S0108270191001543","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","189368","2020-10-21","18:00:00",""
"2000265","5.424","0.004","5.594","0.006","12.078","0.009","83","0.08","85.73","0.06","85.18","0.07","361.7","0.5","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H12 Ca O14 P2 -","- C6 H12 Ca O14 P2 -","- C6 H12 Ca O14 P2 -","1","0.5","MU0223","Lis, T.; Kuczek, M.","Structure of calcium bis(phosphoenolpyruvate) dihydrate","Acta Crystallographica Section C","1991","47","8","1598","1600","10.1107/S0108270191001531","","","0.71069","mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000266","18.195","0.008","9.436","0.003","11.316","0.005","90","","90","","90","","1942.8","1.4","","","","","","","","","","","","6","P n a 21","","","","","","- C11 H23 Co Na O9 P3 -","- C11 H23 Co Na O9 P3 -","- C44 H92 Co4 Na4 O36 P12 -","4","1","MU0208","Kläui, W.; Matt, D.; Balegroune, F.; Grandjean, D.","Structure of an organometallic polymer, [Na{(η^5^-C~5~H~5~)Co[P(O)(OMe)~2~]~3~}]~<i>n~</i>","Acta Crystallographica Section C","1991","47","8","1614","1617","10.1107/S010827019100152X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000267","7.382","0.001","21.494","0.004","8.032","0.001","90","","94.26","0.01","90","","1270.9","0.3","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C10 H10 Cl Cu N4 O3.5 -","- C10 H10 Cl Cu N4 O3.5 -","- C40 H40 Cl4 Cu4 N16 O14 -","4","1","AB0184","Mathews, I. I.; Manohar, H.","Structure of a monochloro bridged polymeric copper(II)-di-2-pyridylamine complex: [Cu(dipyam)Cl(NO~3~)].0.5H~2~O","Acta Crystallographica Section C","1991","47","8","1621","1624","10.1107/S0108270191001233","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2000268","6.793","0.002","7.209","0.011","11.405","0.004","88.77","0.07","89.06","0.02","74.62","0.06","538.4","0.9","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 N2 O4 -","- C12 H12 N2 O4 -","- C24 H24 N4 O8 -","2","1","MU0215","Baggett, N.; Case, M. A.; Foulon, J.-D.; Gray, C. J.; Hamor, T. A.","The rearrangement of coumarin-4-acethydrazides. Structure of 1-amino-4-(2-hydroxy-4-methoxyphenyl)-2,6(1<i>H</i>,3<i>H</i>)-pyridinedione","Acta Crystallographica Section C","1991","47","8","1670","1672","10.1107/S0108270190013890","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","200475","2020-10-21","18:00:00",""
"2000269","11.348","0.001","4.854","0.001","14.629","0.001","90","","99.87","0.01","90","","793.89","0.19","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 N2 O6 -","- C14 H20 N2 O6 -","- C28 H40 N4 O12 -","2","0.5","MU0218","Główka, M. L.","Structure of the 4-oxo-2-butenoic acid alkyl ester moiety. III. Structures of diethyl <i>N</i>,<i>N</i>'-(ethylenediamino)bis(4-oxo-2-butenoate) and propyl 4-oxo-4-ureido-2-butenoate","Acta Crystallographica Section C","1991","47","8","1680","1683","10.1107/S0108270190013932","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000270","39.365","0.002","10.147","0.001","9.937","0.001","90","","90","","90","","3969.2","0.6","","","","","","","","","","","","4","P c c n","","","","","","- C8 H12 N2 O4 -","- C8 H12 N2 O4 -","- C128 H192 N32 O64 -","16","2","MU0218","Główka, M. L.","Structure of the 4-oxo-2-butenoic acid alkyl ester moiety. III. Structures of diethyl <i>N</i>,<i>N</i>'-(ethylenediamino)bis(4-oxo-2-butenoate) and propyl 4-oxo-4-ureido-2-butenoate","Acta Crystallographica Section C","1991","47","8","1680","1683","10.1107/S0108270190013932","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000271","9.131","0.001","9.131","0.001","8.146","0.003","90","","90","","90","","679.2","0.3","","","","","","","","","","","","4","P 4/n c c","-P 4a 2ac","","","","","- As2 H4 O9 V -","- As2 H4 O9 V -","- As8 H16 O36 V4 -","4","","CR0308","Wang, S.-L.; Lee, W.-C.","Structure of vanadyl(IV) dihydrogenarsenate","Acta Crystallographica Section C","1991","47","8","1709","1711","10.1107/S0108270191002214","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000272","15.239","0.002","16.376","0.003","28.964","0.004","90","","90","","90","","7228.1","1.9","","","","","","","","","","","","7","P b c a","","","","","","- C19 H46 Cl2 Fe2 Mo3 N6 O13 -","- C19 H46 Cl2 Fe2 Mo3 N6 O13 -","- C152 H368 Cl16 Fe16 Mo24 N48 O104 -","8","1","ST0478","Lettko, K.; Liu, S.; Zubieta, J.","Structure of [<i>L</i>Fe(μ-MoO~4~)~3~Fe<i>L</i>].CH~2~Cl~2~.H~2~O (<i>L</i> = 1,4,7-trimethyl-1,4,7-triazacyclononane)","Acta Crystallographica Section C","1991","47","8","1723","1725","10.1107/S0108270191002111","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","194538","2020-10-21","18:00:00",""
"2000273","6.671","0.001","6.683","0.001","16.357","0.003","93.1","0.02","92.85","0.01","117.69","0.01","642.46","0.19","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H30 Ni O22 -","- C18 H30 Ni O22 -","- C18 H30 Ni O22 -","1","0.5","MU0234","Pech, R.; Pickardt, J.","Hexaaquanickel(II) bis[1,2,3-benzenetricarboxylate(1‒)] tetrahydrate","Acta Crystallographica Section C","1991","47","8","1731","1732","10.1107/S0108270191001567","","","0.71069","mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000274","8.982","0.004","9.155","0.004","16.514","0.005","90","","114.18","0.03","90","","1238.8","0.9","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C4 H10 Mn O6 -","- C4 H10 Mn O6 -","- C24 H60 Mn6 O36 -","6","1.5","CR0307","Cheng, C.-Y.; Wang, S.-L.","Structure of manganese acetate dihydrate","Acta Crystallographica Section C","1991","47","8","1734","1736","10.1107/S0108270191002202","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000275","7.827","0.002","9.796","0.002","15.548","0.004","76.53","0.02","75.4","0.02","74.36","0.02","1093.4","0.5","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H8 Br N3 O -","- C11 H7 Br N3 O -","- C44 H28 Br4 N12 O4 -","4","2","CR0291","Cody, V.; Wojtczak, A.","Structure of 6-oxo-1,6-dihydro-3,4'-bipyridine-5-carbonitrile hydrogen bromide","Acta Crystallographica Section C","1991","47","8","1742","1744","10.1107/S0108270191000355","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000276","16.474","0.001","13.132","0.001","7.638","0.001","90","","99.24","0.01","90","","1630.9","0.3","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 N4 -","- C20 H16 N4 -","- C80 H64 N16 -","4","0.5","AB0171","Woźniak, K.","Structure of 2,3-di(2-pyridyl)-6,7-dimethylquinoxaline","Acta Crystallographica Section C","1991","47","8","1761","1763","10.1107/S0108270191001269","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000277","9.759","0.001","12.252","0.002","13.017","0.002","90","","108.65","0.01","90","","1474.7","0.4","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 I2 Mn2 O8 -","- C8 I2 Mn2 O8 -","- C32 I8 Mn8 O32 -","4","1","CR0280","Davies, J. A.; El-Ghanam, M.; Pinkerton, A. A.","Di-μ-iodo-bis[tetracarbonylmanganese(I)]","Acta Crystallographica Section C","1991","47","7","1356","1358","10.1107/S010827019100015X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000278","13.278","0.005","24.462","0.008","10.823","0.003","90","","90","","90","","3515","2","","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C39 H33 Br2 N O Os P2 -","- C39 H33 Br2 N O Os P2 -","- C156 H132 Br8 N4 O4 Os4 P8 -","4","1","CR0287","Robinson, P. D.; Ali, I. A.; Hinckley, C. C.","Structures of <i>c</i>-acetonitrile-<i>ab</i>-dibromo-<i>d</i>-carbonyl-<i>ef</i>-bis(triphenylphosphine)osmium(2+) and <i>b</i>-acetonitrile-<i>af</i>-dibromo-<i>d</i>-carbonyl-<i>ce</i>-bis(triphenylphosphine)osmium(2+)","Acta Crystallographica Section C","1991","47","7","1397","1401","10.1107/S0108270191000173","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000279","10.326","0.005","15.461","0.01","22.961","0.008","90","","91.15","0.05","90","","3665","3","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C39 H33 Br2 N O Os P2 -","- C39 H33 Br2 N O Os P2 -","- C156 H132 Br8 N4 O4 Os4 P8 -","4","1","CR0287","Robinson, P. D.; Ali, I. A.; Hinckley, C. C.","Structures of <i>c</i>-acetonitrile-<i>ab</i>-dibromo-<i>d</i>-carbonyl-<i>ef</i>-bis(triphenylphosphine)osmium(2+) and <i>b</i>-acetonitrile-<i>af</i>-dibromo-<i>d</i>-carbonyl-<i>ce</i>-bis(triphenylphosphine)osmium(2+)","Acta Crystallographica Section C","1991","47","7","1397","1401","10.1107/S0108270191000173","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000280","11.296","0.004","8.471","0.003","18.889","0.002","90","","98.83","0.02","90","","1786","0.9","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H7 F N2 -","- C12 H7 F N2 -","- C96 H56 F8 N16 -","8","1","AB0101","Hökelek, T.","Structural investigations of benzo[<i>c</i>]cinnoline derivatives. III. Structure of 2-fluorobenzo[<i>c</i>]cinnoline","Acta Crystallographica Section C","1991","47","7","1432","1434","10.1107/S0108270190011611","","","1.54184","cu","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000281","5.632","0.001","14.636","0.003","13.914","0.003","90","","90.57","0.01","90","","1146.9","0.4","","","","","","","","","","","","4","P 1 21 1","","","","","","- C10 H15 N3 O5 -","- C10 H15 N3 O5 -","- C40 H60 N12 O20 -","4","2","AB0162","Padmaja, N.; Ramakumar, S.; Viswamitra, M. A.","Structure of 5-methylcytidine","Acta Crystallographica Section C","1991","47","7","1445","1448","10.1107/S0108270190012264","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","199682","2020-10-21","18:00:00",""
"2000282","10.154","0.007","11.82","0.009","15.038","0.008","96.02","0.05","107.54","0.04","110.34","0.05","1569","2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H40 N2 O10 -","- C30 H40 N2 O10 -","- C60 H80 N4 O20 -","2","1","AB0170","Stensland, B.; Batt, J.-P.; Lamouri, A.; Godfroid, J.-J.","Platelet activating factor antagonists. Structure of <i>N</i>,<i>N</i>'-bis(3,4,5-trimethoxybenzoyl)-2-piperazinylmethyl 2,2-dimethylpropanoate","Acta Crystallographica Section C","1991","47","7","1453","1457","10.1107/S0108270190012446","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","200475","2020-10-21","18:00:00",""
"2000283","10.28","0.01","15.45","0.03","6.752","0.002","90","","95.88","0.06","90","","1067","2","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 N O4 -","- C11 H11 N O4 -","- C44 H44 N4 O16 -","4","1","HE0004","Bałczewski, P.; Beddoes, R. L.; Joule, J. A.","Structure of methyl 1,3-dihydro-4-methyl-3-oxofuro[3,4-<i>b</i>]pyridin-1-ylacetate","Acta Crystallographica Section C","1991","47","7","1457","1460","10.1107/S0108270190012434","","","1.54178","cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000284","9.709","0.002","13.311","0.002","17.487","0.005","90","","116.29","0.05","90","","2026.2","1.2","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Br F -","- C12 H8 Br F -","- C96 H64 Br8 F8 -","8","2","ST0469","Gleason, W. B.; Brostrom, M.; Etter, M. C.; Johnson, R. B.","Structure of 4-bromo-4'-fluorobiphenyl","Acta Crystallographica Section C","1991","47","7","1473","1476","10.1107/S0108270190012811","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000285","10.397","0.004","23.018","0.016","11.667","0.003","90","","90","","90","","2792","2","","","","","","","","","","","","4","P c a 21","","","","","","- C31 H41 N O3 -","- C31 H41 N O3 -","- C124 H164 N4 O12 -","4","1","CR0273","Luss, H. R.; Texter, J.","Structure of <i>N</i>-{4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl}-1-hydroxy-2-naphthalenecarboxamide","Acta Crystallographica Section C","1991","47","7","1491","1493","10.1107/S0108270190012859","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","190701","2020-10-21","18:00:00",""
"2000286","4.748","0.003","8.362","0.006","11.428","0.007","90","","92.01","0.03","90","","453.4","0.5","","","","","","","","","","","","3","P 1 21 1","","","","","","- C7 H16 O7 -","- C7 H16 O7 -","- C14 H32 O14 -","2","1","AB0175","Kopf, J.; Köll, P.; Angyal, S. J.","Structure of <small>D</small>-<i>glycero</i>-<small>L</small>-<i>galacto</i>-heptitol","Acta Crystallographica Section C","1991","47","7","1503","1506","10.1107/S010827019001349X","","","1.54051","cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000287","5.005","0.005","17.69","0.009","18.7","0.01","90","","90","","90","","1656","2","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 N2 O5 -","- C17 H22 N2 O5 -","- C68 H88 N8 O20 -","4","1","CR0283","Krause, J. A.; Eggleston, D. S.","Proline conformations in linear peptides. Structure determination of the methyl ester of <i>N</i>-benzyloxycarbonyl-<small>L</small>-prolyl-<small>D</small>-alanine (<i>N</i>-Z-<small>L</small>-Pro-<small>D</small>-Ala-OMe)","Acta Crystallographica Section C","1991","47","7","1508","1512","10.1107/S0108270191000161","","","1.54056","cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000288","7.1738","0.0008","10.11","0.002","13.394","0.002","70.34","0.01","75.61","0.01","79.34","0.01","880.6","0.2","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H22 Br N5 O4 -","- C14 H22 Br N5 O4 -","- C28 H44 Br2 N10 O8 -","2","1","AB0167","Kivekäs, R.; Sundberg, M. R.; Ruiz, J.; Colacio, E.","6-Amino-1,3-dimethyl-5-(2-ethylphenylazonio)uracil bromide dihydrate","Acta Crystallographica Section C","1991","47","7","1512","1515","10.1107/S010827019001318X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000289","10.385","0.002","16.419","0.003","7.539","0.005","90","","106.73","0.04","90","","1231.1","0.9","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 N2 O4 -","- C14 H12 N2 O4 -","- C56 H48 N8 O16 -","4","1","LI0058","Street, J. D.; Mills, O. S.; Joule, J. A.","Structure of 1-acetyl-7,8-dimethoxypyrrolo[2,3,4-<i>ij</i>]isoquinolin-2(1<i>H</i>)-one","Acta Crystallographica Section C","1991","47","7","1523","1525","10.1107/S0108270190013907","","","0.71069","mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000290","5.2789","0.0005","14.998","0.002","5.4868","0.0005","90","","90","","90","","434.41","0.08","","","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C1.65 Al0.35 Ca1.6 Co O5 Pr0.37 -","- Al Ca2 Co2 O5 Pr2 -","- Al4 Ca8 Co8 O20 Pr8 -","4","0.5","CR0289","Lee, J. Y.; Swinnea, J. S.; Steinfink, H.","(Ca~1{-~<i>x</i>}Pr~<i>x~</i>)~2~(Co~1{-~<i>y</i>}Al~<i>y~</i>)~2~O~5~, a brownmillerite structure","Acta Crystallographica Section C","1991","47","7","1532","1534","10.1107/S0108270191000343","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2000291","10.09","0.003","7.578","0.006","16.454","0.005","90","","103.92","0.01","90","","1221.2","1.1","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 Br2 N3 Pt S -","- C10 H7 Br2 N3 Pt S -","- C40 H28 Br8 N12 Pt4 S4 -","4","1","ST0491","Rong, M.; Muir, M. M.; Cádiz, M. E.; Muir, J. A.","Structure of a platinum(II) complex with a ligand containing thiazole and benzimidazole","Acta Crystallographica Section C","1991","47","7","1539","1541","10.1107/S0108270191000318","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000292","5.7017","0.0006","9.404","0.001","22.104","0.004","91.45","0.01","93.17","0.01","104.17","0.01","1146.4","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H39 N S3 -","- C21 H39 N S3 -","- C42 H78 N2 S6 -","2","1","AB0173","Hjorth, M.; Thorup, N.; Jørgensen, M.; Bechgaard, K.","Structure of 2-<i>N</i>,<i>N</i>-dimethylamino-5-hexadecyl-1,3-dithiolium-4-thiolate","Acta Crystallographica Section C","1991","47","7","1548","1550","10.1107/S0108270190013038","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000293","12.768","0.002","7.416","0.003","19.206","0.003","90","","98.71","0.01","90","","1797.6","0.8","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- C20 H22 N4 O2 -","- C18 H18 N4 O4 -","- C72 H72 N16 O16 -","4","1","AB0178","Leban, I.; Svete, J.; Stanovnik, B.; Tišler, M.","Structure of the 1:1 adduct of 2-phenyl-4-(4,6-dimethyl-2-pyrimidinyl)aminomethylene-5(4<i>H</i>)-oxazolone and acetic acid","Acta Crystallographica Section C","1991","47","7","1552","1554","10.1107/S0108270191000276","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000294","11.076","0.001","11.314","0.001","12.155","0.001","104.41","0.01","102.02","0.01","89.37","0.01","1441.6","0.2","","","","","","","","","","","","4","P 1","P 1","1","","","","- C27 H32 N2 O7 -","- C27.5 H32 N2 O7 -","- C55 H64 N4 O14 -","2","2","MU0231","Driessen, R. A. J.; Fraanje, J.","Structure of methyl (4a<i>S</i>,5<i>R</i>,7a<i>R</i>,11a<i>R</i>,12a<i>S</i>)-2-benzyl-2,3,4,4a,5,6,7,7a,8,10,11a,12-dodecahydro-7,7-(ethylenedioxy)-1,9-dioxooxazolo[3',4':1,2]pyrrolo[5,4-<i>i</i>]isoquinoline-5-carboxylate toluene (2/1)","Acta Crystallographica Section C","1991","47","7","1554","1557","10.1107/S0108270191000653","","","1.54184","cu","","","","","","","","","","","","","","","","","has coordinates","208347","2020-10-21","18:00:00",""
"2000295","10.2759","0.0012","22.353","0.003","10.4051","0.0012","90","","106.502","0.009","90","","2291.6","0.5","","","","","","","","","","","","4","P 1 21 1","","","","","","- C48 H66 N4 O11 -","- C48 H65 N4 O11 -","- C96 H130 N8 O22 -","2","1","ST0486","Lynch, V. M.; Stamford, A.; Magnus, P.; Davis, B. E.","Structure of 18'-epivinblastine","Acta Crystallographica Section C","1991","47","7","1563","1566","10.1107/S010827019100029X","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000296","8.813","0.002","9.043","0.002","25.643","0.005","90","","90","","90","","2043.6","0.8","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H31 N O2 -","- C23 H31 N O2 -","- C92 H124 N4 O8 -","4","1","ST0488","Lynch, V. M.; Yaser, H. K.; Whitesell, J. K.; Davis, B. E.","The structure at 198 K of (1<i>R</i>,5<i>R</i>,15<i>R</i>,16<i>R</i>)-5-isopropenyl-2-methyl-1-[<i>N</i>-(<i>trans</i>-2-phenylcyclohexyloxycarbonyl)amino]-2-cyclohexene","Acta Crystallographica Section C","1991","47","7","1566","1568","10.1107/S0108270191000306","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000297","13.155","0.002","13.397","0.002","12.369","0.002","90","","90","","90","","2179.9","0.6","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H31 Cl O4 -","- C23 H31 Cl O4 -","- C92 H124 Cl4 O16 -","4","1","CR0285","Wawrzak, Z.; Grochulski, P.; Galdecki, Z.; Griffin, J. F.; Strong, P. D.; Duax, W. L.","Structure of 6α-chloro-3,20-dioxo-4-pregnen-17α-yl acetate","Acta Crystallographica Section C","1991","47","7","1568","1570","10.1107/S0108270191000331","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000298","6.7201","0.0005","7.3601","0.0004","10.7671","0.0006","97.607","0.005","108.002","0.005","93.935","0.006","498.62","0.06","","","","","","","","","","","","5","P -1","-P 1","2","","","","- H10 I K2 Na O10 -","- H10 I K2 Na O10 -","- H20 I2 K4 Na2 O20 -","2","1","AB0172","Kellersohn, T.","Structure of potassium sodium orthoperiodate(VII) tetrahydrate","Acta Crystallographica Section C","1991","47","6","1133","1136","10.1107/S0108270190013269","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000299","13.058","0.005","16.153","0.009","7.585","0.004","90","","90","","90","","1599.9","1.4","","","","","","","","","","","","4","I b a 2","","","","","","- C10 H12 Ni S8 -","- C10 H12 Ni S8 -","- C40 H48 Ni4 S32 -","4","0.5","ST0464","Geiser, U.; Tytko, S. F.; Allen, T. J.; Wang, H. H.; Kini, A. M.; Williams, J. M.","Structure of bis(2,3-dimercapto-6,7-dihydro-5<i>H</i>-1,4-dithiepin)nickel(IV) at 295 and 109 K","Acta Crystallographica Section C","1991","47","6","1164","1167","10.1107/S0108270190013117","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000300","13.027","0.003","16.042","0.006","7.486","0.002","90","","90","","90","","1564.4","0.8","","","","","","","","","","","","4","I b a 2","","","","","","- C10 H12 Ni S8 -","- C10 H12 Ni S8 -","- C40 H48 Ni4 S32 -","4","0.5","ST0464","Geiser, U.; Tytko, S. F.; Allen, T. J.; Wang, H. H.; Kini, A. M.; Williams, J. M.","Structure of bis(2,3-dimercapto-6,7-dihydro-5<i>H</i>-1,4-dithiepin)nickel(IV) at 295 and 109 K","Acta Crystallographica Section C","1991","47","6","1164","1167","10.1107/S0108270190013117","","","0.71069","mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000301","7.976","0.001","8.959","0.003","24.936","0.008","90","","99","0.02","90","","1759.9","0.9","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 F6 Fe O2 P -","- C18 H15 F6 Fe O2 P -","- C72 H60 F24 Fe4 O8 P4 -","4","1","ST0468","Abboud, K. A.; Simonsen, S. H.; Piórko, A.; Sutherland, R. G.","Structure of (η^5^-cyclopentadienyl)(1,2,3,4,4a,10a-η^6^-2-methyldibenzo[<i>b</i>,<i>e</i>][1,4]dioxine)iron(II) hexafluorophosphate at 163 K","Acta Crystallographica Section C","1991","47","6","1198","1202","10.1107/S0108270190014111","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000302","15.415","0.006","16.422","0.005","15.535","0.004","90","","90","","90","","3933","2","","","","","","","","","","","","5","P b c a","","","","","","- C14 H16 N10 Ni S2 -","- C14 H16 N10 Ni S2 -","- C112 H128 N80 Ni8 S16 -","8","1","MU0213","Koman, M.; Jóna, E.; Mašlejová, A.","Structural investigations of nickel(II) complexes. IX. Structure of tetrakis(imidazole)bis(isothiocyanato)nickel(II)","Acta Crystallographica Section C","1991","47","6","1206","1208","10.1107/S0108270190013920","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000303","8.429","0.006","11.271","0.003","12.606","0.003","76.302","0.008","78.32","0.004","78.227","0.008","1124","0.9","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H29 N3 O7 S -","- C21 H29 N3 O8 S -","- C42 H58 N6 O16 S2 -","2","1","MU0168","Eliopoulos, E.; Sheldrick, B.; Hamodrakas, S.","4,5-Dimethoxy-2-[3-(1,4-oxazinan-4-yl)-3-oxopropyl]-<i>N</i>-(2-pyridyl)benzenesulfonamide methanol solvate","Acta Crystallographica Section C","1991","47","6","1212","1215","10.1107/S0108270190010174","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","206341","2020-10-21","18:00:00",""
"2000304","10.819","0.005","6.591","0.006","18.044","0.008","90","","92.91","0.04","90","","1285","1.4","","","","","","","","","","","","3","P 1 21 1","","","","","","- C24 H36 O11 -","- C24 H36 O11 -","- C48 H72 O22 -","2","1","ST0487","Sun, K.-L.; Chan, J. A.; Baures, P. W.; Eggleston, D. S.","Paucin methanolate","Acta Crystallographica Section C","1991","47","6","1253","1256","10.1107/S0108270190014068","","","1.5406","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000305","10.071","0.007","19.218","0.015","19.406","0.014","90","","90","","90","","3756","5","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2R)-2-Ethyl-2-methyl-4-phenyl-N-[(S)-1-phenylethyl]-(E)-3-butenamide","","- C21 H25 N O -","- C21 H25 N O -","- C168 H200 N8 O8 -","8","2","LI0051","Alcock, N. W.; Richards, C. J.; Thomas, S. E.","Structure of a chiral amide derived from a (vinylketenimine)tricarbonyliron(0) complex","Acta Crystallographica Section C","1991","47","6","1261","1263","10.1107/S0108270190011143","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000306","9.637","0.002","9.82","0.002","11.505","0.002","73.4","0.01","65.41","0.01","69.29","0.01","913.7","0.3","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C32 H30 Cu F6 N4 O6 S2 -","- C32 H30 Cu F6 N4 O6 S2 -","- C32 H30 Cu F6 N4 O6 S2 -","1","0.5","LI0049","Gou, S.-H.; You, X.-Z.; Xu, Z.; Zhou, Z.-Y.; Yu, K.-B.; Yu, Y.-P.; Zhu, D.-L.","Structure of <i>catena</i>-poly{bis[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato-κ^2^<i>O</i>,<i>O</i>']copper-μ-(4,4'-bipyridine)-κ<i>N</i>:κ<i>N</i>'}–<i>N</i>,<i>N</i>-dimethylformamide (1/2)","Acta Crystallographica Section C","1991","47","6","1303","1305","10.1107/S0108270190011672","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000307","7.978","0.002","9.428","0.002","9.627","0.002","75.46","0.02","67.86","0.02","73.84","0.02","635.5","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H44 Al4 N4 -","- C18 H44 Al4 N4 -","- C18 H44 Al4 N4 -","1","0.5","ST0480","Self, M. F.; Pennington, W. T.; Robinson, G. H.","Structure of a second polymorph of [Al(CH~3~)]~2~[14]aneN~4~[Al(CH~3~)~3~]~2~","Acta Crystallographica Section C","1991","47","6","1309","1310","10.1107/S0108270190013130","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208360","2020-10-21","18:00:00",""
"2000308","10.678","0.002","15.924","0.004","27.237","0.005","90","","100.92","0.02","90","","4547.4","1.7","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H56 O10 Os3 P2 Pt -","- C37 H56 O10 Os3 P2 Pt -","- C148 H224 O40 Os12 P8 Pt4 -","4","1","MU0219","Farrugia, L. J.","Structure of 1,2,2,2,3,3,3,4,4,4-decacarbonyl-1,2:3,4-di-μ-hydrido-1-tricyclohexylphosphine-3-triisopropylphosphineplatinumtriosmium(2 <i>Pt</i>‒<i>Os</i>)(3 <i>Os</i>‒<i>Os</i>)","Acta Crystallographica Section C","1991","47","6","1310","1312","10.1107/S0108270190013944","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000309","9.7046","0.0009","13.742","0.003","16.285","0.001","90","","90","","90","","2171.8","0.5","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H35 Br2 N3 Ni O4 -","- C15 H35 Br2 N3 Ni O4 -","- C60 H140 Br8 N12 Ni4 O16 -","4","1","MU0222","Farrugia, L. J.; Peacock, R. D.","Structure of 1,4,7-tris[(2<i>S</i>)-2-hydroxypropyl]-1,4,7-triazacyclononanenickel(II) dibromide monohydrate","Acta Crystallographica Section C","1991","47","6","1312","1313","10.1107/S0108270190014007","","","0.71069","mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000310","12.514","0.001","15.067","0.001","9.588","0.001","90","","107.47","0.01","90","","1724.4","0.3","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 O4 -","- C20 H20 O4 -","- C80 H80 O16 -","4","1","ST0481","Mullica, D. F.; Belew, J. S.; Sappenfield, E. L.; Leschnitzer, D. H.","Structure of ethyl 3'-ethyl-6-methoxy-5'-oxo-1,2-cyclopent-1',3'-dienonaphthalene-4'-acetate","Acta Crystallographica Section C","1991","47","6","1330","1332","10.1107/S0108270190013063","","","1.54184","cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000311","5.9496","0.001","11.483","0.003","40.262","0.007","90","","90","","90","","2750.7","1","","","","","","","","","","","","4","P b c a","","","","","","- C15 H16 O4 S -","- C15 H16 O4 S -","- C120 H128 O32 S8 -","8","1","ST0484","Lynch, V. M.; Daniel, D.; Martin, S. F.; Davis, B. E.","Structure of (±)-3-benzyloxy-2,3,3a,7a-tetrahydrobenzo[<i>b</i>]thiophen-5(4<i>H</i>)-one 1,1-dioxide","Acta Crystallographica Section C","1991","47","6","1340","1342","10.1107/S0108270190013142","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000312","8.2878","0.0008","31.018","0.004","9.2267","0.0007","90","","105.211","0.007","90","","2288.8","0.4","","","","","","","","","","","","4","P 1 21 1","","","","","","- C47 H66 N4 O12 -","- C47 H66 N4 O12 -","- C94 H132 N8 O24 -","2","1","ST0489","Lynch, V. M.; Stamford, A.; Magnus, P.; Davis, B. E.","Structure of a novel bisindole derivative","Acta Crystallographica Section C","1991","47","6","1342","1345","10.1107/S0108270190013191","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000313","9.359","0.002","10.117","0.001","24.71","0.004","90","","90","","90","","2339.7","0.7","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H35 N O4 -","- C25 H35 N O4 -","- C100 H140 N4 O16 -","4","1","ST0490","Lynch, V. M.; Austin, R. E.; Martin, S. F.; George, T.","Determination of the absolute configuration of a novel dipeptide isostere","Acta Crystallographica Section C","1991","47","6","1345","1347","10.1107/S0108270190013208","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000314","8.433","0.002","12.932","0.001","10.503","0.003","90","","111.77","0.01","90","","1063.7","0.4","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 N O S -","- C11 H13 N O S -","- C44 H52 N4 O4 S4 -","4","1","LI0060","Yeap, G.-Y.; Fun, H.-K.; Teo, S.-B.; Teoh, S.-G.","Structure of 1-(2-methyl-2,3-dihydrobenzothiazol-2-yl)-2-propanone","Acta Crystallographica Section C","1991","47","6","1347","1348","10.1107/S0108270190013695","","","0.71069","mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000315","8.886","0.008","15.025","0.007","11.928","0.005","90","","90","","90","","1592.5","1.7","","","","","","","","","","","","6","P c c n","","","","","","- C10 H10 Br2 Cu N8 O -","- C10 H10 Br2 Cu N8 O -","- C40 H40 Br8 Cu4 N32 O4 -","4","0.5","AB0165","van Albada, G. A.; de Graaff, R. A. G.; Haasnoot, J. G.; Schild, J.; Reedijk, J.","Structure of aquadibromobis(1,2,4-triazolo[1,5-<i>a</i>]pyrimidine-<i>N</i>3)copper(II), a one-dimensional alternating copper(II)^{···^} oxygen array","Acta Crystallographica Section C","1991","47","5","946","949","10.1107/S010827019001191X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000316","11.586","0.002","7.279","0.001","13.742","0.002","90","","96.02","0.02","90","","1152.5","0.3","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C16 H32 Cu2 N6 O4 -","- C16 H32 Cu2 N8 O4 -","- C32 H64 Cu4 N16 O8 -","2","0.5","LI0052","Zukerman-Schpector, J.; Castellano, E. E.; De Simone, C. A.; Oliva, G.; Mauro, A. E.","Structure of di-μ-cyanato-bis[cyanato(<i>N</i>,<i>N</i>-diethylethylenediamine)copper(II)], [Cu(NCO)~2~(diEten)]~2~","Acta Crystallographica Section C","1991","47","5","957","959","10.1107/S0108270190011416","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000317","18.829","0.003","8.809","0.003","20.969","0.003","90","","90","","90","","3478","1.4","","","","","","","","","","","","5","P b c n","","","","","","- C16 H15 Cl3 O Te -","- C16 H15 Cl3 O Te -","- C128 H120 Cl24 O8 Te8 -","8","1","LI0056","Zukerman-Schpector, J.; Castellano, E. E.; Oliva, G.; Comasseto, J. V.; Stefani, H. A.","Structure of dichloro[(<i>Z</i>)-2-chloro-2-<i>p</i>-tolylvinyl](<i>p</i>-methoxyphenyl)tellurium(VI)","Acta Crystallographica Section C","1991","47","5","960","962","10.1107/S0108270190012288","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2000318","17.696","0.003","7.175","0.004","17.155","0.001","90","","117.15","0.01","90","","1938.2","1.1","","","","","","","","","","","","7","I 1 2/c 1","","","","","","- C3 H11 Cl2 N2 O P Pt -","- C3 H12 Cl2 N2 O1.5 P Pt -","- C24 H96 Cl16 N16 O12 P8 Pt8 -","8","1","AB0164","Macíček, J.; Angelova, O.; Dodoff, N.","Structure of <i>cis</i>-dichloro[methylphosphinylidenebis(methylamine-<i>N</i>,<i>N</i>')]platinum(II) hemihydrate","Acta Crystallographica Section C","1991","47","5","971","973","10.1107/S0108270190012689","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000319","10.697","0.001","11.467","0.002","14.229","0.002","90","","98.86","0.01","90","","1724.5","0.4","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H28 O2 -","- C20 H28 O2 -","- C80 H112 O8 -","4","2","TR0399","Reynolds, W. F.; Lough, A. J.; Sawyer, J. F.; Enriquez, R. G.; Ortiz, B.; Walls, F.","Structure of (4α)-kaura-9(11),16-dien-18-oic acid (grandiflorenic acid), an active ingredient of the Mexican medicinal plant zoapatle","Acta Crystallographica Section C","1991","47","5","973","977","10.1107/S0108270190008186","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000320","15.74","0.001","17.279","0.003","8.757","0.002","90","","101.67","0.01","90","","2332.4","0.7","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 N4 O3 -","- C24 H32 N4 O3 -","- C96 H128 N16 O12 -","4","1","MU0210","Główka, M. L.; Codding, P. W.","Structure of <i>N</i>-[4-hydroxy-3,5-bis(1-pyrrolidinylmethyl)phenyl]-<i>N</i>'-(4-methoxyphenyl)urea","Acta Crystallographica Section C","1991","47","5","1038","1040","10.1107/S010827019001023X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000321","10.313","0.0007","14.292","0.002","10.6086","0.0008","90","","99.135","0.007","90","","1543.8","0.3","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H24 O -","- C17 H24 O -","- C68 H96 O4 -","4","1","MU0214","De Ridder, D. J. A.; Schenk, H.","Crystal studies of musk compounds. III. Structures of 6-acetyl-1,1,2,3,3,5-hexamethylindan (musk phantolid) (I) and 6-acetyl-3-isopropyl-1,1,3,5-tetramethylindan (II)","Acta Crystallographica Section C","1991","47","5","1044","1047","10.1107/S0108270190010435","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000322","6.279","0.004","7.306","0.005","11.177","0.007","90","","90","","90","","512.7","0.6","","","","","","","","","","","","4","P b c m","","","","","","- La2 O4 Se Si -","- La2 O4 Se Si -","- La8 O16 Se4 Si4 -","4","0.5","ST0474","Brennan, T. D.; Ibers, J. A.","Lanthanum orthosilicate selenide, La~2~SeSiO~4~","Acta Crystallographica Section C","1991","47","5","1062","1064","10.1107/S010827019001201X","","","0.7093","mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000323","8.476","0.005","13.747","0.002","15.951","0.003","90","","90","","90","","1858.6","1.2","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H27 Au Cl P -","- C18 H27 Au Cl P -","- C72 H108 Au4 Cl4 P4 -","4","1","ST0467","Muir, J. A.; Cuadrado, S. I.; Muir, M. M.","Structure of chloro(dicyclohexylphenylphosphine)gold(I)","Acta Crystallographica Section C","1991","47","5","1072","1074","10.1107/S0108270190011994","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000324","8.524","0.002","8.524","0.002","17.452","0.004","90","","90","","90","","1268","0.5","","","","","","","","","","","","5","P 42/m n m","","","","","","- C18 H18 F12 Ni O6 -","- C18 H18 F12 Ni O6 -","- C36 H36 F24 Ni2 O12 -","2","0.125","ST0475","Cervantes-Lee, F.; Porter, L. C.","Structure of bis(hexafluoroacetylacetonato)bis(tetrahydrofuran)nickel(II)","Acta Crystallographica Section C","1991","47","5","1076","1077","10.1107/S0108270190011581","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000325","11.688","0.003","15.377","0.005","9.466","0.002","90","","90","","90","","1701.3","0.8","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H24 O4 -","- C20 H24 O4 -","- C80 H96 O16 -","4","1","CR0274","Duax, W. L.; Duax, S. J.; Strong, P. D.","Structure of 3-hydroxy-17-oxoestra-1,3,5(10)-trien-11β-yl acetate","Acta Crystallographica Section C","1991","47","5","1094","1096","10.1107/S0108270190011775","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000326","9.527","0.002","11.182","0.003","7.078","0.001","90","","108.45","0.01","90","","715.3","0.3","","","","","","","","","","","","3","P 1 21 1","","","","","","- C18 H22 O2 -","- C18 H22 O2 -","- C36 H44 O4 -","2","1","CR0272","Duax, W. L.; Griffin, J. F.; Strong, P. D.","Structure of 9β-estrone","Acta Crystallographica Section C","1991","47","5","1096","1097","10.1107/S0108270190011763","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000327","14.358","0.002","9.297","0.001","9.011","0.001","90","","90","","90","","1202.8","0.3","","","","","","","","","","","","3","P c a 21","","","","","","- C13 H16 O3 -","- C13 H16 O3 -","- C52 H64 O12 -","4","1","LI0057","Zukerman-Schpector, J.; De Simone, C. A.; Castellano, E. E.; Oliva, G.; Tercio, J.; Ferreira, B.; Catani, V.","Structure of 6,7-dimethoxy-2,2-dimethyl-2<i>H</i>-chromene, a natural precocene","Acta Crystallographica Section C","1991","47","5","1111","1113","10.1107/S0108270190011854","","","0.71073","mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000328","7.083","0.001","5.072","0.001","12.794","0.008","90","","102.34","0.02","90","","449","0.3","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H8 N2 -","- C12 H8 N2 -","- C24 H16 N4 -","2","0.5","AB0166","Woźniak, K.; Kariuki, B.; Jones, W.","Structure of phenazine","Acta Crystallographica Section C","1991","47","5","1113","1114","10.1107/S0108270190011842","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000329","8.7302","0.0012","15.597","0.002","14.463","0.002","90","","104.797","0.01","90","","1904","0.5","","","","","","","","","","","","4","P 1 21 1","","","","","","- C38 H56 N2 O9 -","- C38 H56 N2 O9 -","- C76 H112 N4 O18 -","2","1","ST0470","Lynch, V. M.; Lee, W.-C.; Martin, S. F.; Davis, B. E.","Structure of a fully protected seco-erythronolide B acid derivative","Acta Crystallographica Section C","1991","47","5","1117","1120","10.1107/S0108270190012008","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000330","11.591","0.003","13.308","0.002","20.154","0.003","96.91","0.012","96.95","0.02","114.1","0.02","2767.1","1.1","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C54 H55 Fe3 O20 -","- C54 H55 Fe3 O20 -","- C108 H110 Fe6 O40 -","2","1","ST0463","Lynch, V. M.; Sibert, J. W.; Sessler, J. L.; Davis, B. E.","Structure of aqua-hexakis(μ~2~-benzoato)-bis(methanol)-μ~3~-oxo-triiron(III) benzoate ethanol methanol solvate","Acta Crystallographica Section C","1991","47","4","866","869","10.1107/S010827019001085X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","200475","2020-10-21","18:00:00",""
"2000331","11.03","0.01","10.29","0.01","25.03","0.02","90","","116.8","0.1","90","","2536","5","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H29 Cu N3 O4 -","- C27 H29 Cu N3 O4 -","- C108 H116 Cu4 N12 O16 -","4","1","LI0054","Breuer, S. W.; Small, R. W. H.","Bis(acetato)(4-benzyl-1,7-diphenyl-2,4,6-triazahepta-2,5-diene-κ^2^<i>N</i>^2^,<i>N</i>^6^)copper(II)","Acta Crystallographica Section C","1991","47","4","871","872","10.1107/S0108270190010988","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000332","7.439","0.002","7.561","0.002","20.104","0.005","94.11","0.02","90.95","0.02","117.57","0.02","998.2","0.5","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H16 Cl4 Co N4 O -","- C16 H16 Cl4 Co N4 O -","- C32 H32 Cl8 Co2 N8 O2 -","2","1","AB0147","Lindroos, S.; Lumme, P.","Structure of di(quinoxalinium) tetrachlorocobaltate(II) monohydrate","Acta Crystallographica Section C","1991","47","4","872","874","10.1107/S0108270190011064","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","278247","2022-09-28","15:09:31",""
"2000333","9.986","0.002","12.998","0.004","14.17","0.005","106.18","0.03","94.18","0.02","91.59","0.02","1759.5","0.9","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H59 Cl P2 Pt -","- C30 H58 Cl P2 Pt -","- C60 H116 Cl2 P4 Pt2 -","2","1","ST0465","Mullica, D. F.; Sappenfield, E. L.; Leschnitzer, D. H.","Chloro(tri-<i>tert</i>-butylphosphino-<i>C</i>,<i>P</i>)(tricyclohexylphosphine)platinum(II)","Acta Crystallographica Section C","1991","47","4","874","876","10.1107/S0108270190011179","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","200475","2020-10-21","18:00:00",""
"2000334","6.694","0.001","17.498","0.001","34.959","0.005","90","","90","","90","","4094.8","0.9","","","","","","","","","","","","2","P b c a","","","","","","- C28 H24 -","- C28 H24 -","- C224 H192 -","8","1","ST0461","Abboud, K. A.; Simonsen, S. H.; Prasad, R. S.; Roberts, R. M.","Structure of <i>cis</i>-9,10-dibenzyl-9,10-dihydroanthracene at 193 K","Acta Crystallographica Section C","1991","47","4","880","882","10.1107/S0108270190010605","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000335","10.5052","0.0007","16.442","0.002","10.3415","0.0008","90","","95.358","0.006","90","","1778.4","0.3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 N2 O4 -","- C20 H22 N2 O4 -","- C80 H88 N8 O16 -","4","1","ST0466","Lynch, V. M.; Mortimore, M.; Martin, S. F.; Davis, B. E.","Structure of (±)-7(<i>S</i>)-16-deformyl-21-oxogeissoschizine‒oxindole","Acta Crystallographica Section C","1991","47","4","908","910","10.1107/S0108270190010617","","","0.71073","MO","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000336","10.667","0.003","10.7972","0.0014","16.509","0.005","90","","90","","90","","1901.4","0.8","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 O8 -","- C20 H26 O8 -","- C80 H104 O32 -","4","1","ST0471","Lynch, V. M.; Zinke, P. W.; Martin, S. F.; Davis, B. E.","Structure of a key intermediate in the asymmetric synthesis of (+)-KDO","Acta Crystallographica Section C","1991","47","4","910","912","10.1107/S0108270190011039","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000337","5.2717","0.0001","5.2717","0.0001","11.5801","0.0002","90","","90","","90","","321.82","0.01","","","","","","","","","","","","4","I 41/a :1","I 4bw -1bw","88","","","","- Bi Mo Na O4 -","- Bi2 Mo2 O4 -","- Bi8 Mo8 O16 -","4","0.25","CR0345","Teller, R. G.","Refinement of some Na~0.5{-~<i>x</i>}<i>M</i>'~0.5+<i>x~/3</i>\σquare ~2<i>x~/3</i>MoO~4~, <i>M</i>' = Bi, Ce, La, scheelite structures with powder neutron and X-ray diffraction data","Acta Crystallographica Section C","1992","48","12","2101","2104","10.1107/S0108270192001434","","","1.54154","Cu","","","","","","","","","","","","","","","","","has coordinates","176343","2020-10-21","18:00:00",""
"2000338","5.2785","0.0001","5.2785","0.0001","11.641","0.0002","90","","90","","90","","324.348","0.01","","","","","","","","","","","","4","I 41/a :1","I 4bw -1bw","88","","","","- Bi Mo Na O4 -","- Bi2 Mo2 O4 -","- Bi8 Mo8 O16 -","4","0.25","CR0345","Teller, R. G.","Refinement of some Na~0.5{-~<i>x</i>}<i>M</i>'~0.5+<i>x~/3</i>\σquare ~2<i>x~/3</i>MoO~4~, <i>M</i>' = Bi, Ce, La, scheelite structures with powder neutron and X-ray diffraction data","Acta Crystallographica Section C","1992","48","12","2101","2104","10.1107/S0108270192001434","","","1.54154","Cu","","","","","","","","","","","","","","","","","has coordinates","176343","2020-10-21","18:00:00",""
"2000339","5.3167","0.0004","5.3167","0.0004","11.66","0.0011","90","","90","","90","","329.6","0.05","","","","","","","","","","","","4","I 41/a :1","I 4bw -1bw","88","","","","- Ce Mo Na O4 -","- Ce2 Mo2 O4 -","- Ce8 Mo8 O16 -","4","0.25","CR0345","Teller, R. G.","Refinement of some Na~0.5{-~<i>x</i>}<i>M</i>'~0.5+<i>x~/3</i>\σquare ~2<i>x~/3</i>MoO~4~, <i>M</i>' = Bi, Ce, La, scheelite structures with powder neutron and X-ray diffraction data","Acta Crystallographica Section C","1992","48","12","2101","2104","10.1107/S0108270192001434","","","1.5415","Cu","","","","","","","","","","","","","","","","","has coordinates","176343","2020-10-21","18:00:00",""
"2000340","5.3424","0.0004","5.3424","0.0004","11.7376","0.0011","90","","90","","90","","335.01","0.05","","","","","","","","","","","","4","I 41/a :1","I 4bw -1bw","88","","","","- La Mo Na O4 -","- La2 Mo2 O4 -","- La8 Mo8 O16 -","4","0.25","CR0345","Teller, R. G.","Refinement of some Na~0.5{-~<i>x</i>}<i>M</i>'~0.5+<i>x~/3</i>\σquare ~2<i>x~/3</i>MoO~4~, <i>M</i>' = Bi, Ce, La, scheelite structures with powder neutron and X-ray diffraction data","Acta Crystallographica Section C","1992","48","12","2101","2104","10.1107/S0108270192001434","","","1.5415","Cu","","","","","","","","","","","","","","","","","has coordinates","176343","2020-10-21","18:00:00",""
"2000341","7.524","0.002","7.512","0.002","7.395","0.002","90","","117.88","0.02","90","","369.45","0.18","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- Co3 H4 O10 P2 -","- Co3 H4 O10 P2 -","- Co6 H8 O20 P4 -","2","0.5","BX0567","Effenberger, H.","Structure refinement of Co~3~(OH)~2~(PO~3~OH)~2~ and Co[PO~2~(OH)~2~]~2~.2H~2~O","Acta Crystallographica Section C","1992","48","12","2104","2107","10.1107/S0108270192002920","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000342","7.268","0.002","9.886","0.003","5.331","0.001","90","","94.86","0.02","90","","381.66","0.17","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Co H8 O10 P2 -","- Co H8 O10 P2 -","- Co2 H16 O20 P4 -","2","0.5","BX0567","Effenberger, H.","Structure refinement of Co~3~(OH)~2~(PO~3~OH)~2~ and Co[PO~2~(OH)~2~]~2~.2H~2~O","Acta Crystallographica Section C","1992","48","12","2104","2107","10.1107/S0108270192002920","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000343","12.3777","0.0004","7.21","0.0003","24.0192","0.0009","90","","99.67","0.002","90","","2113.09","0.14","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- Al Co F7 Na2 -","- Al Co F7 Na2 -","- Al16 Co16 F112 Na32 -","16","2","DU0332","Gravereau, P.; Boireau, A.; Dance, J. M.; Trut, L.; Tressaud, A.","Structure of the cobalt weberite Na~2~CoAlF~7~","Acta Crystallographica Section C","1992","48","12","2108","2111","10.1107/S0108270192004621","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000344","9.105","0.002","9.588","0.002","11.753","0.003","78.21","0.02","80.45","0.02","69.72","0.01","937","0.4","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H15 Cl Cu N4 O8 -","- C16 H13 Cl Cu N4 O12 -","- C32 H26 Cl2 Cu2 N8 O24 -","2","1","MU0283","Muñoz, M. C.; Ruiz, R.; Mollar, M.; Lloret, F.; Julve, M.; Solans, X.","Structure of methanol(nitrato)(2,2':6',2''-terpyridyl)copper(II) perchlorate","Acta Crystallographica Section C","1992","48","12","2111","2114","10.1107/S0108270192003342","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000345","9.79","0.003","18.05","0.004","15.118","0.004","90","","105.86","0.03","90","","2569.8","1.2","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25.5 H23 Au Cl2 P2 Se -","- C25.5 H23 Au Cl2 P2 Se -","- C102 H92 Au4 Cl8 P8 Se4 -","4","1","HA0101","Jones, P. G.; Thöne, C.","Chloro[diphenyl(diphenylphosphino-κ<i>P</i>-methyl)phosphine selenide]gold(I) dichloromethane hemisolvate at 178 K","Acta Crystallographica Section C","1992","48","12","2114","2116","10.1107/S0108270192003949","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","202201","2020-10-21","18:00:00",""
"2000346","13.694","0.004","16.519","0.005","7.74","0.002","102.51","0.02","103.43","0.02","81.1","0.02","1652.5","0.8","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C17 H23 Ir O S -","- C17 H23 Ir O S -","- C68 H92 Ir4 O4 S4 -","4","2","HH0574","Chen, J.; Daniels, L. M.; Angelici, R. J.","Structure of a ring-opened 2,5-dimethylthiophene complex, (η^5^C~5~Me~5~)Ir(CO)(<i>C</i>,<i>S</i>-Me~2~C~4~H~2~S)","Acta Crystallographica Section C","1992","48","12","2120","2122","10.1107/S0108270192003895","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206333","2020-10-21","18:00:00",""
"2000347","6.545","0.004","10.235","0.005","12.174","0.006","74.4","0.03","85.02","0.04","78.64","0.03","769.6","0.7","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H8 Cu N2 O4 -","- C16 Cu N2 O4 -","- C32 Cu2 N4 O8 -","2","1","BX0579","Cueto, S.; Rys, P.; Straumann, H.-P.; Gramlich, V.; Rys, F. S.","Structure of copper(II) 3-cyanobenzoate","Acta Crystallographica Section C","1992","48","12","2122","2124","10.1107/S0108270192002932","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000348","7.408","0.003","14.318","0.005","7.188","0.003","90","","112.59","0.04","90","","703.9","0.5","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C8 H12 Cl4 N4 Sn -","- C8 H12 Cl4 N4 Sn -","- C16 H24 Cl8 N8 Sn2 -","2","0.5","NA1002","Casellato, U.; Graziani, R.; Sánchez González, A.","Structure of dichlorobis(2-chloroimidazole)dimethyltin(IV)","Acta Crystallographica Section C","1992","48","12","2125","2126","10.1107/S0108270192003822","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2000349","12.488","0.002","14.198","0.003","16.848","0.003","66.65","0.03","69.65","0.03","86.66","0.03","2560.4","1.2","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C78 H98 Cl12 Gd4 N12 O24 -","- C78 H98 Cl12 Gd4 N12 O24 -","- C78 H98 Cl12 Gd4 N12 O24 -","1","0.5","HH0610","Smith, P. H.; Ryan, R. R.","Structure of a gadolinium hexaaza macrocycle complex with a Gd~2~(OAc)~8~ counterion","Acta Crystallographica Section C","1992","48","12","2127","2130","10.1107/S0108270192003810","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000350","11.163","0.002","15.499","0.003","10.427","0.002","90","","94.18","0.03","90","","1799.2","0.6","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C41 H38 Co O P3 S -","- C41 H38 Co O P3 S -","- C82 H76 Co2 O2 P6 S2 -","2","1","AS1001","Wei, G.; Huang, Z.; Lei, X.; Cao, R.; Jiang, F.; Hong, M.; Liu, H.","Structure of [bis(2-diphenylphosphinoethyl)phenylphosphine-<i>P</i>,<i>P</i>,<i>P</i>]carbonyl(phenylthiolato)cobalt(I), [Co{Ph~2~PCH~2~CH~2~P(Ph)CH~2~CH~2~PPh~2~}(SPh)(CO)]","Acta Crystallographica Section C","1992","48","12","2130","2132","10.1107/S0108270192003731","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000351","18.411","0.009","12.769","0.006","8.323","0.005","90","","100.72","0.06","90","","1922.5","1.8","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C4 H22 O18 P4 Sr -","- C4 H22 O18 P4 Sr -","- C16 H88 O72 P16 Sr4 -","4","0.5","DU0334","Rochdaoui, R.; Silvestre, J.-P.; Quy Dao, Nguyen; Lee, M.-R.; Neuman, A.","Structure du trihydrogéno hydroxy-1 ethanedi(phosphonate)-1,1 de strontium tétrahydrate","Acta Crystallographica Section C","1992","48","12","2132","2135","10.1107/S0108270192003780","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000352","14.913","0.003","17.348","0.003","8.168","0.002","90","","90","","90","","2113.1","0.8","","","","","","","","","","","","4","F m m 2","","","","","","- C20 H30 Cl2 U -","- C20 H30 Cl2 U -","- C80 H120 Cl8 U4 -","4","0.25","HA0097","Spirlet, M. R.; Rebizant, J.; Apostolidis, C.; Kanellakopulos, B.","Bis(cyclopentadienyl) actinide(IV) compounds. I. The structure of dichlorobis(pentamethyl-η^5^-cyclopentadienyl)uranium(IV) and dichlorobis(pentamethyl-η^5^-cyclopentadienyl)thorium(IV)","Acta Crystallographica Section C","1992","48","12","2135","2137","10.1107/S0108270192003603","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","189212","2020-10-21","18:00:00",""
"2000353","14.939","0.004","17.535","0.005","8.201","0.002","90","","90","","90","","2148.3","1","","","","","","","","","","","","4","F m m 2","","","","","","- C20 H30 Cl2 Th -","- C20 H30 Cl2 Th -","- C80 H120 Cl8 Th4 -","4","0.25","HA0097","Spirlet, M. R.; Rebizant, J.; Apostolidis, C.; Kanellakopulos, B.","Bis(cyclopentadienyl) actinide(IV) compounds. I. The structure of dichlorobis(pentamethyl-η^5^-cyclopentadienyl)uranium(IV) and dichlorobis(pentamethyl-η^5^-cyclopentadienyl)thorium(IV)","Acta Crystallographica Section C","1992","48","12","2135","2137","10.1107/S0108270192003603","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","189212","2020-10-21","18:00:00",""
"2000354","14.041","0.002","13.126","0.001","19.21","0.004","90","","96.08","0.01","90","","3520.5","0.9","","","","","","","","","","","","6","C 1 2/c 1","","","","","","- C36 H30 Cl3 Mo O3 P2 -","- C36 H30 Cl4 Mo O4 P2 -","- C144 H120 Cl16 Mo4 O16 P8 -","4","0.5","GR0199","Owens, B. E.; Poli, R.","Structures of two molybdenum oxo complexes [MoOCl~3~(OPPh~3~)~2~] and [MoOI(dmpe)~2~]I","Acta Crystallographica Section C","1992","48","12","2137","2140","10.1107/S010827019200475X","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000355","11.31","0.002","15.58","0.006","13.741","0.003","90","","96.58","0.02","90","","2405.3","1.2","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H32 I2 Mo O P4 -","- C12 H32 I2 Mo O P4 -","- C48 H128 I8 Mo4 O4 P16 -","4","1","GR0199","Owens, B. E.; Poli, R.","Structures of two molybdenum oxo complexes [MoOCl~3~(OPPh~3~)~2~] and [MoOI(dmpe)~2~]I","Acta Crystallographica Section C","1992","48","12","2137","2140","10.1107/S010827019200475X","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000356","27.217","0.012","11.708","0.002","8.416","0.006","90","","104.82","0.02","90","","2593","2","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","","","","","- C36 H28 N4 O2 Pt S24 -","- C36 H28 N4 O2 Pt S24 -","- C72 H56 N8 O4 Pt2 S48 -","2","0.25","PA0279","Fettouhi, M.; Ouahab, L.; Grandjean, D.; Mousdis, G.; Delhaes, P.","Structure of two tetrakis(3,4-ethylenedithio-2,2',5,5'-tetrathiafulvalene) tetracyanometallate dihydrate salts: β-[EDTTTF]~4~[<i>M</i>(CN)~4~].2H~2~O, <i>M</i> = Pt^II^, Pd^II^","Acta Crystallographica Section C","1992","48","12","2141","2144","10.1107/S0108270192003676","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2000357","26.79","0.016","11.736","0.004","8.467","0.004","90","","104.19","0.05","90","","2581","2","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","","","","","- C36 H28 N4 O2 Pd S24 -","- C36 H28 N4 O2 Pd S24 -","- C72 H56 N8 O4 Pd2 S48 -","2","0.25","PA0279","Fettouhi, M.; Ouahab, L.; Grandjean, D.; Mousdis, G.; Delhaes, P.","Structure of two tetrakis(3,4-ethylenedithio-2,2',5,5'-tetrathiafulvalene) tetracyanometallate dihydrate salts: β-[EDTTTF]~4~[<i>M</i>(CN)~4~].2H~2~O, <i>M</i> = Pt^II^, Pd^II^","Acta Crystallographica Section C","1992","48","12","2141","2144","10.1107/S0108270192003676","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2000358","8.3737","0.0008","10.6469","0.0008","22.429","0.002","90","","90","","90","","1999.6","0.3","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C22 H32 O5 -","- C22 H32 O5 -","- C88 H128 O20 -","4","1","GE0309","Puliti, R.; Gavagnin, M.; Cimino, G.; Mattia, C. A.; Mazzarella, L.","Structure of chelonaplysin C: a spongian diterpenoid from nudibranch <i>Chromodoris luteorosea</i>","Acta Crystallographica Section C","1992","48","12","2145","2147","10.1107/S0108270192003196","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000359","19.362","0.001","6.703","0.001","20.011","0.001","90","","109.656","0.004","90","","2445.8","0.4","","","","","","","","","","","","3","P 1 2/n 1","","","","","","- C15 H20 O2 -","- C7.5 H4 O -","- C60 H32 O8 -","8","2","HH0596","Lloyd, B. A.; Arif, A. M.; Allred, E. L.","Pyramidalization in a tetracyclic perpendicular diene derivative","Acta Crystallographica Section C","1992","48","12","2147","2151","10.1107/S0108270192003809","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000360","13.1959","0.0008","13.1959","0.0008","26.6986","0.0011","90","","90","","90","","4649.1","0.4","","","","","","","","","","","","3","P 42/m b c","-P 4c 2ab","","","","","- C23 H32 O8 -","- C24 H34 O8 -","- C192 H272 O64 -","8","0.5","DU0316","Drouin, M.; Lamothe, S.; Michel, A. G.","Functionalized hydrocarbons with condensed ring skeletons. XII. A methyltricyclo[8.4.0.0^2,7^]tetradec-8-ene and a vinylcyclododeca-3,9-diene, products from competing intramolecular Diels-Alder cycloadditions","Acta Crystallographica Section C","1992","48","12","2151","2154","10.1107/S0108270192004426","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000361","12.767","0.005","10.199","0.003","19.175","0.003","90","","109.21","0.02","90","","2357.8","1.2","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H32 O8 -","- C23 H32 O8 -","- C92 H128 O32 -","4","1","DU0316","Drouin, M.; Lamothe, S.; Michel, A. G.","Functionalized hydrocarbons with condensed ring skeletons. XII. A methyltricyclo[8.4.0.0^2,7^]tetradec-8-ene and a vinylcyclododeca-3,9-diene, products from competing intramolecular Diels-Alder cycloadditions","Acta Crystallographica Section C","1992","48","12","2151","2154","10.1107/S0108270192004426","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000362","24.911","0.004","10.028","0.002","17.042","0.002","90","","121.367","0.008","90","","3635","1.1","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H19 N O2 S2 -","- C21 H19 N O2 S2 -","- C168 H152 N8 O16 S16 -","8","1","HE0048","Beddoes, R. L.; Griera, R.; Alvarez, M.; Joule, J. A.","Structure of 2,3-dihydro-1-methylquinolin-2-spiro-2'-indan-3'-spiro-2''-(1'',3''-dithiane)-4,1'-dione","Acta Crystallographica Section C","1992","48","12","2154","2157","10.1107/S0108270192002531","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000363","7.137","0.001","14.438","0.003","16.11","0.003","90","","90","","90","","1660","0.5","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C9 H9 N O3 -","- C9 H12 N O3 -","- C72 H96 N8 O24 -","8","1","AB0273","Maurin, J. K.; Paul, I. C.; Curtin, D. Y.","Structure of <i>p</i>-acetylbenzoic acid oxime","Acta Crystallographica Section C","1992","48","12","2163","2165","10.1107/S0108270192003159","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2000364","9.169","0.001","9.37","0.001","13.883","0.002","90","","92.028","0.004","90","","1192","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H11 N O3 -","- C14 H11 N O3 -","- C56 H44 N4 O12 -","4","1","AB0272","Maurin, J. K.; Paul, I. C.; Curtin, D. Y.","Structure of 3-benzoylbenzoic acid oxime","Acta Crystallographica Section C","1992","48","12","2165","2167","10.1107/S0108270192003147","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000365","26.157","0.005","5.979","0.001","19.492","0.003","90","","97.79","0.01","90","","3020.3","0.9","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C136 H120 N8 O32 -","8","1","GE0306","Giordano, F.","Structure of methyl 3-benzyl-5-phenyl-3<i>H</i>-1,2,4-dioxazole-3-carboxylate","Acta Crystallographica Section C","1992","48","12","2172","2174","10.1107/S0108270192003871","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000366","13.327","0.005","19.277","0.008","6.361","0.002","90","","90","","90","","1634.2","1","","","","","","","","","","","","4","P 21 21 2","","","","","","- C17 H22 O3 S -","- C17 H21 O3 S -","- C68 H84 O12 S4 -","4","1","AL0533","Rambaud, J.; Pauvert, B.; Boussab, A.; Terol, A.; Chevallet, P.; Declercq, J.-P.","Structure of polymorph II of (1<i>R</i>,3<i>S</i>)-1,2,2-trimethyl-3-(4-methylthiobenzoyl)cyclopentanecarboxylic acid","Acta Crystallographica Section C","1992","48","12","2174","2177","10.1107/S010827019200338X","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000367","14.589","0.002","8.33","0.003","8.186","0.004","90","","103.17","0.02","90","","968.6","0.6","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 N O -","- C12 H13 N O -","- C48 H52 N4 O4 -","4","1","GR0201","Eggleston, D. S.; Baures, P. W.; Grabowska, U.; Marson, C. M.; Walsgrove, T.","Structures of three tricyclic γ-lactams","Acta Crystallographica Section C","1992","48","12","2177","2181","10.1107/S0108270192003111","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000368","9.1","0.003","9.678","0.004","17.36","0.002","90","","90","","90","","1528.9","0.8","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H19 N O -","- C19 H19 N O -","- C76 H76 N4 O4 -","4","1","GR0201","Eggleston, D. S.; Baures, P. W.; Grabowska, U.; Marson, C. M.; Walsgrove, T.","Structures of three tricyclic γ-lactams","Acta Crystallographica Section C","1992","48","12","2177","2181","10.1107/S0108270192003111","","","1.5406","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000369","8.121","0.005","16.257","0.004","8.686","0.002","90","","107.65","0.02","90","","1092.8","0.8","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 N O -","- C13 H15 N O -","- C52 H60 N4 O4 -","4","1","GR0201","Eggleston, D. S.; Baures, P. W.; Grabowska, U.; Marson, C. M.; Walsgrove, T.","Structures of three tricyclic γ-lactams","Acta Crystallographica Section C","1992","48","12","2177","2181","10.1107/S0108270192003111","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000370","14.3799","0.0007","5.0922","0.0007","16.4737","0.0011","90","","108.717","0.004","90","","1142.5","0.19","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H15 N O3 -","- C12 H15 N O3 -","- C48 H60 N4 O12 -","4","2","AB0233","Kozma, D.; Larsen, S.; Ács, M.","Structure of (<i>R</i>)-<i>N</i>-(1-phenylethyl)succinamic acid at 110 K","Acta Crystallographica Section C","1992","48","12","2182","2185","10.1107/S0108270192003652","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates,has disorder","205898","2020-10-21","18:00:00",""
"2000371","10.572","0.004","12.91","0.005","9.547","0.004","94.85","0.03","111.62","0.03","75.4","0.04","1172.2","0.9","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","2","HH0584","Chen, Z.; Masnovi, J.; Baker, R. J.; Krafcik, R. B.; Towns, R. L. R.","Structures of 9-ethyl-3-nitrocarbazole and 1-(9-carbazolyl)-3-(3-nitro-9-carbazolyl)propane","Acta Crystallographica Section C","1992","48","12","2185","2189","10.1107/S0108270192003792","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000372","13.1193","0.0003","8.8488","0.0002","9.3648","0.0004","100.35","0.03","103.16","0.02","92.61","0.02","1037.14","0.16","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C27 H21 N3 O2 -","- C27 H21 N3 O2 -","- C54 H42 N6 O4 -","2","1","HH0584","Chen, Z.; Masnovi, J.; Baker, R. J.; Krafcik, R. B.; Towns, R. L. R.","Structures of 9-ethyl-3-nitrocarbazole and 1-(9-carbazolyl)-3-(3-nitro-9-carbazolyl)propane","Acta Crystallographica Section C","1992","48","12","2185","2189","10.1107/S0108270192003792","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000373","13.331","0.003","13.797","0.005","28.179","0.006","90","","90","","90","","5183","2","298","","298","","","","","","","","","5","P b c a","","","","","","- C25 H35 I N2 O4 -","- C25 H35 I N2 O4 -","- C200 H280 I8 N16 O32 -","8","1","NA0017","Dapporto, P.; Paoli, P.; Sega, A.","{2-[<i>p</i>-(<i>o</i>-Butoxybenzamido)benzoyloxy]ethyl}diethylmethylammonium iodide","Acta Crystallographica Section C","1992","48","12","2189","2192","10.1107/S010827019200413X","","","0.71069","Mo-Kalpha","","","0.065","","","0.07","","","","","3.05","3.05","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000374","6.746","0.001","7.712","0.001","12.62","0.01","90","","102.86","0.01","90","","640.1","0.5","","","","","","","","","","","","3","P 1 21 1","","","","","","- C13 H24 O3 -","- C13 H24 O3 -","- C26 H48 O6 -","2","1","AL0522","Rodríguez, M. L.; Brito B, I.; González, A. G.; Almonacid, L. N.; Pérez, C.; Trujillo, J. M.","Structure of a new C~13~-norisoprenoid","Acta Crystallographica Section C","1992","48","12","2192","2194","10.1107/S0108270192002610","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000375","10.307","0.003","9.364","0.003","7.394","0.002","90","","104.65","0.02","90","","690.4","0.4","","","","","","","","","","","","4","P 1 21 1","","","","","","- C13 H16 N2 O5 -","- C13 H16 N2 O5 -","- C26 H32 N4 O10 -","2","1","PA0277","Chiaroni, A.; Langlois, N.; Riche, C.; Snatzke, G.","Structure of (2<i>S</i>,5<i>S</i>)-2-hydroxymethyl-5-methoxy-<i>N</i>-<i>o</i>-nitrobenzoylpyrrolidine","Acta Crystallographica Section C","1992","48","12","2194","2196","10.1107/S0108270192003664","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000376","11.945","0.002","22.24","0.006","24.407","0.005","90","","90","","90","","6484","2","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H43 N O6 S -","- C33 H43 N O6 S -","- C264 H344 N8 O48 S8 -","8","2","HU1000","Andrews, J. F. P.; Regan, A. C.; Wallis, J. D.; Povey, D. C.","A substrate for the asymmetric Nazarov cyclization","Acta Crystallographica Section C","1992","48","12","2196","2199","10.1107/S010827019200492X","","","0.71069","MoKα","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000377","8.0903","0.0004","24.865","0.001","13.442","0.001","90","","96.79","0.01","90","","2685.1","0.3","","","","","","","","","","","","4","P 1 n 1","P -2yac","","","","","- C27 H33 O9 P -","- C27 H33 O9 P -","- C108 H132 O36 P4 -","4","2","CR0412","Nemeth, G.; Pinkerton, A. A.; Stowe, J. A.; Ogle, C. A.","Structure of tris(2,4,6-trimethoxyphenyl)phosphine. Resolution of space-group ambiguity by solid-state NMR","Acta Crystallographica Section C","1992","48","12","2200","2203","10.1107/S0108270192004402","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000378","10.677","0.002","26.122","0.003","13.053","0.002","90","","92.96","0.02","90","","3635.7","1","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C25 H22 O -","- C25 H22 O -","- C200 H176 O8 -","8","2","HA0099","Jones, P. G.; Schomburg, D.; Hopf, H.; Lehne, V.","Structures of three derivatives of 5,12-methano[2.2.2]paracyclophane","Acta Crystallographica Section C","1992","48","12","2203","2207","10.1107/S0108270192004141","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000379","15.714","0.002","31.126","0.005","11.476","0.002","90","","96.51","0.02","90","","5576.9","1.5","","","","","","","","","","","","3","C 1 c 1","C -2yc","","","","","- C25 H24 O -","- C25 H24 O -","- C300 H288 O12 -","12","3","HA0099","Jones, P. G.; Schomburg, D.; Hopf, H.; Lehne, V.","Structures of three derivatives of 5,12-methano[2.2.2]paracyclophane","Acta Crystallographica Section C","1992","48","12","2203","2207","10.1107/S0108270192004141","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000380","23.978","0.004","23.978","0.004","8.918","0.002","90","","90","","120","","4440.4","1.4","","","","","","","","","","","","3","R 3 :H","R 3","","","","","- C26 H26 O -","- C26 H26 O -","- C234 H234 O9 -","9","1","HA0099","Jones, P. G.; Schomburg, D.; Hopf, H.; Lehne, V.","Structures of three derivatives of 5,12-methano[2.2.2]paracyclophane","Acta Crystallographica Section C","1992","48","12","2203","2207","10.1107/S0108270192004141","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000381","6.737","0.001","7.803","0.007","10.444","0.001","94.747","0.008","108.3","0.01","97.43","0.01","512.4","0.5","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H16 N6 O12 -","- C16 H16 N6 O12 -","- C16 H16 N6 O12 -","1","0.5","AB0269","Nethaji, M.; Pattabhi, V.; Chhabra, N.; Poonia, N. S.","Structure of ethylenediammonium 3,5-dinitrobenzoate","Acta Crystallographica Section C","1992","48","12","2207","2209","10.1107/S0108270192004190","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","296843","2024-12-11","14:15:26",""
"2000382","11.455","0.003","12.401","0.004","12.549","0.003","72.64","0.02","64.2","0.02","62.74","0.02","1415.7","0.8","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C10 H30 B2 F8 O7 S5 U -","- C5 H15 B F4 O3.5 S2.5 U0.5 -","- C20 H60 B4 F16 O14 S10 U2 -","4","2","DU0328","Deshayes, L.; Keller, N.; Lance, M.; Nierlich, M.; Vigner, D.","Structure of pentakis(dimethyl sulfoxide)dioxouranium(VI) bis(tetrafluoroborate)","Acta Crystallographica Section C","1992","48","12","2209","2211","10.1107/S0108270192003536","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000383","10.9026","0.0007","19.614","0.001","16.8211","0.0009","90","","94.512","0.005","90","","3585.9","0.4","","","","","","","","","","","","6","P 1 21 1","","","","","","- C39 H33 N O4 S2 Sn -","- C39 H28 N O4 S2 Sn -","- C156 H112 N4 O16 S8 Sn4 -","4","2","AS0550","Ng, S. W.; Chen, W.; Kumar Das, V. G.","Structure of the dibenzyl sulfoxide adduct of <i>N</i>-triphenylstannyl-1,2-benzisothiazol-3(2<i>H</i>)-one 1,1-dioxide","Acta Crystallographica Section C","1992","48","12","2211","2213","10.1107/S0108270192003299","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000384","7.736","0.001","10.406","0.002","12.111","0.003","111","0.01","104.07","0.01","90.65","0.01","877.6","0.3","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H38 N2 O2 P2 Pt -","- C40 H38 N2 O2 P2 Pt -","- C40 H38 N2 O2 P2 Pt -","1","0.5","CR0418","Staples, R. J.; Khan, Md. N. I.; Wang, S.; Fackler, Jnr, J. P.","Structure of <i>trans</i>-dicyanobis(triphenylphosphine)platinum(II) dimethanol solvate","Acta Crystallographica Section C","1992","48","12","2213","2215","10.1107/S0108270192003512","","","0.7103","MoKα","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000385","17.488","0.003","22.287","0.004","22.811","0.003","90","","90","","90","","8891","2","","","","","","","","","","","","7","P b c a","-P 2ac 2ab","","","","","- C36 H46 Cd Cl2 N4 O9 S4 -","- C36 H46 Cd Cl2 N4 O9 S4 -","- C288 H368 Cd8 Cl16 N32 O72 S32 -","8","1","BX0581","Castiñeiras, A.; Gómez, M. C.; Hiller, W.","Structure of tetrakis(<i>N</i>,<i>N</i>-dimethylbenzenecarbothioamide-<i>S</i>)cadmium(II) diperchlorate monohydrate","Acta Crystallographica Section C","1992","48","12","2215","2218","10.1107/S0108270192004359","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","194525","2020-10-21","18:00:00",""
"2000386","14.6","0.01","16.28","0.01","17.13","0.01","70.2","0.05","69.07","0.06","63.68","0.06","3329","4","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C72 H60 Br2 Cu Li O4 P4 -","- C72 H60 Br2 Cu Li O4 P4 -","- C144 H120 Br4 Cu2 Li2 O8 P8 -","2","1","CR0305","Fackler, Jnr, J. P.; López, C. A.; Winpenny, R. E. P.","Structure of tetrakis(triphenylphosphine oxide)lithium dibromocuprate(I)","Acta Crystallographica Section C","1992","48","12","2218","2220","10.1107/S0108270192004396","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000387","26.296","0.003","12.304","0.004","19.061","0.002","90","","103.63","0.02","90","","5993","2","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C71 H67 B Fe O2 P4 -","- C47 H47 Fe O2 P4 -","- C188 H188 Fe4 O8 P16 -","4","1","LI1002","Linn, K.; Masi, D.; Mealli, C.; Bianchini, C.; Peruzzini, M.","Structure of (4-pentynoato-<i>O</i>,<i>O</i>'){tris[2-(diphenylphosphino)ethyl]phosphine}iron(II) tetraphenylborate","Acta Crystallographica Section C","1992","48","12","2220","2222","10.1107/S0108270192004554","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2000388","8.896","0.003","11.006","0.003","17.31","0.006","90","","90","","90","","1694.8","0.9","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H22 O Si -","- C19 H22 O Si -","- C76 H88 O4 Si4 -","4","1","GR0200","Barnes, C. L.; Soderquist, J. A.","<i>cis</i>-1,1-Dimethyl-2,6-diphenyl-1-silacyclohexan-4-one","Acta Crystallographica Section C","1992","48","12","2222","2224","10.1107/S0108270192002828","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000389","6.1917","0.0008","7.1417","0.0006","9.9643","0.0008","81.822","0.007","84.638","0.008","78.682","0.009","426.68","0.08","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C8 H8 N4 S -","- C8 H8 N4 S -","- C16 H16 N8 S2 -","2","1","AS0566","Ng, S. W.","Structure of 4-amino-5-phenyl-4<i>H</i>-1,2,4-triazole-3-thione","Acta Crystallographica Section C","1992","48","12","2224","2225","10.1107/S0108270192003305","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000390","7.4946","0.001","13.437","0.002","10.863","0.0008","90","","90","","90","","1094","0.2","","","","","","","","","","","","3","P n a 21","","","","","","- C13 H12 O3 -","- C13 H12 O3 -","- C52 H48 O12 -","4","1","ST0581","Prince, P.; Fronczek, F. R.; Gandour, R. D.","1-Acetyl-7-methoxy-2-naphthol","Acta Crystallographica Section C","1992","48","12","2225","2227","10.1107/S0108270192003287","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000391","7.189","0.001","10.141","0.002","11.302","0.002","90","","90","","90","","824","0.2","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C10 H8 N2 O -","- C10 H8 N2 O -","- C40 H32 N8 O4 -","4","1","LI1001","Leban, I.; Polanc, S.","Structure of 2-phenylpyrimidinium 1-oxide","Acta Crystallographica Section C","1992","48","12","2227","2229","10.1107/S0108270192003391","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000392","12.488","0.005","10.372","0.005","8.335","0.005","84.95","0.05","108.74","0.05","98.51","0.05","1010.2","0.9","","","","","","","","","","","","4","P 1","P 1","1","","","","- C20 H19 O3.5 S3 -","- C20 H19 O3.5 S3 -","- C40 H38 O7 S6 -","2","2","GE0310","Dillen, J. L. M.; Roos, H. M.","Structure of tris(5-acetyl-3-thienyl)methane-ethanol (2/1) inclusion compound","Acta Crystallographica Section C","1992","48","12","2229","2231","10.1107/S0108270192003202","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:42",""
"2000393","8.697","0.002","12.741","0.003","12.94","0.002","90","","103.39","0.02","90","","1394.9","0.5","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-4,4-dimethyl-2-(4-tolyl)-morpholinium bromide","","- C13 H20 Br N O2 -","- C13 H20 Br N O2 -","- C52 H80 Br4 N4 O8 -","4","1","HH0601","Garcia, J. G.; Fronczek, F. R.; Gandour, R. D.","2-Hydroxy-4,4-dimethyl-2-(4-tolyl)-morpholinium bromide","Acta Crystallographica Section C","1992","48","12","2231","2233","10.1107/S0108270192003913","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206334","2020-10-21","18:00:00",""
"2000394","14.766","0.003","5.604","0.002","15.897","0.003","90","","97.34","0.02","90","","1304.7","0.6","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4-bis(dibenzylamino)benzene","","- C34 H32 N2 -","- C34 H32 N2 -","- C68 H64 N4 -","2","0.5","BX0575","Rickert, C.; Pirotta, M.; Müller, T.","Structure of 1,4-bis(dibenzylamino)benzene","Acta Crystallographica Section C","1992","48","12","2233","2235","10.1107/S0108270192004347","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206335","2020-10-21","18:00:00",""
"2000395","11.738","0.008","12.879","0.01","11.027","0.005","111.89","0.05","110.28","0.1","91.19","0.07","1429","2","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C37 H28 Cl N O4 -","- C37 H28 Cl N O8 -","- C74 H56 Cl2 N2 O16 -","2","1","AB0257","Anulewicz, R.; Woźniak, K.; Soroka, J. A.","(±)-7,10,12-Triphenyl-7,8-dihydroacenaphtho[4,5-<i>c</i>]quinolizinium perchlorate","Acta Crystallographica Section C","1992","48","12","2238","2240","10.1107/S0108270192002841","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000396","7.23","0.002","7.702","0.001","42.42","0.005","90","","90","","90","","2362.2","0.8","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4,4'-(tetrahydro-1-hydroxy-1H,3H-furo[3,4-c]furan-1,4-diyl)bis(2-methoxyphenyl) diacetate monohydrate","","- C24 H28 O10 -","- C24 H28 O10 -","- C96 H112 O40 -","4","1","HH0597","Macías, F. A.; Zubía, E.; Quijano, L.; Fronczek, F. R.; Fischer, N. H.","Structures of three tetrahydrofurofurane-type lignanes","Acta Crystallographica Section C","1992","48","12","2240","2244","10.1107/S0108270192003901","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","206309","2020-10-21","18:00:00",""
"2000397","5.5333","0.0005","12.552","0.0007","31.723","0.002","90","","90","","90","","2203.3","0.3","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","tetrahydro-1,4-bis(3,4,5-trimethoxyphenyl)-1H,3H-furo[3,4-c]furan","","- C24 H30 O8 -","- C24 H30 O8 -","- C96 H120 O32 -","4","1","HH0597","Macías, F. A.; Zubía, E.; Quijano, L.; Fronczek, F. R.; Fischer, N. H.","Structures of three tetrahydrofurofurane-type lignanes","Acta Crystallographica Section C","1992","48","12","2240","2244","10.1107/S0108270192003901","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","206309","2020-10-21","18:00:00",""
"2000398","9.6127","0.001","5.6194","0.0004","15.66","0.002","90","","103.687","0.008","90","","821.89","0.15","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","5,5'-(tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diyl)bis(1,3-benzodioxole)","","- C20 H18 O6 -","- C20 H18 O6 -","- C40 H36 O12 -","2","1","HH0597","Macías, F. A.; Zubía, E.; Quijano, L.; Fronczek, F. R.; Fischer, N. H.","Structures of three tetrahydrofurofurane-type lignanes","Acta Crystallographica Section C","1992","48","12","2240","2244","10.1107/S0108270192003901","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","296843","2024-12-11","14:15:26",""
"2000399","7.7157","0.001","27.019","0.003","7.6219","0.001","90","","107.473","0.01","90","","1515.6","0.3","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 O3 -","- C19 H18 O3 -","- C76 H72 O12 -","4","1","HA0105","Jones, P. G.","[4-(1-Hydroxyethyl)-5-phenanthryl]methyl acetate","Acta Crystallographica Section C","1992","48","12","2244","2245","10.1107/S0108270192003615","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000400","15.6464","0.0012","23.027","0.003","6.932","0.0008","90","","90","","90","","2497.5","0.5","","","","","","","","","","","","3","P 21 21 2","","","","","","- C16 H16 O2 -","- C16 H15.5 O2 -","- C128 H124 O16 -","8","2","HA0104","Jones, P. G.","9,10-Dihydrophenanthrene-4,5-dimethanol","Acta Crystallographica Section C","1992","48","12","2245","2247","10.1107/S0108270192003962","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000401","17.44","0.005","13.267","0.001","12.168","0.002","90","","110.49","0.08","90","","2637.3","1.6","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C27 H40 O7 -","- C27 H40 O7 -","- C108 H160 O28 -","4","2","CR0399","Grochulski, P.; Wawrzak, Z.; Gałdecki, Z.; Duax, W. L.; Strong, P. D.","Structure of 5β-pregnane-3α,6α,17α-triol triacetate","Acta Crystallographica Section C","1992","48","12","2247","2249","10.1107/S0108270192003494","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","296843","2024-12-11","14:15:26",""
"2000402","7.569","0.001","9.308","0.001","18.502","0.002","90","","90","","90","","1303.5","0.3","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H16 O2 -","- C16 H16 O2 -","- C64 H64 O8 -","4","1","HA0102","Tinant, B.; Declercq, J.-P.; Weiler, J.; Soumillon, J. P.; Motte, F.; Vanhulle, S.","(<i>Z</i>)-α,β-Dimethoxystilbene","Acta Crystallographica Section C","1992","48","12","2250","2251","10.1107/S0108270192003950","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000403","9.795","0.002","16.452","0.002","18.835","0.002","90","","90","","90","","3035.2","0.8","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C32 H50 O5 -","- C32 H50 O5 -","- C128 H200 O20 -","4","1","AB1003","Sekar, K.; Parthasarathy, S.; Kundu, A. B.; Barik, B. R.","Structure of dimethyl ceanothate","Acta Crystallographica Section C","1992","48","12","2251","2253","10.1107/S0108270192004189","","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000404","8.075","0.002","7.306","0.001","7.533","0.002","90","","96.65","0.02","90","","441.43","0.17","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- H2 K N O3 Se -","- H2 K N O3 Se -","- H8 K4 N4 O12 Se4 -","4","1","KA1009","Žák, Z.; R°užička, A.","Structure of potassium amidoselenate K^+^.SeO~3~NH~2~^{-^}","Acta Crystallographica Section C","1992","48","12","2254","2255","10.1107/S0108270192007844","","","0.71069","MoKα","","0.065","0.035","","0.064","0.059","","","","","1.3","1.3","","","","","has coordinates","281832","2023-03-13","07:37:02",""
"2000405","7.002","0.001","9.253","0.002","14.869","0.003","90","","104.83","0.01","90","","931.3","0.3","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C20 H20 O8 -","- C20 H20 O8 -","- C40 H40 O16 -","2","0.5","NA1008","Centore, R.; Ciajolo, M. R.; Tuzi, A.","Structure of 4,4'-[2,6-naphthylenebis(oxycarbonyl)]dibutyric acid","Acta Crystallographica Section C","1992","48","12","2255","2257","10.1107/S0108270192007716","","","1.54178","CuKα","","","0.054","","","0.065","","","","","2.904","2.904","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000406","22.521","0.006","10.809","0.003","9.509","0.002","90","","90","","90","","2314.8","1","298","","","","","","","","","","","4","P b c n","-P 2n 2ab","","","","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C112 H104 N8 O16 -","8","1","LI1009","Yeap, G.-Y.; Fun, H.-K.; Teoh, S.-G.; Teo, S.-B.; Chinnakali, K.; Yip, B.-C.","Structure of 4-[(4-methoxyphenylimino)methyl]phenol","Acta Crystallographica Section C","1992","48","12","2257","2258","10.1107/S0108270192008035","","","0.71069","MoKα","","","0.0454","","","0.0493","","","","","1","1","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000407","9.671","0.002","9.079","0.003","4.466","0.001","90","","96.2","0.02","90","","389.83","0.18","203","","","","","","","","","","","4","C 1 2/m 1","-C 2y","","","","","- C4 H4 I2 N2 -","- C4 H4 I2 N2 -","- C8 H8 I4 N4 -","2","0.25","ST1008","Bailey, R. D.; Buchanan, M. L.; Pennington, W. T.","Molecular complexes of 1,4-diazines with iodine","Acta Crystallographica Section C","1992","48","12","2259","2262","10.1107/S0108270192007662","","","0.71073","MoKα","","","0.0472","","","0.0519","","","","","1.19","1.19","","","","","has coordinates","199443","2020-10-21","18:00:00",""
"2000408","11.607","0.005","13.751","0.005","7.578","0.003","90","","108.54","0.03","90","","1146.7","0.8","203","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C8 H12 I2 N2 -","- C8 H12 I2 N2 -","- C32 H48 I8 N8 -","4","0.5","ST1008","Bailey, R. D.; Buchanan, M. L.; Pennington, W. T.","Molecular complexes of 1,4-diazines with iodine","Acta Crystallographica Section C","1992","48","12","2259","2262","10.1107/S0108270192007662","","","0.71073","MoKα","","","0.0341","","","0.0471","","","","","1.93","1.93","","","","","has coordinates","199443","2020-10-21","18:00:00",""
"2000409","11.657","0.002","13.763","0.003","7.654","0.001","90","","108.06","0.01","90","","1167.5","0.4","294","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C8 H12 I2 N2 -","- C8 H12 I2 N2 -","- C32 H48 I8 N8 -","4","0.5","ST1008","Bailey, R. D.; Buchanan, M. L.; Pennington, W. T.","Molecular complexes of 1,4-diazines with iodine","Acta Crystallographica Section C","1992","48","12","2259","2262","10.1107/S0108270192007662","","","0.071073","MoKα","","","0.0482","","","0.0754","","","","","1.51","1.51","","","","","has coordinates","199443","2020-10-21","18:00:00",""
"2000410","6.5779","0.0015","15.565","0.0013","19.217","0.002","90","","90","","90","","1967.5","0.5","293","","293","","","","","","","","","4","P c a b","-P 2bc 2ac","61","","Bis(5-chloro-2-hydroxy-1,3-xylyl)-18-crown-4","","- C20 H22 Cl2 O6 -","- C20 H22 Cl2 O6 -","- C80 H88 Cl8 O24 -","4","0.5","LI1019","Ferguson, G.; Ruhl, B. L.; McKervey, M. A.; Browne, C. M.","Bis(5-chloro-2-hydroxy-1,3-xylyl)-18-crown-4","Acta Crystallographica Section C","1992","48","12","2262","2264","10.1107/S0108270192007832","","","0.7093","MolybdenumKα","","","0.0427","","","0.0373","","","","","1.09","1.09","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000411","7.799","0.003","30.488","0.009","8.046","0.002","90","","119.21","","90","","1669.9","0.9","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C18 H14 F6 O4 -","- C18 H14 F9 O4 -","- C72 H56 F36 O16 -","4","1","HA1015","Barlow, M. G.; Beagley, B.; Pritchard, R. G.; Tajammal, S.; Tipping, A. E.; Wright, A. P.","Structure of a (1:2) adduct of 1,1-[bis(3,3,3-trifluoropropynly)]ethyl acetate and furan","Acta Crystallographica Section C","1992","48","12","2264","2266","10.1107/S010827019200845X","","","0.71069","MoKα","","","0.052","","","0.026","","","","","1.84","1.84","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000412","9.939","0.002","11.403","0.002","12.472","0.001","90","","113.04","0.01","90","","1300.8","0.4","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H12 N2 S4 -","- C8 H12 N2 S4 -","- C32 H48 N8 S16 -","4","1","SH1007","Heinemann, F.; Dölling, W.; Hartung, H.","Structures of 1-cyano-2,2-bis(methylthio)vinyl <i>N</i>,<i>N</i>-dimethyldithiocarbamate (2) and 1,2,2-tris(methylthio)vinyl <i>N</i>,<i>N</i>-dimethyldithiocarbamate (3)","Acta Crystallographica Section C","1992","48","12","2266","2268","10.1107/S0108270192007479","","","0.71073","MoKα","","","0.039","","","0.035","","","","","0.762","0.762","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000413","11.203","0.002","9.042","0.002","13.693","0.002","90","","100.85","0.02","90","","1362.3","0.4","291","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C8 H15 N S5 -","- C8 H15 N S5 -","- C32 H60 N4 S20 -","4","1","SH1007","Heinemann, F.; Dölling, W.; Hartung, H.","Structures of 1-cyano-2,2-bis(methylthio)vinyl <i>N</i>,<i>N</i>-dimethyldithiocarbamate (2) and 1,2,2-tris(methylthio)vinyl <i>N</i>,<i>N</i>-dimethyldithiocarbamate (3)","Acta Crystallographica Section C","1992","48","12","2266","2268","10.1107/S0108270192007479","","","1.54178","CuKα","","","0.052","","","0.058","","","","","5.26","5.26","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000414","17.121","0.001","17.121","0.001","13.241","0.001","90","","90","","90","","3881.3","0.4","293","","293","","","","","","","","","3","I 41/a :2","-I 4ad","88","tetra(2-pyridyl)pyrazine","2,3,4,6-tetra(2-pyridyl)pyrazine","","- C24 H16 N6 -","- C24 H16 N6 -","- C192 H128 N48 -","8","0.5","AL1025","Greaves, B.; Stoeckli-Evans, H.","A tetragonal form of tetra(2-pyridyl)pyrazine (TPPZ)","Acta Crystallographica Section C","1992","48","12","2269","2271","10.1107/S0108270192009387","","","0.71073","MolybdenumKα","","0.053","0.053","","0.072","0.072","","","","","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000415","7.315","0.001","7.941","0.002","21.393","0.004","90","","90","","90","","1242.7","0.4","295","","295","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine hydrochloride","","- C12 H17 Cl N2 O2 -","- C12 H17 Cl N2 O2 -","- C48 H68 Cl4 N8 O8 -","4","1","AB1011","Verdonk, M. L.; Kanters, J. A.; Kroon, J.","Structure of eltoprazine","Acta Crystallographica Section C","1992","48","12","2271","2273","10.1107/S0108270192008904","","","0.71073","MoKα","","","0.069","","","0.063","","","","","1.41","1.41","","","","","has coordinates","209447","2020-10-21","18:00:00",""
"2000416","6.1749","0.0004","8.0494","0.0004","14.0057","0.0005","90","","96.078","0.004","90","","692.23","0.06","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","(1R,2R)-1,2-diphenyl-1,2-ethanediamine monohydrobromide","","- C14 H17 Br N2 -","- C14 H17 Br N2 -","- C28 H34 Br2 N4 -","2","1","AB1027","Ferguson, G.; Gallagher, J. F.; Fullwood, R.; Parker, D.","(1<i>R</i>,2<i>R</i>)-1,2-Diphenyl-1,2-ethanediamine monohydrobromide","Acta Crystallographica Section C","1992","48","12","2273","2275","10.1107/S0108270192008953","","","0.7093","MolybdenumKα","","0.027","0.021","","0.028","0.026","","","","","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000417","5.796","0.001","8.714","0.001","9.152","0.001","92.29","0.009","97.17","0.01","103.47","0.01","444.86","0.11","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H26 N2 S2 -","- C16 H26 N2 S2 -","- C16 H26 N2 S2 -","1","0.5","SH1010","Heinemann, F.; Hartung, H.; Hansen, J.; Maschmeier, C.-P.; Matschiner, H.","Structure of 3,6-bis(dimethylamino)-2,5-diisopropylthieno[3,2-<i>b</i>]thiophene","Acta Crystallographica Section C","1992","48","12","2275","2277","10.1107/S0108270192008229","","","0.71073","MoKα","","","0.047","","","0.037","","","","","6.84","6.84","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000418","14.87","0.001","5.411","0.001","8.15","0.001","90","","95.71","0.02","90","","652.51","0.15","297","","","","","","","","","","","4","P 1 21 1","","","","5'-O-acetyl-4'-cyano-2',3'-didehydro-2',3'-dideoxyuridine","","- C12 H11 N3 O5 -","- C12 H11 N3 O5 -","- C24 H22 N6 O10 -","2","1","AS1021","Yamaguchi, K.; Haraguchi, K.; Tanaka, H.; Itoh, Y.; Miyasaka, T.","Structure of a 4'-<i>C</i>-branched 2',3'-didehydro-2',3'-dideoxyuridine","Acta Crystallographica Section C","1992","48","12","2277","2278","10.1107/S0108270192009077","","","1.5405","CuKα~1~","","","0.047","","","0.046","","","","","3.04","3.04","","","","","has coordinates","189488","2020-10-21","18:00:00",""
"2000420","13.015","0.001","13.015","0.001","5.6637","0.0007","90","","90","","90","","959.38","0.16","","","","","","","","","","","","3","P 42/n :1","P 4n -1n","86","","","","- La4 Mo2 O11 -","- La4 Mo2 O12 -","- La16 Mo8 O48 -","4","0.5","DU0314","Gall, P.; Gougeon, P.","Structure of La~4~Mo~2~O~11~ containing isolated Mo~2~O~10~ cluster units","Acta Crystallographica Section C","1992","48","11","1915","1917","10.1107/S0108270192003214","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176343","2020-10-21","18:00:00",""
"2000421","16.914","0.011","9.526","0.004","17.671","0.011","90","","127.41","0.02","90","","2262","2","","","","","","","","","","","","4","C 1 2/c 1","","","","","","- Br9 K Re6 S5 -","- Br6 K Re6 S8 -","- Br24 K4 Re24 S32 -","4","0.5","DU0337","Slougui, A.; Perrin, A.; Sergent, M.","Structure of potassium hexarhenium nonabromide pentasulfide: KRe~6~S~5~Br~9~","Acta Crystallographica Section C","1992","48","11","1917","1920","10.1107/S0108270192002919","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000422","8.569","0.009","9.991","0.005","14.811","0.005","108.84","0.03","95.1","0.04","90.37","0.07","1194.5","1.5","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H20 N4 O2 Pt S24 -","- C32 H20 N4 O2 Pt S24 -","- C32 H20 N4 O2 Pt S24 -","1","0.5","PA0278","Fettouhi, M.; Ouahab, L.; Grandjean, D.; Mousdis, G.; Delhaes, P.","Structures of some quasi-two-dimensional molecular conductors. I. Structure of κ-tetrakis(3,4-methylenedithio-2,2',5,5'-tetrathiafulvalen)ium tetracyanoplatinate dihydrate: κ-(MDTTTF)~4~Pt(CN)~4~(H~2~O)~2~","Acta Crystallographica Section C","1992","48","11","1920","1923","10.1107/S0108270192002750","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000423","19.009","0.008","11.273","0.004","13.144","0.007","90","","103.5","0.04","90","","2739","2","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H36 Cu2 N12 O16 S2 -","- C8 H36 Cu2 N12 O16 S2 -","- C32 H144 Cu8 N48 O64 S8 -","4","0.5","LI0125","van Koningsbruggen, P. J.; Haasnoot, J. G.; de Graaff, R. A. G.; Reedijk, J.; Slingerland, S.","Structure of bis[μ-4-amino-3,5-bis(aminomethyl)-1,2,4-triazole-<i>N</i>',<i>N</i>^1^,<i>N</i>^2^,<i>N</i>'']-bis[diaquacopper(II)] bis(sulfate) tetrahydrate","Acta Crystallographica Section C","1992","48","11","1923","1926","10.1107/S0108270192002634","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000424","7.363","0.003","8.886","0.002","18.321","0.004","90","","96.18","0.02","90","","1191.7","0.6","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C14 H38 N8 Ni2 O10 -","- C14 H38 N8 Ni2 O10 -","- C28 H76 N16 Ni4 O20 -","2","0.5","BR0003","Zhu, S.; Luo, Q.; Shen, M.; Huang, L.","Structure of the hydrogen-bond-rich dinickel(II) complex of <i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>'''-tetrakis(2-aminoethyl)-1,1,2,2-ethanetetraamide","Acta Crystallographica Section C","1992","48","11","1926","1929","10.1107/S0108270192003056","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000425","14.76","0.02","7.316","0.001","8.177","0.003","90","","119.7","0.3","90","","767","3","","","","","","","","","","","","6","C 1 2/m 1","","","","","","- C6 H24 F6 N2 O2 Sn -","- C6 H24 F6 N2 O2 Sn -","- C12 H48 F12 N4 O4 Sn2 -","2","0.25","DU0247","Taha, A.; Liautard, B.; Granier, W.","Etude structurale du dihydrate de l'hexafluorostannate de triméthylammonium","Acta Crystallographica Section C","1992","48","11","1929","1931","10.1107/S0108270191000550","","","0.70906","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000426","23.807","0.006","9.548","0.001","24.192","0.006","90","","136.48","0.02","90","","3787","2","","","","","","","","","","","","5","I 1 2/a 1","","","","","","- C14 H16 I2 Pt Te2 -","- C14 H16 I2 Pt Te2 -","- C112 H128 I16 Pt8 Te16 -","8","1","MU0295","Levason, W.; Webster, M.; Mitchell, C. J.","Structure of <i>trans</i>-diiodobis(methyl phenyl telluride)platinum(II)","Acta Crystallographica Section C","1992","48","11","1931","1933","10.1107/S0108270192003354","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000427","12.947","0.001","9.401","0.003","20.005","0.003","90","","90","","90","","2434.9","0.9","","","","","","","","","","","","5","P b c a","","","","","","- C26 H24 Cu N2 O8 -","- C26 H24 Cu N2 O8 -","- C104 H96 Cu4 N8 O32 -","4","0.5","AL0524","Hoang, N. N.; Valach, F.; Macášková, L.; Melník, M.","Structure of copper(II) salicylates: bis(3-pyridylmethanol)bis(salicylato)copper(II)","Acta Crystallographica Section C","1992","48","11","1933","1936","10.1107/S0108270192003263","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000428","9.263","0.002","14.317","0.003","11.036","0.005","90","","90","","90","","1463.6","0.8","","","","","","","","","","","","7","I b a m","","","","","","- C8 H36 Br2 N8 O16 Pt2 S4 -","- C8 H40 Br4 N8 O16 Pt2 S4 -","- C16 H80 Br8 N16 O32 Pt4 S8 -","2","0.125","AS0571","Matsushita, N.; Taga, T.; Tsujikawa, I.","Structure of a one-dimensional Br-bridged Pt^II^-Pt^IV^ mixed-valence complex, <i>catena</i>-poly[bis(ethylenediamine)platinum(II,IV)-μ-bromo bis(hydrogensulfate)]","Acta Crystallographica Section C","1992","48","11","1936","1939","10.1107/S0108270192003457","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000429","24.6077","0.0018","9.0071","0.0003","10.069","0.0004","90","","100.824","0.005","90","","2192","0.2","","","","","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C24 H21 B F4 N P -","- C24 H21 B F4 N P -","- C96 H84 B4 F16 N4 P4 -","4","2","AL0527","Llamas-Saiz, A. L.; Foces-Foces, C.; Elguero, J.; Molina, P.; Alajarín, M.; Vidal, A.","Effect of the protonation and of the <i>ortho</i> substitution on the structure of aryliminophosphoranes","Acta Crystallographica Section C","1992","48","11","1940","1945","10.1107/S0108270192001811","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","288374","2023-12-18","07:44:25",""
"2000430","30.4088","0.0015","11.5561","0.0003","22.9996","0.001","90","","101.437","0.003","90","","7921.7","0.6","","","","","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C24 H21 N2 P -","- C24 H21 N2 P -","- C384 H336 N32 P16 -","16","2","AL0527","Llamas-Saiz, A. L.; Foces-Foces, C.; Elguero, J.; Molina, P.; Alajarín, M.; Vidal, A.","Effect of the protonation and of the <i>ortho</i> substitution on the structure of aryliminophosphoranes","Acta Crystallographica Section C","1992","48","11","1940","1945","10.1107/S0108270192001811","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","288374","2023-12-18","07:44:25",""
"2000431","6.55","0.003","17.318","0.006","20.129","0.006","90","","98.83","0.03","90","","2256.2","1.5","","","","","","","","","","","","5","P 1 21 1","","","","","","- C22 H29 N O3 Si -","- C22 H29 N O3 Si -","- C88 H116 N4 O12 Si4 -","4","2","HH0589","Marsh, R. E.; Schaefer, W. P.; Widdowson, K. L.; Myers, A. G.","Structure of an <i>anti</i>-aldol addition product of benzaldehyde and a pseudoephedrine-derived <i>O</i>-silyl ketene <i>N</i>,<i>O</i>-acetal","Acta Crystallographica Section C","1992","48","11","1948","1951","10.1107/S0108270192002233","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000432","11.676","0.002","24.819","0.007","12.344","0.003","90","","113.74","0.02","90","","3274.4","1.4","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C12 H20 Br N4 O3 S -","- C12 H20 Br N4 O2.5 S -","- C96 H160 Br8 N32 O20 S8 -","8","2","AS0586","Hu, N.-H.; Zhang, S.-L.","Structure of thiamine bromide sesquihydrate","Acta Crystallographica Section C","1992","48","11","1951","1954","10.1107/S0108270192002257","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208452","2020-10-21","18:00:00",""
"2000433","10.231","0.007","11.171","0.007","14.759","0.005","90","","90","","90","","1686.8","1.7","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C19 H28 N2 O2 -","- C19 H27 N2 O2 -","- C76 H108 N8 O8 -","4","1","HE0046","Maes, D.; Fiddelaers, P.; Wyns, L.; Lisgarten, J.; Lisgarten, D.; Palmer, R.","Structure of (17α)-androstano[3,4-<i>c</i>][1,2,5]oxadiazole-17-ol (HS963)","Acta Crystallographica Section C","1992","48","11","1954","1957","10.1107/S010827019200252X","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000434","8.939","0.003","10.697","0.004","14.92","0.004","90","","102.55","0.02","90","","1392.6","0.8","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C5 H7 N5 O2 -","- C5 H7 N5 O2 -","- C40 H56 N40 O16 -","8","1","CR0391","Serra, M. A.; Dorner, B. K.; Silver, M. E.","Structure of an adenine-hydrogen peroxide adduct","Acta Crystallographica Section C","1992","48","11","1957","1960","10.1107/S0108270192002294","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000435","18.508","0.007","5.228","0.002","6.342","0.003","90","","93.22","0.03","90","","612.7","0.4","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","","","","","- C7 H6 O3 -","- C7 H7 O3 -","- C28 H28 O12 -","4","1","CR0372","Heath, E. A.; Singh, P.; Ebisuzaki, Y.","Structure of <i>p</i>-hydroxybenzoic acid and <i>p</i>-hydroxybenzoic acid-acetone complex (2/1)","Acta Crystallographica Section C","1992","48","11","1960","1965","10.1107/S0108270192002361","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000436","24.093","0.008","7.232","0.002","9.699","0.002","90","","92.47","0.02","90","","1688.4","0.8","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","","","","","- C17 H18 O7 -","- C17 H18 O7 -","- C68 H72 O28 -","4","1","CR0372","Heath, E. A.; Singh, P.; Ebisuzaki, Y.","Structure of <i>p</i>-hydroxybenzoic acid and <i>p</i>-hydroxybenzoic acid-acetone complex (2/1)","Acta Crystallographica Section C","1992","48","11","1960","1965","10.1107/S0108270192002361","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000437","14.23","0.001","24.37","0.005","18.78","0.002","90","","90","","90","","6512.6","1.6","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C54 H95 N9 O17 -","- C54 N9 O18 -","- C216 N36 O72 -","4","1","CR0373","Han, F.; Mortishire-Smith, R. J.; Rainey, P. B.; Williams, D. H.","Structure of the white-line-inducing principle isolated from <i>Pseudomonas reactans</i>","Acta Crystallographica Section C","1992","48","11","1965","1968","10.1107/S0108270192001690","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000438","10.076","0.002","12.346","0.003","9.154","0.002","98.9","0.02","122.06","0.02","96.67","0.02","926.3","0.4","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H21 N O2 -","- C22 H21 N O2 -","- C44 H42 N2 O4 -","2","1","AS0561","Hamada, K.; Oh-hira, M.; Fujiwara, T.; Toda, F.","Structures of two crystal forms of the host-guest complex between <i>trans</i>-3,3'-bis(diphenylhydroxymethyl)azobenzene and acetone","Acta Crystallographica Section C","1992","48","11","1969","1971","10.1107/S0108270192002245","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000439","16.782","0.002","8.744","0.003","23.386","0.003","90","","107.83","0.02","90","","3266.9","1.3","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C41 H36 N2 O3 -","- C41 H36 N2 O3 -","- C164 H144 N8 O12 -","4","0.5","AS0561","Hamada, K.; Oh-hira, M.; Fujiwara, T.; Toda, F.","Structures of two crystal forms of the host-guest complex between <i>trans</i>-3,3'-bis(diphenylhydroxymethyl)azobenzene and acetone","Acta Crystallographica Section C","1992","48","11","1969","1971","10.1107/S0108270192002245","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000440","5.087","0.002","19.222","0.003","9.552","0.002","90","","93.81","0.03","90","","932","0.4","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C12 H8 O4 -","- C12 H8 O4 -","- C48 H32 O16 -","4","0.5","ST0572","Fitzgerald, L. J.; Gerkin, R. E.","Structure of 2,3-naphthalenedicarboxylic acid","Acta Crystallographica Section C","1992","48","11","1971","1975","10.1107/S0108270192003226","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000441","8.059","0.002","11.537","0.003","22.311","0.006","90","","90","","90","","2074.4","0.9","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C20 H29 Cl N2 O4 -","- C20 H22 Cl N2 O4 -","- C80 H88 Cl4 N8 O16 -","4","1","CR0388","Karle, J. M.; Karle, I. L.","Structure of 9-epiquinine hydrochloride dihydrate <i>versus</i> antimalarial activity","Acta Crystallographica Section C","1992","48","11","1975","1980","10.1107/S0108270192002373","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000442","7.7505","0.0009","16.484","0.002","8.7383","0.0009","90","","101.16","0.01","90","","1095.3","0.2","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","AB0267","Nethaji, M.; Pattabhi, V.; Harikrishna Reddy, S.","Structure of pentacyclo[8.5.0.0^2,7^.0^4,13^.0^5,1^]pentadeca-8,14-diene-3,6-dione","Acta Crystallographica Section C","1992","48","11","1980","1981","10.1107/S0108270192002154","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000443","12.94","0.003","13.551","0.003","7.44","0.002","90","","90","","90","","1304.6","0.5","","","","","","","","","","","","4","P n m n","","","","","","- C26 H8 N8 S6 -","- C26 H8 N8 S6 -","- C52 H16 N16 S12 -","2","0.25","AS0570","Iwasaki, K.; Ida, T.; Kawamoto, A.; Ugawa, A.; Yamashita, Y.; Yakushi, K.; Suzuki, T.","Structure of the charge-transfer complex of (DBTTF)(BTDA-TCNQ)","Acta Crystallographica Section C","1992","48","11","1982","1984","10.1107/S0108270192003445","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000444","5.5055","0.0013","25.201","0.003","8.1241","0.0019","90","","100.434","0.011","90","","1108.5","0.4","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H13 N3 O3 -","- C10 H13 N3 O3 -","- C40 H52 N12 O12 -","4","1","BR0018","Vaughan, K.; Cameron, L. M.; Christie, S.; Zaworotko, M. J.","Structures of the isomeric triazene 1-oxides 3-(4-ethoxycarbonylphenyl)-1-methyltriazene 1-oxide (1) and 3-(2-ethoxycarbonylphenyl)-1-methyltriazene 1-oxide (2)","Acta Crystallographica Section C","1992","48","11","1985","1988","10.1107/S0108270192003329","","","0.70926","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000445","12.963","0.009","8.1716","0.0008","11.212","0.007","90","","110.85","0.03","90","","1109.9","1.1","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H13 N3 O3 -","- C10 H13 N3 O3 -","- C40 H52 N12 O12 -","4","1","BR0018","Vaughan, K.; Cameron, L. M.; Christie, S.; Zaworotko, M. J.","Structures of the isomeric triazene 1-oxides 3-(4-ethoxycarbonylphenyl)-1-methyltriazene 1-oxide (1) and 3-(2-ethoxycarbonylphenyl)-1-methyltriazene 1-oxide (2)","Acta Crystallographica Section C","1992","48","11","1985","1988","10.1107/S0108270192003329","","","0.70926","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000446","8.259","0.007","13.111","0.004","9.978","0.004","90","","104.9","0.05","90","","1044.1","1.1","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H6 N4 O4 -","- C10 H6 N4 O4 -","- C40 H24 N16 O16 -","4","1","AL0537","Rice, C. R.; Wallis, J. D.; Povey, D. C.","Intramolecular interactions in 3,3'-dinitro-2,2'-bipyridine","Acta Crystallographica Section C","1992","48","11","1988","1991","10.1107/S0108270192003251","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000447","10.33","0.002","10.958","0.002","13.251","0.003","78.48","0.02","80.86","0.02","87.04","0.03","1450.8","0.5","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H13 Cl N2 O2 -","- C16 H13 Cl N2 O2 -","- C64 H52 Cl4 N8 O8 -","4","2","CR0364","Karolak-Wojciechowska, J.; Kwiatkowski, W.; Karczmarzyk, Z.; Zejc, A.; Obniska, J.","Structure and conformation of <i>N</i>-(4-methyl-2-pyridyl)-<i>p</i>-chlorophenylsuccinimide","Acta Crystallographica Section C","1992","48","11","1991","1994","10.1107/S0108270192002853","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000448","10.867","0.002","5.79","0.001","14.74","0.002","90","","94.75","0.01","90","","924.3","0.3","","","","","","","","","","","","4","P 1 21 1","","","","","","- C18 H24 N2 O5 -","- C18 H24 N2 O5 -","- C36 H48 N4 O10 -","2","1","AL0535","Qing, C. Y.; de Wit, D.; van Rantwijk, F.; van Koningsveld, H.; Maat, L.","Structure of a phenylhydrazone of diacetone protected 3-keto-glucose","Acta Crystallographica Section C","1992","48","11","1994","1996","10.1107/S0108270192002798","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","199444","2020-10-21","18:00:00",""
"2000449","10.548","0.006","19.59","0.011","7.729","0.003","90","","90","","90","","1597.1","1.4","","","","","","","","","","","","4","C m c 21","","","","","","- C18 H20 N2 O3 -","- C20 H24 N4 O6 -","- C80 H96 N16 O24 -","4","0.5","CR0293","Singh, P.; Levine, S. G.; Kasdorf, K.","Structures of 4β-(nitromethyl)-2α,6α-diphenyl-4α-piperidinol and 4β-(nitromethyl)-2β,6β-diphenyl-4α-piperidinol","Acta Crystallographica Section C","1992","48","11","1996","2000","10.1107/S0108270192003482","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000450","5.573","0.002","11.852","0.006","13.44","0.007","68.42","0.04","89.46","0.04","79.82","0.03","811","0.7","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H20 N2 O3 -","- C18 H20 N2 O3 -","- C36 H40 N4 O6 -","2","1","CR0293","Singh, P.; Levine, S. G.; Kasdorf, K.","Structures of 4β-(nitromethyl)-2α,6α-diphenyl-4α-piperidinol and 4β-(nitromethyl)-2β,6β-diphenyl-4α-piperidinol","Acta Crystallographica Section C","1992","48","11","1996","2000","10.1107/S0108270192003482","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000451","20.828","0.005","8.364","0.002","21.508","0.004","90","","122.39","0.02","90","","3163.9","1.4","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C18 H22 O3 -","- C18 H22 O3 -","- C144 H176 O24 -","8","1","HH0594","Toscano, R. A.; Quijano, L.; Gómez, F.; García-Pérez, G.; Rios, T.","Structure of wigandol","Acta Crystallographica Section C","1992","48","11","2000","2002","10.1107/S010827019200307X","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000452","9.54","0.003","17.763","0.005","10.39","0.006","90","","106.91","0.04","90","","1684.6","1.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","triphenylphosphine oxide hydrogen bromide","","- C18 H16 Br O P -","- C18 H16 Br O P -","- C72 H64 Br4 O4 P4 -","4","1","AL0534","Lane, H. P.; McAuliffe, C. A.; Pritchard, R. G.","Triphenylphosphine oxide hydrogen bromide","Acta Crystallographica Section C","1992","48","11","2002","2004","10.1107/S0108270192002518","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206335","2020-10-21","18:00:00",""
"2000453","7.983","0.003","18.028","0.002","11.668","0.001","90","","90","","90","","1679.2","0.7","","","","","","","","","","","","6","P n a 21","P 2c -2n","","","","","- C17 H20 Cl N3 O S -","- C17 H20 Cl N3 O S -","- C68 H80 Cl4 N12 O4 S4 -","4","1","HU1001","Christiansen, J.; Clark, G. R.; Denny, W. A.; Palmer, B. D.","Structure of <i>N</i>-(2-dimethylaminoethyl)phenothiazine-1-carboxamide hydrochloride","Acta Crystallographica Section C","1992","48","11","2004","2007","10.1107/S0108270192003330","","","0.71069","MoKα","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000454","6.408","0.001","10.433","0.001","12.388","0.001","90","","98.6","0.01","90","","818.88","0.17","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C5 H10 N O3 S -","- C10 H20 N2 O6 S2 -","- C20 H40 N4 O12 S4 -","2","0.5","CR0404","Pyrka, G. J.; Scott, N.; Fernando, Q.","Structure of the 1:2 adduct of <i>meso</i>-2,3-dimercaptosuccinic acid and <i>N</i>,<i>N</i>-dimethylformamide","Acta Crystallographica Section C","1992","48","11","2007","2009","10.1107/S0108270192002865","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000455","5.96","0.001","9.569","0.002","10.679","0.002","96.82","0.02","98.32","0.02","90.32","0.02","598.2","0.2","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C15 H14 O3 -","- C15 H14 O3 -","- C30 H28 O6 -","2","1","AB0274","Larsen, I. K.; Andersen, L. A.; Pedersen, B. F.","Structures of two crystalline modifications of lapachol","Acta Crystallographica Section C","1992","48","11","2009","2013","10.1107/S0108270192003378","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000456","6.035","0.001","9.427","0.002","20.918","0.005","90","","98.27","0.02","90","","1177.7","0.4","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 O3 -","- C15 H14 O3 -","- C60 H56 O12 -","4","1","AB0274","Larsen, I. K.; Andersen, L. A.; Pedersen, B. F.","Structures of two crystalline modifications of lapachol","Acta Crystallographica Section C","1992","48","11","2009","2013","10.1107/S0108270192003378","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000457","12.619","0.001","8.285","0.001","16.469","0.001","90","","94.39","0.06","90","","1716.8","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H17 N3 O2 -","- C20 H17 N3 O2 -","- C80 H68 N12 O8 -","4","1","GE0305","Carugo, O.; Poli, G.; Manzoni, L.","Structure of <i>N</i>,<i>N</i>',<i>N</i>''-triphenylbiuret","Acta Crystallographica Section C","1992","48","11","2013","2016","10.1107/S0108270192003858","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000458","11.004","0.001","12.6209","0.0009","9.692","0.0008","90","","108.224","0.007","90","","1278.51","0.19","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H12 O4 -","- C16 H12 O4 -","- C64 H48 O16 -","4","1","AS0554","Matsuzawa, E. S.; Hirayama, N.; Ohshima, E.; Obase, H.","Structural aspects of the 6,11-dihydro-11-oxodibenz[<i>b</i>,<i>e</i>]oxepin skeleton","Acta Crystallographica Section C","1992","48","11","2016","2019","10.1107/S0108270192002701","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000459","13.644","0.001","8.878","0.001","13","0.002","90","","117.1","0.01","90","","1401.8","0.3","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C17 H14 O4 -","- C17 H14 O4 -","- C68 H56 O16 -","4","1","AS0554","Matsuzawa, E. S.; Hirayama, N.; Ohshima, E.; Obase, H.","Structural aspects of the 6,11-dihydro-11-oxodibenz[<i>b</i>,<i>e</i>]oxepin skeleton","Acta Crystallographica Section C","1992","48","11","2016","2019","10.1107/S0108270192002701","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2000460","10.177","0.001","10.63","0.001","7.776","0.001","103.72","0.01","100.7","0.01","107.85","0.01","746.9","0.16","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C18 H16 O4 -","- C18 H16 O4 -","- C36 H32 O8 -","2","1","AS0554","Matsuzawa, E. S.; Hirayama, N.; Ohshima, E.; Obase, H.","Structural aspects of the 6,11-dihydro-11-oxodibenz[<i>b</i>,<i>e</i>]oxepin skeleton","Acta Crystallographica Section C","1992","48","11","2016","2019","10.1107/S0108270192002701","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000461","9.962","0.004","6.711","0.002","12.339","0.005","90","","96.76","0.03","90","","819.2","0.5","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 Co4 O10 S2 -","- C10 Co4 O10 S2 -","- C20 Co8 O20 S4 -","2","0.5","AL1006","Mackay, K. M.; Nicholson, B. K.; van Tiel, M. L.","Redetermination of decacarbonyl di-μ~4~-sulfido-tetracobalt","Acta Crystallographica Section C","1992","48","11","2020","2021","10.1107/S0108270192003433","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000462","11.57","0.003","12.725","0.003","5.79","0.004","101.28","0.03","102.35","0.04","70.01","0.03","775.6","0.6","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H17 N4 Na O4 S -","- C12 H17 N4 Na O4 S -","- C24 H34 N8 Na2 O8 S2 -","2","1","AS0507","Hannan, S. S.; Talukdar, A. N.","Structure of monosodium <i>N</i>^1^-(4,6-dimethyl-2-pyrimidyl)sulfanilamidate dihydrate","Acta Crystallographica Section C","1992","48","11","2021","2023","10.1107/S0108270192002695","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000463","10.719","0.003","7.648","0.002","12.224","0.003","90","","110.32","0.02","90","","939.7","0.4","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H34 Al2 N2 -","- C12 H34 Al2 N2 -","- C24 H68 Al4 N4 -","2","0.5","ST0555","Byers, J. J.; Pennington, W. T.; Robinson, G. H.","Bis-adducts of trimethylaluminium and trimethylgallium with <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine","Acta Crystallographica Section C","1992","48","11","2023","2025","10.1107/S0108270192001495","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000464","10.735","0.003","7.656","0.002","12.31","0.004","90","","110.7","0.02","90","","946.4","0.5","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H34 Ga2 N2 -","- C12 H34 Ga2 N2 -","- C24 H68 Ga4 N4 -","2","0.5","ST0555","Byers, J. J.; Pennington, W. T.; Robinson, G. H.","Bis-adducts of trimethylaluminium and trimethylgallium with <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine","Acta Crystallographica Section C","1992","48","11","2023","2025","10.1107/S0108270192001495","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000465","16.525","0.002","15.386","0.002","19.751","0.002","90","","113.82","0.01","90","","4594","1","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C25 H21 N O2 S Sn -","- C25 H21 N O2 S Sn -","- C200 H168 N8 O16 S8 Sn8 -","8","2","AS0579","Ng, S. W.; Kumar Das, V. G.","Structure of triphenyltin 2-(4-pyridylthio)acetate","Acta Crystallographica Section C","1992","48","11","2025","2026","10.1107/S0108270192002609","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2000466","7.083","0.001","9.359","0.001","9.809","0.002","89.92","0.01","81.46","0.02","80.66","0.01","634.33","0.18","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C6 H13 N4 Na O7 S2 -","- C6 H13 N4 Na O7 S2 -","- C12 H26 N8 Na2 O14 S4 -","2","1","GE0303","Pecorari, P.; Rinaldi, M.; Antolini, L.","Structure of sodium (7-amino-2,3-dihydro-5-oxo-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyrimidin-6-yl)sulfamate trihydrate","Acta Crystallographica Section C","1992","48","11","2027","2029","10.1107/S0108270192002622","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208360","2020-10-21","18:00:00",""
"2000467","11.278","0.005","15.195","0.005","19.92","0.01","90","","91.6","0.04","90","","3412","3","","","","","","","","","","","","5","P 1 21 1","","","","","","- C50 H77 N15 O31 Pt5 -","- C50 H50 N15 O31 Pt5 -","- C100 H100 N30 O62 Pt10 -","2","1","DU0338","Khodadad, P.; Rodier, N.","Penta[bis(5-oxoprolinato)platinate(II) d'ammonium] monohydrate","Acta Crystallographica Section C","1992","48","11","2029","2031","10.1107/S0108270192003275","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000468","17.426","0.011","6.945","0.01","6.816","0.002","90","","90","","90","","824.9","1.3","","","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C6 H5 F3 N2 O S -","- C6 H5 F3 N2 O S -","- C24 H20 F12 N8 O4 S4 -","4","0.5","HA0110","Tinant, B.; Feneau-Dupont, J.; Declercq, J.-P.; Evariste, F.; Viehe, H. G.","3-Methyl-2-thioxo-6-trifluoromethyl-2,3-dihydro-4(1<i>H</i>)-pyrimidinone","Acta Crystallographica Section C","1992","48","11","2032","2033","10.1107/S0108270192002440","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2000469","7.296","0.001","13.099","0.002","15.754","0.002","90","","90","","90","","1505.6","0.4","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C18 H16 O5 -","- C18 H16 O5 -","- C72 H64 O20 -","4","1","CR0410","Shoja, M.","4',6,7-Trimethoxyisoflavone","Acta Crystallographica Section C","1992","48","11","2033","2035","10.1107/S010827019200249X","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000470","9.777","0.001","10.211","0.001","22.585","0.002","90","","90","","90","","2254.7","0.4","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C26 H29 N O2 -","- C26 H29 N O2 -","- C104 H116 N4 O8 -","4","1","SE1000","Dyrbusch, M.; Egert, E.","Structure of a cinnamic acid derivative","Acta Crystallographica Section C","1992","48","11","2035","2036","10.1107/S0108270192002221","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000471","17.397","0.004","5.865","0.002","13.482","0.005","90","","104.26","0.02","90","","1333.2","0.7","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 Cl N2 O2 -","- C14 H15 Cl N2 O2 -","- C56 H60 Cl4 N8 O8 -","4","1","CR0409","Bryant, Jnr, G. L.; King, Jnr, J. A.","Structures of two acylpyridinium salts and one simple pyridinium salt","Acta Crystallographica Section C","1992","48","11","2036","2039","10.1107/S0108270192002403","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000472","9.086","0.002","9.328","0.002","19.494","0.005","79.03","0.02","78.83","0.02","64.53","0.02","1452.7","0.6","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H35 B N2 O -","- C38 H35 B N2 O -","- C76 H70 B2 N4 O2 -","2","1","CR0409","Bryant, Jnr, G. L.; King, Jnr, J. A.","Structures of two acylpyridinium salts and one simple pyridinium salt","Acta Crystallographica Section C","1992","48","11","2036","2039","10.1107/S0108270192002403","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000473","17.113","0.003","7.46","0.002","14.57","0.003","90","","120.84","0.01","90","","1597","0.6","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C7 H11 Cl N2 -","- C7 H11 Cl N2 -","- C56 H88 Cl8 N16 -","8","1","CR0409","Bryant, Jnr, G. L.; King, Jnr, J. A.","Structures of two acylpyridinium salts and one simple pyridinium salt","Acta Crystallographica Section C","1992","48","11","2036","2039","10.1107/S0108270192002403","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000474","9.019","0.001","14.522","0.001","6.059","0.001","90","","90","","90","","793.57","0.17","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C5 H10 O3 S2 -","- C5 H10 O3 S2 -","- C20 H40 O12 S8 -","4","1","LI0123","Barkley, J.; Dodd, I. M.; Harding, M. M.; Namwindwa, E. S.; Page, P. C. B.","<i>anti</i>-2-Methyl-1,3-dithiane 1,1,3-trioxide","Acta Crystallographica Section C","1992","48","11","2039","2040","10.1107/S0108270192002749","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000475","13.343","0.007","21.991","0.005","10.462","0.003","90","","90","","90","","3070","2","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C8 H0 F4 N2 -","- C8 F4 N2 -","- C128 F64 N32 -","16","2","CR0414","Britton, D.","Structure of tetrafluoroisophthalonitrile","Acta Crystallographica Section C","1992","48","11","2040","2042","10.1107/S0108270192002567","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000476","4.722","0.002","12.284","0.005","17.638","0.011","90","","90","","90","","1023.1","0.9","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C12 H10 N2 O -","- C12 H10 N2 O -","- C48 H40 N8 O4 -","4","1","ST0559","Orr, Jnr, L. B.; Parsons, E. J.; Pennington, W. T.","2-{[(<i>o</i>-Hydroxyphenyl)imino]methyl}pyridine","Acta Crystallographica Section C","1992","48","11","2042","2043","10.1107/S0108270192001483","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000477","15.96","0.01","5.339","0.005","16.97","0.02","90","","117.43","0.06","90","","1283","2","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 O -","- C16 H24 O -","- C64 H96 O4 -","4","1","SE1003","Nieger, M.; Egert, E.","Structure of an epoxytetradecahydropyrene","Acta Crystallographica Section C","1992","48","11","2044","2045","10.1107/S0108270192003160","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000478","5.187","0.003","14.362","0.005","19.845","0.004","90","","93.42","0.04","90","","1475.7","1","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 N3 O -","- C7 H7 N3 O -","- C56 H56 N24 O8 -","8","2","AS0594","Okabe, N.; Kisaichi, H.","Structure of phenylazocarboxamide","Acta Crystallographica Section C","1992","48","11","2047","2049","10.1107/S0108270192003081","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000479","6.628","0.004","21.495","0.006","23.526","0.006","90","","90","","90","","3352","2","","","","","","","","","","","","6","C m c a","","","","","","- C16 H12 F6 O2 P S2 -","- C16 H12 F12 O2 P S2 -","- C128 H96 F96 O16 P8 S16 -","8","","AB0275","Thorup, N.; Frederiksen, P.; Bechgaard, K.","Structure of the cation radical salt 3,8-dimethoxy-1,6-dithiapyrenium hexafluorophosphate","Acta Crystallographica Section C","1992","48","11","2049","2051","10.1107/S0108270192002683","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000480","10.667","0.002","16.552","0.005","8.116","0.001","90","","90","","90","","1433","0.5","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C15 H24 N2 O2 -","- C15 H24 N2 O2 -","- C60 H96 N8 O8 -","4","1","CR0413","Khan, M. A.; Burrows, G. E.; Holt, E. M.","(5α,6α,7α,11β)-Δ^13,14^-Sophocarpine monohydrate","Acta Crystallographica Section C","1992","48","11","2051","2053","10.1107/S0108270192003500","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","190826","2020-10-21","18:00:00",""
"2000481","7.7464","0.0004","12.214","0.001","7.8813","0.0009","88.78","0.01","119.255","0.006","103.803","0.007","627.78","0.11","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H12 N2 O2 -","- C15 H12 N2 O2 -","- C30 H24 N4 O4 -","2","1","PA0274","Rodier, N.; Robert, J.-M.; Leblois, D.; Le Baut, G.","Structure cristalline d'un <i>N</i>-azaarylphtalimide à activité anti-inflammatoire, le 2-(4,6-diméthylpyridin-2-yl)-2,3-dihydro-1<i>H</i>-isoindole-1,3-dione","Acta Crystallographica Section C","1992","48","11","2053","2054","10.1107/S0108270192002415","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000482","10.485","0.005","16.892","0.008","19.75","0.006","90","","90","","90","","3498","3","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 N2 O -","- C20 H26 N2 O -","- C160 H208 N16 O8 -","8","2","AL0529","Soriano-García, M.","Structure of ibogaine","Acta Crystallographica Section C","1992","48","11","2055","2057","10.1107/S0108270192002786","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000483","7.652","0.002","10.398","0.001","11.135","0.002","90","","96.8","0.01","90","","879.7","0.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H11 N3 O2 S -","- C6 H11 N3 O2 S -","- C24 H44 N12 O8 S4 -","4","1","AS0572","Ng, S. W.","Structure of 2-[1-(2-carboxyethyl)ethylidene]hydrazinecarbothioamide","Acta Crystallographica Section C","1992","48","11","2057","2058","10.1107/S0108270192002592","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000484","11.336","0.002","10.134","0.003","20.275","0.003","90","","90","","90","","2329.2","0.9","","","","","","","","","","","","4","P b c a","","","","","","- C12 H5 N3 O6 -","- C12 H5 N3 O6 -","- C96 H40 N24 O48 -","8","1","AL0528","Du, M.-H.; Hitchcock, P. B.","1,3-Dinitropyrrolo[1,2-<i>b</i>]isoquinoline-5,10-dione","Acta Crystallographica Section C","1992","48","11","2058","2060","10.1107/S0108270192002774","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000485","16.2","0.002","7.182","0.002","13.758","0.002","90","","126.99","0.01","90","","1278.6","0.5","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","","","","","- C14 H20 O2 -","- C14 H20 O2 -","- C56 H80 O8 -","4","0.5","DU0326","Bois, C.; Martin, R.","Structure of 1-[3-(1,1-dimethylethyl)-2-hydroxy-6-methylphenyl]-1-propanone","Acta Crystallographica Section C","1992","48","11","2060","2061","10.1107/S0108270192003524","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000486","14.075","0.002","14.075","0.002","10.115","0.002","90","","90","","120","","1735.4","0.5","293","","","","","","","","","","","4","P 31","","","","","","- Er0.05 F4 K Y0.95 -","- F4 K Y -","- F72 K18 Y18 -","18","6","DU1003","Le Fur, Y.; Khaidukov, N. M.; Aléonard, S.","Structure of KY~0.95~Er~0.05~F~4~","Acta Crystallographica Section C","1992","48","11","2062","2064","10.1107/S010827019200461X","","","0.5608","AgKα","","","0.032","","","0.035","","","","","3.494","3.494","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000487","4.6445","0.0007","4.6445","0.0007","9.354","0.002","90","","90","","120","","174.75","0.05","293","1","293","1","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- In La Pd2 -","- In La Pd2 -","- In2 La2 Pd4 -","2","0.0833333","SH1014","Xue, B.; Schwer, H.; Hulliger, F.","Structure of LaPd~2~In","Acta Crystallographica Section C","1992","48","11","2064","2065","10.1107/S0108270192007303","","","0.71073","MoKα","","0.0377","0.0369","","0.0977","0.0974","","","","1.565","1.572","1.572","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000488","6.077","0.001","6.077","0.001","36.659","0.006","90","","90","","120","","1172.4","0.3","293","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- Al13.4 Ba15 Ga14.5 -","- Al2.07 Ba15 Ga7.86 -","- Al2.07 Ba15 Ga7.86 -","1","0.0277778","NA1010","Fornasini, M. L.; Pani, M.","Ba~15~Al~13.4~Ga~14.5~, a disordered structure derived from Sr~5~Al~9~","Acta Crystallographica Section C","1992","48","11","2067","2069","10.1107/S0108270192007534","","","0.7107","MoKα","","","0.053","","","0.081","","","","","5.8","5.8","","","","","has coordinates","203894","2020-10-21","18:00:00",""
"2000489","15.81","0.003","6.052","0.001","10.482","0.002","90.79","0.03","102.31","0.03","89.13","0.03","979.7","0.3","296","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","","- H13 N3 O8 Se2 -","- H14 N3 O8 Se2 -","- H56 N12 O32 Se8 -","4","","NA1004","Pietraszko, A.; Łukaszewicz, K.; Augustyniak, M. A.","Structure of phase III of (NH~4~)~3~H(SeO~4~)~2~","Acta Crystallographica Section C","1992","48","11","2069","2071","10.1107/S0108270192005006","","","0.71073","MoKα","","","0.0283","","","0.0343","","","","","1.1617","1.1617","","","","","has coordinates","203573","2020-10-21","18:00:00",""
"2000490","19.975","0.007","8.377","0.003","16.234","0.006","90","","103.59","0.04","90","","2640.4","1.7","294","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C18 H32 Br3 N6 O3 Rh -","- C18 H32 Br3 N6 O3 Rh -","- C72 H128 Br12 N24 O12 Rh4 -","4","1","HH1011","Schaefer, W. P.; Krotz, A. H.; Kuo, L. Y.; Shields, T. P.; Barton, J. K.","Metallointercalators: structure of <i>rac</i>-bis(ethylenediamine)(9,10-phenanthrenequinone diimine)rhodium(III) tribromide trihydrate","Acta Crystallographica Section C","1992","48","11","2071","2073","10.1107/S0108270192006917","","","0.71073","MoKα","","","","","","0.015","","","","","1.16","1.16","","","","","has coordinates","190727","2020-10-21","18:00:00",""
"2000491","9.551","0.002","10.486","0.003","12.543","0.002","90","","90","","90","","1256.2","0.5","0","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C7 H17 Cl2 N O Pt S -","- C7 H17 Cl2 N O Pt S -","- C28 H68 Cl8 N4 O4 Pt4 S4 -","4","1","AB1016","Lövqvist, K.; Oskarsson, Å.","Structure of <i>trans</i>-dichloro(dimethylsulfoxide)(piperidine)platinum(II)","Acta Crystallographica Section C","1992","48","11","2073","2075","10.1107/S0108270192007212","","","0.71069","MoKα","","","0.048","","","0.061","","","","","1.04","1.04","","","","","has coordinates","206336","2020-10-21","18:00:00",""
"2000492","12.073","0.002","13.562","0.002","6.2527","0.0005","101.05","0.09","103.38","0.08","70.76","0.01","932.9","0.4","296","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H16 N2 O2 S3 -","- C19 H16 Br N2 O2 S3 -","- C38 H32 Br2 N4 O4 S6 -","2","1","MU1006","Beddoes, R. L.; Russell, J. R.; Garner, C. D.; Joule, J. A.","Regioselective pyrazine ring reduction of 4-(quinoxalin-2-yl)-1,3-dithiole-2-thione","Acta Crystallographica Section C","1992","48","11","2075","2078","10.1107/S0108270192006115","","","1.54178","CuKα","","","0.054","","","0.066","","","","","2.42","2.42","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000493","12.288","0.014","14.863","0.011","18.479","0.016","90","","90","","90","","3375","5","298","","","","","","","","","","","5","P c c n","-P 2ab 2ac","","","","","- C32 H44 Br N3 O4 -","- C36 H54 Br N3 O4 -","- C144 H216 Br4 N12 O16 -","4","0.5","MU1007","Elding, M.; Larsson, A.-K.; Svensson, G.; Albertsson, J.; Eberson, L.","Structure of a `hypervalent' linear bis(phthalimidato)bromate(I) complex","Acta Crystallographica Section C","1992","48","11","2078","2080","10.1107/S0108270192006164","","","0.71069","MoKα","","","0.063","","","0.069","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000494","10.046","0.002","12.365","0.002","12.065","0.002","90","","111.6","0.02","90","","1393.5","0.5","292","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C15 H22 O5 -","- C15 H22 O5 -","- C60 H88 O20 -","4","1","LI1013","Castellano, E. E.; Zukerman-Schpector, J.; Ferraz, H. M. C.; de Souza, A. J. C.; Tenius, B. S. M.","Structure of an intermediate in the synthesis of corymbolone","Acta Crystallographica Section C","1992","48","11","2080","2082","10.1107/S0108270192007455","","","0.71073","MoKα","","","0.055","","","0.062","","","","","1.3","1.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000495","31.196","0.008","7.748","0.001","10.154","0.002","90","","96.32","0.02","90","","2439.4","0.9","293","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C26 H31 N O4 S -","- C26 H31 N O4 S -","- C104 H124 N4 O16 S4 -","4","2","KA1007","Stanković, S.; Stefanović, A.; Bruvo, M.; Altomare, A.","<small>D</small>-Secoestrone derivatives. II. 16-Cyano-3-methoxy-16,17-secoestra-1,3,5(10)-trien-17-yl <i>p</i>-toluenesulfonate","Acta Crystallographica Section C","1992","48","11","2082","2085","10.1107/S0108270192006450","","","1.5418","CuKα","","","0.057","","","0.061","","","","","0.6","0.6","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000496","22.046","0.006","6.226","0.001","8.48","0.003","90","","90","","90","","1164","0.6","294","","","","","","","","","","","4","P n a 21","","","","","","- C4 H12 P2 S4 -","- C4 H12 P2 S4 -","- C16 H48 P8 S16 -","4","1","AB1019","Gallacher, A. C.; Pinkerton, A. A.","Structures of bis(dialkylthiophosphoryl) disulfides, [<i>R</i>~2~P(S)]~2~S~2~, <i>R</i> = Me, ^<i>i^</i>Pr, and the question of P-S π bonding","Acta Crystallographica Section C","1992","48","11","2085","2088","10.1107/S0108270192008333","","","0.71073","MoKα","","","0.042","","","0.041","","","","","1.265","1.265","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000497","7.616","0.001","11.378","0.001","12.403","0.002","68.33","0.01","72.61","0.01","85.53","0.01","952.5","0.2","294","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H28 P2 S4 -","- C12 H28 P2 S4 -","- C24 H56 P4 S8 -","2","1","AB1019","Gallacher, A. C.; Pinkerton, A. A.","Structures of bis(dialkylthiophosphoryl) disulfides, [<i>R</i>~2~P(S)]~2~S~2~, <i>R</i> = Me, ^<i>i^</i>Pr, and the question of P-S π bonding","Acta Crystallographica Section C","1992","48","11","2085","2088","10.1107/S0108270192008333","","","0.71073","MoKα","","","0.025","","","0.032","","","","","1","1","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000498","9.622","0.002","27.282","0.007","8.107","0.002","90","","90","","90","","2128.1","0.9","296","","296","","","","","","","","","5","P -1","-P 1","2","","Ethyl (2R, 3R, SR)-3-(Ethoxycarbonyloxy)-2-[1-(p-tolylsulfinyl) cyclopropyl]-1-pyrrolidinecarboxylate","","- C20 H27 N O6 S -","- C10 H13.5 N0.5 O3 S0.5 -","- C40 H54 N2 O12 S2 -","4","2","CR1017","Robinson, P. D.; Hua, D. H.; Wu, X.; Miao, S. W.; Meled, M.","Ethyl (2<i>R</i>,3<i>R</i>,<i>SR</i>)-3-(ethoxycarbonyloxy)-2-[1-(<i>p</i>-tolylsulfinyl)cyclopropyl]-1-pyrrolidinecarboxylate","Acta Crystallographica Section C","1992","48","11","2088","2090","10.1107/S010827019200814X","","","0.71069","MoKα","","","0.056","","","0.053","","","","","1.58","1.58","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000499","6.562","0.004","20.473","0.011","15.202","0.006","90","","94.73","","90","","2035.3","1.8","293","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H29 N O3 Si -","- C19 H29 N O3 Si -","- C76 H116 N4 O12 Si4 -","4","2","HH1008","Schaefer, W. P.; Subramanian, V.; Myers, A. G.","Structure of an 11-membered cyclic silyl enol ether from condensation of methacrolein and a pseudoephedrine-derived <i>O</i>-silyl ketene <i>N</i>,<i>O</i>-acetal","Acta Crystallographica Section C","1992","48","11","2090","2092","10.1107/S0108270192006851","","","0.71073","MoKα","","","","","","0.05","","","","","1.72","1.72","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000500","14.232","0.003","5.973","0.001","14.98","0.002","90","","93.52","0.01","90","","1271","0.4","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 O S3 -","- C13 H14 O S3 -","- C52 H56 O4 S12 -","4","1","HH1012","Watson, W. H.; Krawiec, M.; Ghosh, T.; Bartlett, P. D.","<i>endo</i>-2-Phenyl-<i>exo</i>-3,4,5-trithiatricyclo[5.2.1.0^2,6^]decane <i>exo</i>-4-oxide","Acta Crystallographica Section C","1992","48","11","2092","2094","10.1107/S0108270192007030","","","0.71073","MoKαradiation,graphitemonochromator","","0.041","0.0346","","0.0394","0.0388","","","","","1.737","1.737","","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2000501","7.7819","0.0008","8.069","0.002","11.574","0.002","90","","90","","90","","726.8","0.2","291","","","","","","","","","","","4","P c n b","","","","","","- C5 H12 N2 O4 -","- C5 H12 N2 O4 -","- C20 H48 N8 O16 -","4","0.5","PA1005","Bréhin, P.; Kozelka, J.; Bois, C.","Diammonium cyclopropane-1,1-dicarboxylate","Acta Crystallographica Section C","1992","48","11","2094","2096","10.1107/S0108270192006802","","","0.7107","MoKα","","","0.032","","","0.031","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000502","24.565","0.002","17.75","0.002","10.959","0.003","90","","105.24","0.03","90","","4610.4","1.6","294","","","","","","","","","","","4","C 1 2/c 1","","","","","","- C26 H24 N4 O4 -","- C26 H23 N4 O4 -","- C208 H184 N32 O32 -","8","1","CR0411","Liu, H.; Wang, X.; Zhang, X.","Structure of the 1:1 complex of 6,6'-diquinolyl ether with 5,5-diethylbarbituric acid","Acta Crystallographica Section C","1992","48","11","2096","2098","10.1107/S010827019200828X","","","0.7107","MoKα","","","0.052","","","0.047","","","","","3.75","3.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000503","12.326","0.002","17.177","0.001","5.906","0.002","90","","90","","106.4","0.01","1199.6","0.5","293","","","","","","","","","","","4","P 1 1 21/b","-P 2bc","","","","","- C14 H13 N S -","- C14 H13 N S -","- C56 H52 N4 S4 -","4","1","DU1010","Metin, J.; Roche, D.; Veschambre, H.; Madesclaire, M.","(<i>E</i>)-Methyl 2-phenyl-2-(3-pyridyl)vinyl sulfide","Acta Crystallographica Section C","1992","48","11","2098","2100","10.1107/S0108270192007339","","","0.71069","MoKα","","","0.045","","","0.044","","","","","2.2","2.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000504","10.605","0.0009","10.605","0.0009","6.4099","0.0005","90","","90","","90","","720.9","0.1","","","","","","","","","","","","5","P -4 m 2","P -4 -2","","","","","- K4 Nb8 O34 P4 Si -","- K4 Nb8 O34 P4 Si -","- K4 Nb8 O34 P4 Si -","1","0.125","DU0309","Leclaire, A.; Borel, M. M.; Chardon, J.; Grandin, A.; Raveau, B.","A niobium silicophosphate belonging to the niobium phosphate bronze series: K~4~Nb~8~P~4~SiO~34~","Acta Crystallographica Section C","1992","48","10","1744","1747","10.1107/S0108270192002129","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000505","9.254","0.005","12.747","0.003","7.805","0.002","90","","96.43","0.02","90","","914.9","0.6","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- K2 N4 O8 Pd -","- K2 N4 O8 Pd -","- K8 N16 O32 Pd4 -","4","1","HA0078","Blake, A. J.; Gould, R. O.; Johnson, B. F. G.; Parisini, E.","Redetermination of the structure of potassium tetranitropalladate(II)","Acta Crystallographica Section C","1992","48","10","1749","1751","10.1107/S0108270192000192","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000506","8.703","0.002","16.025","0.008","6.799","0.002","90","","100.83","0.02","90","","931.3","0.6","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C2 H8 Au Br N4 S2 -","- C2 H8 Au Br N4 S2 -","- C8 H32 Au4 Br4 N16 S8 -","4","0.5","HH0577","Porter, L. C.; Fackler, Jnr, J. P.; Costamagna, J.; Schmidt, R.","Structure of bis(thiourea)gold(I) bromide, [Au{SC(NH~2~)~2~}~2~]Br","Acta Crystallographica Section C","1992","48","10","1751","1754","10.1107/S0108270192001860","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000507","6.44","0.003","16.608","0.001","7.641","0.002","86.61","0.02","89.21","0.02","105.13","0.03","787.2","0.4","","","","","","","","","","","","6","A -1","","","","","","- C10 H24 Br Cl2 Cr N4 -","- C10 H24 Br Cl2 Cr N4 -","- C20 H48 Br2 Cl4 Cr2 N8 -","2","","HE0038","Dealwis, C. G.; Janes, R. W.; Palmer, R. A.; Lisgarten, J. N.; Maes, D.; Flint, C. D.; Gazi, D. M.","Structures of chromium(III) cyclam complexes. 3. Structure of <i>trans</i>-dichloro(1,4,8,11-tetraazacyclotetradecane)chromium(III) bromide","Acta Crystallographica Section C","1992","48","10","1754","1756","10.1107/S0108270192000040","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000508","7.775","0.001","7.775","0.001","13.686","0.002","90","","90","","90","","827.33","0.19","","","","","","","","","","","","6","P 42/m","-P 4c","","","","","- C10 H24 Br2 Cl Cr N4 -","- C10 H24 Br3 Cl2 Cr N4 -","- C20 H48 Br6 Cl4 Cr2 N8 -","2","0.25","HE0039","Chattopadhyay, T. K.; Palmer, R. A.; Lisgarten, J. N.; Wyns, L.; Gazi, D. M.","Structures of chromium(III) cyclam complexes. 4. Structure of <i>trans</i>-bromochloro(1,4,8,11-tetraazacyclotetradecane)chromium(III) bromide displaying structural enantiomorphism with the dibromo complex","Acta Crystallographica Section C","1992","48","10","1756","1759","10.1107/S0108270192000039","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000509","10.704","0.001","19.562","0.003","19.823","0.003","90","","90","","90","","4150.8","1","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C54 H39 Nb O4 -","- C54 H39 Nb O4 -","- C216 H156 Nb4 O16 -","4","1","HU0405","Yu, J. S.; Fanwick, P. E.; Rothwell, I. P.","Structure of a tetrahedral niobium oxo compound [Nb(OC~6~H~3~Ph~2~-2,6)~3~(O)]","Acta Crystallographica Section C","1992","48","10","1759","1761","10.1107/S0108270192001744","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000510","9.266","0.003","11.385","0.003","12.606","0.003","112.72","","99.9","0.02","103.24","","1142.7","0.6","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C46 H32 F12 Ni O6 P2 -","- C46 H32 F12 Ni O6 P2 -","- C46 H32 F12 Ni O6 P2 -","1","0.5","HH0620","Polam, J. R.; Porter, L. C.","Structure of bis(hexafluoroacetylacetonato)bis(triphenylphosphine oxide)nickel(II)","Acta Crystallographica Section C","1992","48","10","1761","1764","10.1107/S0108270192001975","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000511","9.89","0.004","10.942","0.004","11.114","0.004","100.48","0.03","105.45","0.03","108.87","0.03","1048.5","0.8","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H24 F24 Ni2 O12 -","- C28 F24 Ni2 O12 -","- C28 F24 Ni2 O12 -","1","0.5","HH0565","Romero, R. R.; Cervantes-Lee, F.; Porter, L. C.","Structure of μ-dioxane-bis[(ethanol)bis(hexafluoroacetylacetonato)nickel(II)]","Acta Crystallographica Section C","1992","48","10","1764","1767","10.1107/S0108270192001884","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000512","19.759","0.003","17.016","0.003","13.661","0.003","90","","90","","90","","4593.1","1.5","","","","","","","","","","","","6","P b c a","","","","","","- C16 H32 Cl2 N4 Ni O8 -","- C16 H32 Cl2 N4 Ni O8 -","- C128 H256 Cl16 N32 Ni8 O64 -","8","1","CR0408","Szalda, D. J.; Fujita, E.","Structures of <i>racemic</i> and <i>meso</i> (5,7,7,12,14,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene)nickel(II) perchlorate","Acta Crystallographica Section C","1992","48","10","1767","1771","10.1107/S0108270192002397","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000513","10.257","0.003","10.742","0.002","10.885","0.002","90","","111.46","0.02","90","","1116.2","0.5","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H32 Cl2 N4 Ni O8 -","- C16 H32 Cl2 N4 Ni O8 -","- C32 H64 Cl4 N8 Ni2 O16 -","2","0.5","CR0408","Szalda, D. J.; Fujita, E.","Structures of <i>racemic</i> and <i>meso</i> (5,7,7,12,14,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene)nickel(II) perchlorate","Acta Crystallographica Section C","1992","48","10","1767","1771","10.1107/S0108270192002397","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000514","8.641","0.005","9.478","0.002","12.338","0.005","75.58","0.03","80.39","0.04","63.75","0.03","875.8","0.7","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C40 H58 Sc2 -","- C40 H58 Sc2 -","- C40 H58 Sc2 -","1","0.5","HH0622","Hajela, S.; Schaefer, W. P.; Bercaw, J. E.","Structure of a permethylcyclopentadienyl-μ-tetramethylcyclopentadienylmethylene scandium dimer","Acta Crystallographica Section C","1992","48","10","1771","1773","10.1107/S0108270192002038","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000515","13.11","0.008","17.163","0.015","20.623","0.014","104.02","0.07","99.38","0.05","100.24","0.06","4326","6","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C34 H64 Cl2 Li O2 Si3 Y -","- C34 Cl2 Li O2 Si3 Y -","- C136 Cl8 Li4 O8 Si12 Y4 -","4","2","HH0616","Marsh, R. E.; Schaefer, W. P.; Coughlin, E. B.; Bercaw, J. E.","A silicon-bridged bis(substituted Cp) yttrium complex","Acta Crystallographica Section C","1992","48","10","1773","1776","10.1107/S0108270192001987","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","287963","2023-12-04","08:48:51",""
"2000516","8.625","0.002","20.593","0.008","14.451","0.004","90","","90.32","0.02","90","","2566.7","1.4","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H32 N6 O1.5 Pt -","- C26 H34 N6 O2 Pt -","- C104 H136 N24 O8 Pt4 -","4","1","HH0621","Schaefer, W. P.; Connick, W. B.; Miskowski, V. M.; Gray, H. B.","A bis(pyrazolyl)(bipyridyl)platinum complex","Acta Crystallographica Section C","1992","48","10","1776","1778","10.1107/S0108270192002026","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000517","11.756","0.003","12.683","0.002","8.448","0.002","90","","100.42","0.01","90","","1238.8","0.5","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Br4 Hg2 S6 -","- C12 H24 Br4 Hg2 S6 -","- C24 H48 Br8 Hg4 S12 -","2","0.5","AB0268","Herceg, M.; Matković-Čalogović, D.","Tetrabromo(1,4,7,10,13,16-hexathiacyclooctadecane)dimercury(II)","Acta Crystallographica Section C","1992","48","10","1779","1782","10.1107/S0108270192002671","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206335","2020-10-21","18:00:00",""
"2000518","8.471","0.001","10.157","0.001","14.821","0.003","102.81","0.01","97.74","0.01","103.52","0.01","1185.4","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H36 Ca Cl2 O12 -","- C12 H36 Ca Cl2 O12 -","- C24 H72 Ca2 Cl4 O24 -","2","1","CD0085","Rogers, R. D.; Bond, A. H.","Structure of [Ca(triethylene glycol)~2~]Cl~2~.4H~2~O","Acta Crystallographica Section C","1992","48","10","1782","1785","10.1107/S010827019200235X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000519","19.113","0.003","15.079","0.002","5.782","0.001","90","","90","","90","","1666.4","0.4","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C13 H18 Cu N4 O7 -","- C13 H17 Cu N4 O7 -","- C52 H68 Cu4 N16 O28 -","4","1","MU0253","Solans, X.; Ruíz-Ramírez, L.; Martínez, A.; Gasque, L.; Moreno-Esparza, R.","Mixed chelate complexes. III. Structures of (<small>L</small>-alaninato)(aqua)(2,2'-bipyridine)copper(II) nitrate monohydrate and aqua(2,2'-bipyridine)(<small>L</small>-tyrosinato)copper(II) chloride trihydrate","Acta Crystallographica Section C","1992","48","10","1785","1788","10.1107/S0108270192000568","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","191052","2020-10-21","18:00:00",""
"2000520","9.307","0.002","9.307","0.002","44.432","","90","","90","","120","","3333.1","1","","","","","","","","","","","","6","P 61","P 61","","","","","- C19 H26 Cl Cu N3 O7 -","- C19 H14 Cl Cu N3 O7 -","- C114 H84 Cl6 Cu6 N18 O42 -","6","1","MU0253","Solans, X.; Ruíz-Ramírez, L.; Martínez, A.; Gasque, L.; Moreno-Esparza, R.","Mixed chelate complexes. III. Structures of (<small>L</small>-alaninato)(aqua)(2,2'-bipyridine)copper(II) nitrate monohydrate and aqua(2,2'-bipyridine)(<small>L</small>-tyrosinato)copper(II) chloride trihydrate","Acta Crystallographica Section C","1992","48","10","1785","1788","10.1107/S0108270192000568","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","191086","2020-10-21","18:00:00",""
"2000521","9.188","0.003","14.229","0.002","10.628","0.012","90","","104.74","0.06","90","","1343.7","1.6","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H19 I O2 -","- C11 H19 I O2 -","- C44 H76 I4 O8 -","4","1","PA0268","Sans-Lenain, S.; Reynes, A.; Gleizes, A.","4-Iodo-2,2,6,6-tetramethylheptane-3,5-dione","Acta Crystallographica Section C","1992","48","10","1788","1791","10.1107/S0108270192001537","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000522","16.247","0.009","11.182","0.007","13.42","0.006","90","","91.62","0.04","90","","2437","2","","","","","","","","","","","","5","C 1 2 1","","","","","","- C21 H25 N O10 S -","- C21 H25 N O10 S -","- C84 H100 N4 O40 S4 -","4","1","PA0259","Durier, V.; Driguez, H.; Rollin, P.; Duee, E.; Buisson, G.","Stereochemical investigation of 2,3,4,6-tetra-<i>O</i>-acetyl-1-<i>S</i>-benzhydroximoyl-α-<small>D</small>-glucopyranose","Acta Crystallographica Section C","1992","48","10","1791","1794","10.1107/S0108270192001550","","","0.711","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000523","9.7768","0.0004","10.6279","0.0003","15.3157","0.0004","90","","90","","90","","1591.41","0.09","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H23 Cl N2 O -","- C15 H19 Cl N2 O -","- C60 H76 Cl4 N8 O4 -","4","1","KA0013","Csöregh, I.","Structures and absolute configurations of enantiomers of two local anaesthetics: (2<i>S</i>)-1-methyl- and (2<i>R</i>)-1-butyl-2',6'-pipecoloxylidide hydrochlorides","Acta Crystallographica Section C","1992","48","10","1794","1798","10.1107/S0108270192001604","","","1.54183","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000524","9.7018","0.0006","10.9221","0.0008","9.9519","0.0007","90","","114.38","0.06","90","","960.5","0.5","","","","","","","","","","","","5","P 1 21 1","","","","","","- C18 H30 Cl N2 O -","- C18 H29 Cl N2 O -","- C36 H58 Cl2 N4 O2 -","2","1","KA0013","Csöregh, I.","Structures and absolute configurations of enantiomers of two local anaesthetics: (2<i>S</i>)-1-methyl- and (2<i>R</i>)-1-butyl-2',6'-pipecoloxylidide hydrochlorides","Acta Crystallographica Section C","1992","48","10","1794","1798","10.1107/S0108270192001604","","","1.54183","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000525","24.324","0.004","6.537","0.002","15.598","0.002","90","","93.52","0.01","90","","2475.5","0.9","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C15 H11 Cl O2 -","- C15 H11 Cl O2 -","- C120 H88 Cl8 O16 -","8","1","GE0304","Gilli, P.; Ferretti, V.; Bertolasi, V.; Gilli, G.","Structure of 3-(<i>p</i>-chlorophenyl)-1-phenyl-1,3-propanedione enol","Acta Crystallographica Section C","1992","48","10","1798","1801","10.1107/S0108270192001719","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000526","6.161","0.002","8.045","0.003","20.811","0.006","90","","90","","90","","1031.5","0.6","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C11 H14 N2 O -","- C11 H14 N2 O -","- C44 H56 N8 O4 -","4","1","AL0526","Regan, A. C.; Wallis, J. D.; Povey, D. C.","A urea with non-planar nitrogen-bonding geometry","Acta Crystallographica Section C","1992","48","10","1801","1804","10.1107/S0108270192001641","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000527","9.821","0.001","10.222","0.003","13.871","0.001","90","","90","","90","","1392.5","0.4","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H22 Cl N O3 -","- C12 H22 Cl N O3 -","- C48 H88 Cl4 N4 O12 -","4","1","PA0272","Dupont, L.; Dideberg, O.; Pardon, M. C.; Piette, J. L.","Structure du chlorhydrate de (1<i>R</i>,2<i>S</i>)(3-hydroxy-3-<i>m</i>-hydroxyphényl-2-propyl)triméthylammonium monohydrate","Acta Crystallographica Section C","1992","48","10","1804","1806","10.1107/S0108270192001562","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000528","11","0.02","7.48","0.01","7.49","0.01","90","","114.3","0.1","90","","561.7","1.5","","","","","","","","","","","","4","P 1 21 1","","","","","","- C12 H17 N O2 -","- C12 H17 N O2 -","- C24 H34 N2 O4 -","2","1","PA0249","Lapasset, J.; El Marini, A.; Roumestant, M. L.; Vidal, Y.; Viallefont, P.","Structure of the lactonic adduct from 2-hydroxypinan-3-one and glycine","Acta Crystallographica Section C","1992","48","10","1806","1808","10.1107/S0108270192001823","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000529","16.398","0.007","8.128","0.003","7.937","0.003","90","","92.13","","90","","1057.1","0.7","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C10 H12 O2 S2 -","- C10 H12 O2 S2 -","- C40 H48 O8 S8 -","4","1","PA0269","Ginderow, D.; Mornon, J.-P.; Erdelmeier, I.; Dansette, P.; Mansuy, D.","Structure du 2,3-dihydro-3-(2-hydroxyéthylthio)benzo[<i>b</i>]thiophène 1-oxyde, C~10~H~12~O~2~S~2~","Acta Crystallographica Section C","1992","48","10","1808","1810","10.1107/S0108270192002002","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2000530","18.917","0.01","11.843","0.008","13.177","0.007","90","","90","","90","","2952","3","","","","","","","","","","","","3","P b c n","","","","","","- C18 H18 O2 -","- C18 H18 O2 -","- C144 H144 O16 -","8","1","CR0397","Meyers, C. Y.; Tunnell, J. L.; Robinson, P. D.; Hua, D. H.; Saha, S.","Structure of <i>sp</i>-9-hydroxy-9-pivaloylfluorene, product of base-catalyzed autoxidation of <i>ap</i>-9-pivaloylfluorene","Acta Crystallographica Section C","1992","48","10","1815","1818","10.1107/S0108270192002014","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000531","15.582","0.005","15.582","0.005","17.528","0.005","90","","90","","90","","4256","2","","","","","","","","","","","","4","I 41 c d","I 4bw -2c","110","","","","- C11 H14 N2 O2 -","- C11 H14 N2 O2 -","- C176 H224 N32 O32 -","16","1","NA1000","Maurin, J. K.; Paul, I. C.; Curtin, D. Y.","Structure of (<i>E</i>)-4-benzoylbutyramide oxime","Acta Crystallographica Section C","1992","48","10","1819","1821","10.1107/S0108270192004463","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205964","2020-10-21","18:00:00",""
"2000532","7.9333","0.0007","25.947","0.002","11.855","0.001","90","","90","","90","","2440.3","0.4","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C112 H96 N16 O16 -","8","1","NA1001","Maurin, J. K.; Paul, I. C.; Curtin, D. Y.","Structure of 3-benzoylbenzamide oxime","Acta Crystallographica Section C","1992","48","10","1821","1823","10.1107/S010827019200458X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000533","14.348","0.004","13.086","0.004","11.851","0.002","90","","90","","90","","2225.1","1","296","1","296","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H36 O6 -","- C24 H36 O6 -","- C96 H144 O24 -","4","1","NA0013","Argay, G.; Kálmán, A.; Ribár, B.; Živanov-Stakic, D.; Vladimirov, S.","Structures of two bufadienolides: telocinobufagin (3β,5β-dihydroxy-5β,14β-bufa-20,22-dienolide) monohydrate and 14α-artebufogenin (3β-hydroxy-15-oxo-5β,14α-bufa-20,22-dienolide)","Acta Crystallographica Section C","1992","48","10","1823","1827","10.1107/S0108270192001859","","","0.71073","X-rayMoKalphamean","","0.079","0.042","","","0.044","","","","","0.82","0.82","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000534","7.92","0.001","11.507","0.001","22.519","0.002","90","","90","","90","","2052.3","0.4","296","1","296","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H32 O4 -","- C24 H32 O4 -","- C96 H128 O16 -","4","1","NA0013","Argay, G.; Kálmán, A.; Ribár, B.; Živanov-Stakic, D.; Vladimirov, S.","Structures of two bufadienolides: telocinobufagin (3β,5β-dihydroxy-5β,14β-bufa-20,22-dienolide) monohydrate and 14α-artebufogenin (3β-hydroxy-15-oxo-5β,14α-bufa-20,22-dienolide)","Acta Crystallographica Section C","1992","48","10","1823","1827","10.1107/S0108270192001859","","","1.54184","X-rayCu-Kalpha","","0.069","0.047","","","0.041","","","","","0.68","0.68","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000535","19.95","0.01","9.782","0.005","22.07","0.01","90","","102.82","0.03","90","","4200","4","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H25 F N4 O2 -","- C24 H25 F N4 O2 -","- C192 H200 F8 N32 O16 -","8","2","NA0018","Jottier, W. I.; De Winter, H. L.; Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","Structure of the antipsychotic drug 3-{2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl}-2,9-dimethyl-4<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidin-4-one (ocaperidone)","Acta Crystallographica Section C","1992","48","10","1827","1830","10.1107/S0108270192001677","","","0.71069","Mo-Kalpha","","","0.071","","","0.075","","","","","2.71","2.71","","","","","has coordinates,has disorder","278324","2022-10-03","14:41:52",""
"2000536","12.618","0.004","12.618","0.004","12.618","0.004","90","","90","","90","","2009","1.1","","","","","","","","","","","","4","I -4 3 d","","","","","","- B K O6 Si2 -","- B3 K O6 Si3 -","- B48 K16 O96 Si48 -","16","0.333333","KA0017","Mikloš, D.; Smrčok, Ľ.; Ďurovič, S.; Gyepesová, D.; Handlovič, M.","Refinement of the structure of boroleucite, K(BSi~2~O~6~)","Acta Crystallographica Section C","1992","48","10","1831","1832","10.1107/S0108270192002270","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000537","9.875","0.003","14.794","0.005","14.917","0.005","71.99","0.02","70.41","0.02","74.67","0.02","1920.8","1.1","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H39 Cl2 Mn O P2 -","- C44 H39 Cl2 Mn O P2 -","- C88 H78 Cl4 Mn2 O2 P4 -","2","1","HH0611","Rheingold, A. L.; White, C. B.; Haggerty, B. S.; Terry, M. R.; Geoffroy, G. L.","Carbonyl(1-methyl-η^5^-cyclopentadienyl)bis(triphenylphosphine)manganese dichloromethane solvate","Acta Crystallographica Section C","1992","48","10","1832","1834","10.1107/S0108270192002191","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","202203","2020-10-21","18:00:00",""
"2000538","10.721","0.001","10.716","0.001","16.365","0.002","90","","90","","90","","1880.1","0.3","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 Cl P Se Sn -","- C16 H20 Cl P Se Sn -","- C64 H80 Cl4 P4 Se4 Sn4 -","4","1","AL0530","Preut, H.; Godry, B.; Mitchell, T. N.","Structure of [2-(chlorodimethylstannyl)ethyl]diphenylphosphine selenide","Acta Crystallographica Section C","1992","48","10","1834","1835","10.1107/S0108270192001793","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000539","15.783","0.003","15.783","0.003","16.965","0.008","90","","90","","90","","4226","2","","","","","","","","","","","","5","I 41/a c d","-I 4bd 2c","","","","","- C20 H20 Cl2 N4 Ni -","- C20 H20 Cl2 N4 Ni -","- C160 H160 Cl16 N32 Ni8 -","8","","HH0615","Bachman, R. E.; Whitmire, K. H.; Mandal, S.; Bharadwaj, P. K.","Dichlorotetrakis(pyridine)nickel(II)","Acta Crystallographica Section C","1992","48","10","1836","1837","10.1107/S0108270192001872","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000540","7.101","0.002","13.92","0.003","19.05","0.004","90","","98.47","0.02","90","","1862.5","0.8","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 Cl4 N6 Ti2 -","- C12 H14 Cl4 N6 Ti2 -","- C48 H56 Cl16 N24 Ti8 -","4","1","CR0406","Kirschbaum, K.; Giolando, D. M.","Structure of the μ-azido-dichloro(η^5^-methylcyclopentadienyl)titanium(IV) dimer","Acta Crystallographica Section C","1992","48","10","1837","1839","10.1107/S0108270192002385","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000541","10.671","0.001","11.777","0.002","25.494","0.001","90","","98.148","0.005","90","","3171.5","0.6","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C36 H30 Cl O P Sn -","- C36 H30 Cl O P Sn -","- C144 H120 Cl4 O4 P4 Sn4 -","4","1","AS0567","Ng, S. W.; Kumar Das, V. G.","Structure of triphenyltin chloride-triphenylphosphine oxide (1/1) complex","Acta Crystallographica Section C","1992","48","10","1839","1841","10.1107/S0108270192001306","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000542","11.732","0.005","12.404","0.004","16.194","0.005","90","","108.8","0.03","90","","2230.9","1.4","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H16 Cl Co N4 O7 -","- C25 H16 Cl Co N4 O7 -","- C100 H64 Cl4 Co4 N16 O28 -","4","1","AL0481","McAuliffe, C. A.; Pritchard, R. G.; Bermejo, M. R.; Garcia-Vazquez, A.; Macias, A.; Sanmartín, J.; Romero, J.; Sousa, A.","Carbonatobis(1,10-phenanthroline)cobalt(III) perchlorate","Acta Crystallographica Section C","1992","48","10","1841","1842","10.1107/S0108270192002105","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000543","6.701","0.001","8.674","0.001","9.179","0.001","83.5","0.01","89.37","0.01","74.35","0.01","510.34","0.11","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C4 H8 Cl8 F6 Mo2 N4 O2 -","- C4 H8 Cl8 F6 Mo2 N4 O2 -","- C4 H8 Cl8 F6 Mo2 N4 O2 -","1","0.5","SE1001","Herbst-Irmer, R.; Egert, E.","Structure of bis(trifluoracetamidinium) di-μ-chloro-hexachlorodioxodimolybdate(V)","Acta Crystallographica Section C","1992","48","10","1843","1844","10.1107/S0108270192002488","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000544","12.379","0.005","13.79","0.006","16.031","0.006","90","","99.73","0.04","90","","2697.2","1.9","","","","","","","","","","","","8","P 1 21/c 1","","","","","","- C14 H27 B Cl3 F4 N Ni2 S6 -","- C14 H27 B Cl3 F6 N Ni2 S6 -","- C56 H108 B4 Cl12 F24 N4 Ni8 S24 -","4","1","HA0100","Blake, A. J.; Halcrow, M. A.; Schröder, M.","Tri-μ-chloro-bis(1,4,7-trithiacyclononane)dinickel(II) tetrafluoroborate acetonitrile solvate","Acta Crystallographica Section C","1992","48","10","1844","1846","10.1107/S0108270192002439","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000545","23.867","0.002","9.492","0.001","11.615","0.0006","90","","90","","90","","2631.3","0.4","","","","","","","","","","","","4","P n a 21","","","","","","- C29 H31 N3 O5 -","- C29 H31 N3 O5 -","- C116 H124 N12 O20 -","4","1","PA0267","Theobald, F.; Rodier, N.; Moustaid, K.; Laude, B.","Structure of ethyl 8,9-dimethoxy-3-(4-methoxyphenyl)-10b-methyl-1-phenyl-4,5,6,10b-tetrahydro-1,2,4-triazolo[3,4-<i>a</i>]isoquinoline-5-carboxylate","Acta Crystallographica Section C","1992","48","10","1846","1848","10.1107/S0108270192001161","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000546","12.384","0.001","17.786","0.001","21.903","0.002","97.68","0.01","96.96","0.01","105.73","0.01","4539","0.7","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C50 H70 O5 -","- C51.5 O5.5 -","- C206 O22 -","4","2","AB0181","Bugge, K.-E.; Verboom, W.; Reinhoudt, D. N.; Harkema, S.","Ethanol complex of 1,3-diethoxy-<i>p</i>-<i>tert</i>-butylcalix[4]arene","Acta Crystallographica Section C","1992","48","10","1848","1851","10.1107/S0108270192001239","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000547","9.521","0.003","13.007","0.004","14.116","0.006","90","","100.77","0.01","90","","1717.3","1.1","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 Cl N3 S -","- C18 H18 Cl N3 S -","- C72 H72 Cl4 N12 S4 -","4","1","PA0271","Dupont, L.; Dideberg, O.; Liégeois, J. F.; Delarge, J.","Structure du 8-chloro-11-(4-méthylpipérazin-1-yl)dibenzo[<i>b</i>,<i>f</i>]-1,4-thiazépine","Acta Crystallographica Section C","1992","48","10","1851","1853","10.1107/S0108270192001021","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000548","6.739","0.005","16.963","0.006","17.094","0.006","90","","90","","90","","1954.1","1.7","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C22 H32 O6 -","- C22 H32 O6 -","- C88 H128 O24 -","4","1","AB0231","Wang, J.-L.; Zhang, L.-J.; Miao, F.-M.; Sun, H.-D.; Gong, Y.-H.","Structure of xindongnin B","Acta Crystallographica Section C","1992","48","10","1853","1855","10.1107/S0108270191013410","","","1.541","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000549","15.608","0.004","8.637","0.002","17.273","0.005","90","","97.71","0.02","90","","2307.5","1","","","","","","","","","","","","5","P 1 21 1","","","","","","- C23 H34 Cl N O3 -","- C23 H34 Cl N O3 -","- C92 H136 Cl4 N4 O12 -","4","2","HH0604","Flippen-Anderson, J. L.; George, C. F.","Absolute configuration of ({-})-α-acetylmethadol hydrochloride","Acta Crystallographica Section C","1992","48","10","1855","1857","10.1107/S0108270192001409","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2000550","7.766","0.006","11.809","0.004","27.219","0.011","90","","90","","90","","2496","2","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C26 H34 O6 -","- C26 H34 O6 -","- C104 H136 O24 -","4","1","ST0563","Baures, P. W.; Miski, M.; Eggleston, D. S.","Structure of 3,6-diacetyl-8-benzoylantakyatriol","Acta Crystallographica Section C","1992","48","10","1857","1859","10.1107/S0108270192001598","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000551","14.392","0.002","18.837","0.003","10.191","0.002","90.15","0.02","98.72","0.02","85.49","0.02","2722.3","0.8","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 F3 N O2 -","- C14 H14 F3 N O2 -","- C112 H112 F24 N8 O16 -","8","4","MU0286","Chinnakali, K.; Sivakumar, K.; Natarajan, S.","Structure of 7-diethylamino-4-trifluoromethylcoumarin","Acta Crystallographica Section C","1992","48","10","1859","1862","10.1107/S0108270192000623","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000552","13.075","0.002","13.284","0.003","9.924","0.002","103.68","0.03","95.28","0.03","66.34","0.04","1534","0.7","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H17 Cl N2 O3 S -","- C12 H17 Cl N2 O3 S -","- C48 H68 Cl4 N8 O12 S4 -","4","2","AS0517","Ghosh, M.; Das, A. K.; Mazumdar, S. K.; Bocelli, G.","Structure of 3-<i>tert</i>-butyl-1-[(4-chlorophenyl)sulfonyl]-1-methylurea","Acta Crystallographica Section C","1992","48","10","1862","1864","10.1107/S0108270191014658","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000553","8.732","0.006","7.639","0.005","14.966","0.01","90","","95.85","0.02","90","","993.1","1.2","","","","","","","","","","","","4","P 1 21 1","","","","","","- C22 H27 N O4 -","- C22 H27 N O4 -","- C44 H54 N2 O8 -","2","1","KA0018","Ribár, B.; Lazar, D.; Radivojević, P.; Engel, P.; Gašić, O.; Kanyó, I.","Structure of corydaline","Acta Crystallographica Section C","1992","48","10","1864","1866","10.1107/S0108270192001951","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000554","5.726","0.006","14.234","0.007","20.08","0.01","90","","92.54","0.07","90","","1635","2","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 O3 P -","- C18 H19 O3 P -","- C72 H76 O12 P4 -","4","1","CR0403","Hua, D. H.; Roche, D.; Bharathi, S. N.; Wu, X.; Robinson, P. D.","Structure of <i>cis</i>,<i>cis</i>-4,6-diphenyl-2-(2-propenyl)-1,3-dioxa-2-phosphorinane 2-oxide","Acta Crystallographica Section C","1992","48","10","1866","1868","10.1107/S0108270192002051","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000555","22.704","0.005","10.33","0.002","14.808","0.003","90","","105.79","0.03","90","","3341.9","1.3","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C19 H17 N3 O4 -","- C19 H17 N3 O4 -","- C152 H136 N24 O32 -","8","1","HH0582","Toscano, R. A.; Rubio, M.; Cetina, R.; Pérez-Ibarra, B. M.","Structure of a <i>p</i>-nitrobenzoyl praziquantel analogue","Acta Crystallographica Section C","1992","48","10","1868","1870","10.1107/S0108270192001902","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000556","7.9122","0.0013","27.749","0.008","13.402","0.003","90","","107.094","0.016","90","","2812.5","1.2","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H14 O3 -","- C17 H14 O3 -","- C136 H112 O24 -","8","2","CR0385","Lin, T.-Y.; Mao, Y.-L.; Chuo, C.-M.","Structure of 10-acetyloxy-10-methyl-9(10<i>H</i>)-anthracenone","Acta Crystallographica Section C","1992","48","10","1870","1872","10.1107/S010827019200204X","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000557","8.1446","0.0011","12.238","0.002","14.186","0.003","90","","90","","90","","1414","0.4","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H14 N8 O8 -","- C9 H14 N8 O8 -","- C36 H56 N32 O32 -","4","1","HH0608","Gilardi, R.; Flippen-Anderson, J. L.; George, C. F.","Structure of 8,10-diacetyl-2,4,6-trinitro-2,4,6,8,10-pentaazabicyclo[5.3.0]decane","Acta Crystallographica Section C","1992","48","10","1872","1873","10.1107/S0108270192001707","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000558","6.657","0.001","8.742","0.001","15.894","0.001","90","","101.23","0.01","90","","907.25","0.18","130","","130","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H14 N4 O2 -","- C7 H14 N4 O2 -","- C28 H56 N16 O8 -","4","1","NA0014","Meetsma, A.; van Aken, E.; Wynberg, H.","Structure of a bicyclic guanidinium nitrite salt","Acta Crystallographica Section C","1992","48","10","1874","1876","10.1107/S0108270192002282","","","0.71073","X-rayMoKalphamean","","","0.043","","","0.035","","","","","1.816","1.816","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000559","12.755","0.001","11.221","0.002","21.77","0.002","90","","94.16","0.02","90","","3107.6","0.7","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 Br2 Se -","- C16 H14 Br2 Se -","- C128 H112 Br16 Se8 -","8","2","LI0102","Zukerman-Schpector, J.; Castellano, E. E.; Comasseto, J. V.; Stefani, H. A.","Structure of 1,1-dibromo-2-phenylseleno-3-<i>p</i>-tolylcyclopropane","Acta Crystallographica Section C","1992","48","10","1876","1878","10.1107/S0108270192002427","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000560","9.463","0.002","11.251","0.003","18.871","0.006","90","","90","","90","","2009.2","0.9","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H26 N2 O5 -","- C22 H26 N2 O5 -","- C88 H104 N8 O20 -","4","1","ST0565","Lynch, V. M.; Corbett, J. W.; Martin, S. F.; Davis, B. E.","Structure of a chiral intermediate in the synthesis of (+)-19-epiajmalicine","Acta Crystallographica Section C","1992","48","10","1878","1880","10.1107/S0108270192002336","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000561","13.686","0.002","5.874","0.002","11.03","0.003","90","","96.62","0.03","90","","880.8","0.4","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C18 H26 O4 -","- C18 H26 O4 -","- C36 H52 O8 -","2","1","PA0237","Bocelli, G.; Cantoni, A.","2-Menthyl (2-hydroxyphenyl)glycolate","Acta Crystallographica Section C","1992","48","10","1880","1881","10.1107/S0108270192002324","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000562","20.604","0.005","12.694","0.005","12.647","0.005","93.64","0.05","105.69","0.05","85.89","0.05","3173","2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C63 H62 O9 S9 -","- C63 H62 O9 S9 -","- C126 H124 O18 S18 -","2","1","AL0531","Roos, H. M.; Dillen, J. L. M.","Structure of tris(5-acetyl-3-thienyl)methane-<i>n</i>-hexane (3/1) inclusion compound","Acta Crystallographica Section C","1992","48","10","1882","1884","10.1107/S0108270192002312","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000563","6.228","0.003","20.315","0.008","11.104","0.006","90","","103.87","0.05","90","","1363.9","1.2","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- C13 H22 N2 O2 -","- C16 H33 N2 O2 -","- C64 H132 N8 O8 -","4","1","HU0411","van Eijk, P. J. S. S.; Verboom, W.; Reinhoudt, D. N.; Harkema, S.","<i>N</i>,<i>N</i>-Diethyl-6-(hydroxyimino)-α-methyl-1-cyclohexene-1-acetamide","Acta Crystallographica Section C","1992","48","10","1884","1886","10.1107/S0108270192001756","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000564","13.123","0.007","11.24","0.008","9.666","0.006","90","","99.22","0.05","90","","1407.3","1.5","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H22 N2 O2 -","- C13 H22 N2 O2 -","- C52 H88 N8 O8 -","4","1","HU0413","van Eijk, P. J. S. S.; Verboom, W.; Reinhoudt, D. N.; Harkema, S.","<i>N</i>,<i>N</i>-Diethyl-2-[2-(hydroxyimino)cyclohexylidine]propanamide","Acta Crystallographica Section C","1992","48","10","1886","1887","10.1107/S0108270192001768","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000565","20.52","0.002","10.647","0.001","18.26","0.002","90","","91.015","0.008","90","","3988.8","0.7","299","","299","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","tetrakis(μ-2,2-dimethylpropanoate-O,O')di(2,5-lutidine)dinickel","","- C34 H54 N2 Ni2 O8 -","- C34 H54 N2 Ni2 O8 -","- C136 H216 N8 Ni8 O32 -","4","0.5","AS1007","Morooka, M.; Ohba, S.; Nakashima, M.; Tokii, T.; Muto, Y.; Kato, M.; Steward, O. W.","Dimeric nickel(II) carboxylates and a silanecarboxylate: [Ni(Me~3~CCOO)~2~(2,5-lutidine)]~2~, [Ni(MePh~2~CCOO)~2~(quinoline)]~2~.2CHCl~3~, [Ni(Me~2~PhCCOO)~2~(quinoline)]~2~, [Ni(Me~3~CCOO)~2~(2-ethylpyridine)]~2~, [Ni(Me~3~CCOO)~2~(2-picoline)]~2~ and [Ni(MePh~2~SiCOO)~2~(Ph~3~P)]~2~","Acta Crystallographica Section C","1992","48","10","1888","1894","10.1107/S0108270192005808","","","0.71073","MoKα","","","0.043","","","0.031","","","","","2.29","2.29","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000566","13.231","0.001","13.857","0.001","11.425","0.001","99.48","0.01","104.63","0.01","109.68","0.01","1835.3","0.3","297","","297","1","","","","","","","","6","P -1","-P 1","2","","tetrakis(μ-2,2-diphenylpropanoate-O,O')di(quinoline)dinickel bis(trichloromethane)","","- C80 H68 Cl6 N2 Ni2 O8 -","- C80 H66 Cl6 N2 Ni2 O8 -","- C80 H66 Cl6 N2 Ni2 O8 -","1","0.5","AS1007","Morooka, M.; Ohba, S.; Nakashima, M.; Tokii, T.; Muto, Y.; Kato, M.; Steward, O. W.","Dimeric nickel(II) carboxylates and a silanecarboxylate: [Ni(Me~3~CCOO)~2~(2,5-lutidine)]~2~, [Ni(MePh~2~CCOO)~2~(quinoline)]~2~.2CHCl~3~, [Ni(Me~2~PhCCOO)~2~(quinoline)]~2~, [Ni(Me~3~CCOO)~2~(2-ethylpyridine)]~2~, [Ni(Me~3~CCOO)~2~(2-picoline)]~2~ and [Ni(MePh~2~SiCOO)~2~(Ph~3~P)]~2~","Acta Crystallographica Section C","1992","48","10","1888","1894","10.1107/S0108270192005808","","","0.71073","MoKα","","","0.081","","","0.087","","","","","6.176","6.176","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000567","10.992","0.001","20.932","0.001","10.964","0.001","90","","90.587","0.005","90","","2522.5","0.3","300","","300","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetrakis(μ-2-methyl-2-phenylpropanoato-O,O')di(quinoline)dinickel","","- C58 H58 N2 Ni2 O8 -","- C58 H58 N2 Ni2 O8 -","- C116 H116 N4 Ni4 O16 -","2","0.5","AS1007","Morooka, M.; Ohba, S.; Nakashima, M.; Tokii, T.; Muto, Y.; Kato, M.; Steward, O. W.","Dimeric nickel(II) carboxylates and a silanecarboxylate: [Ni(Me~3~CCOO)~2~(2,5-lutidine)]~2~, [Ni(MePh~2~CCOO)~2~(quinoline)]~2~.2CHCl~3~, [Ni(Me~2~PhCCOO)~2~(quinoline)]~2~, [Ni(Me~3~CCOO)~2~(2-ethylpyridine)]~2~, [Ni(Me~3~CCOO)~2~(2-picoline)]~2~ and [Ni(MePh~2~SiCOO)~2~(Ph~3~P)]~2~","Acta Crystallographica Section C","1992","48","10","1888","1894","10.1107/S0108270192005808","","","0.71073","MoKα","","","0.041","","","0.026","","","","","1.726","1.726","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000568","10.616","0.001","11.059","0.001","9.826","0.001","98.22","0.01","109.03","0.01","62.52","0.01","967.47","0.19","299","","299","1","","","","","","","","5","P -1","-P 1","2","","tetrakis(μ-2,2-dimethylpropanoato-O,O')di(2-ethylpyridine)dinickel","","- C34 H54 N2 Ni2 O8 -","- C34 H54 N2 Ni2 O8 -","- C34 H54 N2 Ni2 O8 -","1","0.5","AS1007","Morooka, M.; Ohba, S.; Nakashima, M.; Tokii, T.; Muto, Y.; Kato, M.; Steward, O. W.","Dimeric nickel(II) carboxylates and a silanecarboxylate: [Ni(Me~3~CCOO)~2~(2,5-lutidine)]~2~, [Ni(MePh~2~CCOO)~2~(quinoline)]~2~.2CHCl~3~, [Ni(Me~2~PhCCOO)~2~(quinoline)]~2~, [Ni(Me~3~CCOO)~2~(2-ethylpyridine)]~2~, [Ni(Me~3~CCOO)~2~(2-picoline)]~2~ and [Ni(MePh~2~SiCOO)~2~(Ph~3~P)]~2~","Acta Crystallographica Section C","1992","48","10","1888","1894","10.1107/S0108270192005808","","","0.71073","MoKα","","","0.042","","","0.037","","","","","3.624","3.624","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000569","10.541","0.001","10.724","0.001","9.68","0.001","97.2","0.01","108.48","0.01","63.31","0.01","927.05","0.19","299","","299","1","","","","","","","","5","P -1","-P 1","2","","tetrakis(μ-2,2-dimethylpropanoato-O,O')di(2-picoline)dinickel","","- C32 H50 N2 Ni2 O8 -","- C32 H50 N2 Ni2 O8 -","- C32 H50 N2 Ni2 O8 -","1","0.5","AS1007","Morooka, M.; Ohba, S.; Nakashima, M.; Tokii, T.; Muto, Y.; Kato, M.; Steward, O. W.","Dimeric nickel(II) carboxylates and a silanecarboxylate: [Ni(Me~3~CCOO)~2~(2,5-lutidine)]~2~, [Ni(MePh~2~CCOO)~2~(quinoline)]~2~.2CHCl~3~, [Ni(Me~2~PhCCOO)~2~(quinoline)]~2~, [Ni(Me~3~CCOO)~2~(2-ethylpyridine)]~2~, [Ni(Me~3~CCOO)~2~(2-picoline)]~2~ and [Ni(MePh~2~SiCOO)~2~(Ph~3~P)]~2~","Acta Crystallographica Section C","1992","48","10","1888","1894","10.1107/S0108270192005808","","","0.71073","MoKα","","","0.039","","","0.035","","","","","3.36","3.36","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000570","14.461","0.001","23.432","0.001","13.542","0.001","90","","112.921","0.004","90","","4226.4","0.5","299","","299","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tetrakis(μ-methyldiphenylsilanecarboxylato-O,O')bis(triphenylphosphine) dinickel","","- C92 H82 Ni2 O8 P2 Si4 -","- C92 H82 Ni2 O8 P2 Si4 -","- C184 H164 Ni4 O16 P4 Si8 -","2","0.5","AS1007","Morooka, M.; Ohba, S.; Nakashima, M.; Tokii, T.; Muto, Y.; Kato, M.; Steward, O. W.","Dimeric nickel(II) carboxylates and a silanecarboxylate: [Ni(Me~3~CCOO)~2~(2,5-lutidine)]~2~, [Ni(MePh~2~CCOO)~2~(quinoline)]~2~.2CHCl~3~, [Ni(Me~2~PhCCOO)~2~(quinoline)]~2~, [Ni(Me~3~CCOO)~2~(2-ethylpyridine)]~2~, [Ni(Me~3~CCOO)~2~(2-picoline)]~2~ and [Ni(MePh~2~SiCOO)~2~(Ph~3~P)]~2~","Acta Crystallographica Section C","1992","48","10","1888","1894","10.1107/S0108270192005808","","","0.71073","MoKα","","","0.044","","","0.035","","","","","2.666","2.666","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000571","7.768","0.002","13.524","0.004","16.066","0.004","90","","91.91","0.02","90","","1686.9","0.8","293","1","293","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[2-(Fluorodimethylstannyl)ethyl]diphenylphosphineoxide","","- C16 H20 F O P Sn -","- C16 H20 F O P Sn -","- C64 H80 F4 O4 P4 Sn4 -","4","1","NA1011","Preut, H.; Godry, B.; Mitchell, T.","Structure of [2-(fluorodimethylstannyl)ethyl]diphenylphosphine oxide","Acta Crystallographica Section C","1992","48","10","1894","1896","10.1107/S0108270192007236","","","0.71073","MoKα","","","0.027","","","0.038","","","","","0.81","0.81","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000572","11.642","0.0006","9.3595","0.0005","21.0985","0.0011","90","","104.252","0.005","90","","2228.2","0.2","293","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","","","","","- C20 H52 Cl8 Cr2 N4 O12 Zn2 -","- C20 H44 Cl8 Cr2 N4 O12 Zn2 -","- C40 H88 Cl16 Cr4 N8 O24 Zn4 -","2","0.5","MU1005","Clegg, W.; Straughan, B. P.; Yusoff, A. R.","Structure of a dichromium(II) complex with bridging betaine ligands, [Cr~2~(O~2~CCH~2~NMe~3~)~4~(OH~2~)~2~][ZnCl~4~]~2~.2H~2~O","Acta Crystallographica Section C","1992","48","10","1896","1898","10.1107/S0108270192006103","","","0.71073","MoKα","","","0.0488","","","0.0601","","","","","2.06","2.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000573","11.362","0.002","9.962","0.001","22.113","0.003","90","","104.01","0.01","90","","2428.5","0.6","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C112 H96 N16 O16 -","8","1","LI1007","Yeap, G.-Y.; Fun, H.-K.; Teo, S.-B.; Teoh, S.-G.","Structure of 2-[(4-methylphenylimino)methyl]-1-nitrobenzene","Acta Crystallographica Section C","1992","48","10","1898","1900","10.1107/S0108270192005997","","","0.71069","MoKα","","","0.0526","","","0.061","","","","","1.46","1.46","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000574","6.511","0.004","7.18","0.005","14.01","0.01","80.57","0.07","78.93","0.06","81.55","0.05","629.6","0.8","295","","295","","","","","","","","","4","P -1","-P 1","2","","","","- C6 H12 N8 O9 -","- C6 H10 N8 O8 -","- C12 H20 N16 O16 -","2","1","AB1010","Simonsen, O.","Structure of an oxonium salt crystal complex","Acta Crystallographica Section C","1992","48","10","1900","1902","10.1107/S0108270192006449","","","0.71069","MoKα","","0.197362","0.082","","0.0726","0.0696","","","","2.817","3","3","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000575","10.85","0.005","8.206","0.004","10.78","0.004","90","","114.07","0.03","90","","876.3","0.7","130","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C8 H16 O4 -","- C8 H19.5 O4 -","- C32 H78 O16 -","4","1","AB1001","Olmstead, M. M.; Hobbs, J. L.; Planalp, R. P.","Structure of a polydentate alkoxide ligand, <i>cis</i>-tetrahydroxytetramethylcyclobutane","Acta Crystallographica Section C","1992","48","10","1902","1904","10.1107/S0108270192006425","","","0.71069","MoKα","","","0.041","","","0.049","","","","","1.13","1.13","","","","","has coordinates","205956","2020-10-21","18:00:00",""
"2000576","19.9686","0.0007","16.733","0.0006","11.8636","0.0004","90","","90","","90","","3964","0.2","293","","293","","","","","","","","","6","A e 2 a","A -2ab -2ab","41","","1,3-bis-[triphenylphosphonio]-propadien-bis-[trifluormethanesulfonate]","","- C41 H32 F6 O6 P2 S2 -","- C41 H32 F6 O6 P2 S2 -","- C164 H128 F24 O24 P8 S8 -","4","0.5","SH1002","Bram, A.; Burzlaff, H.; Hadawi, D.; Bestmann, H.-J.","Structure of the allene C~39~H~32~P~2~^2+^.2CF~3~O~3~S^{-^}","Acta Crystallographica Section C","1992","48","10","1904","1906","10.1107/S0108270192006127","","","0.7093","MoKα~1~","","","0.041","","","0.027","","","","","2.66","2.66","","","","","has coordinates","203891","2020-10-21","18:00:00",""
"2000577","11.157","0.002","11.873","0.004","7.703","0.001","94.54","0.02","106.08","0.02","72.84","0.02","936.8","0.4","293","1","","","","","","","","","","3","P -1","-P 1","2","","","","- C20 H28 O5 -","- C20 H28 O5 -","- C40 H56 O10 -","2","1","BR1004","Parvez, M.; Lin, M.-T.; DeShong, P.","{2<i>S</i>-[2α,3α,3aβ,6β(<i>R</i>*),7α,7aα]}-6-(3-Benzyloxy-2-propyl)-2-hydroxy-2,3,7-trimethylhexahydro-4<i>H</i>-furo[3,2-<i>c</i>]pyran-4-one, a rearrangement product of pyranone derivatives in the tirandamycin A series","Acta Crystallographica Section C","1992","48","10","1906","1908","10.1107/S0108270192005754","","","0.71069","MoKα","","","0.0628","","","0.0708","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000578","12.669","0.005","8.76","0.002","9.475","0.005","90","","107.38","0.03","90","","1003.5","0.7","293","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","1,8-dichloro-5-oxa-10-azatricyclo(5.3.1.0~3,8~)undecan-9-one","","- C9 H11 Cl2 N O2 -","- C9 H11 Cl2 N O2 -","- C36 H44 Cl8 N4 O8 -","4","0.5","AL1017","Barlow, M. G.; Pritchard, R. G.; Sibous, L.; Tipping, A. E.","1,8-Dichloro-5-oxa-10-azatricyclo[5.3.1.0^3,8^]undecan-9-one: structure of a hydrolysed Diels-Alder addition product","Acta Crystallographica Section C","1992","48","10","1908","1909","10.1107/S0108270192007340","","","0.71069","MoKα","","","0.036","","","0.044","","","","","1.95","1.95","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000579","7.6772","0.0006","6.2628","0.0005","12.4889","0.0008","90","","104.879","0.006","90","","580.34","0.08","293","","293","","","","","","","","","3","P 1 21 1","P 2yb","4","","Oxonium (R)-O-acetylmandelate","","- C10 H12 O5 -","- C10 H12 O5 -","- C20 H24 O10 -","2","1","HA1019","Ferguson, G.; Gallagher, J. F.; Fullwood, R.; Parker, D.","Oxonium (<i>R</i>)-<i>O</i>-acetylmandelate","Acta Crystallographica Section C","1992","48","10","1909","1911","10.1107/S0108270192008199","","","0.7093","MolybdenumKα","","0.053","0.039","","0.061","0.055","","","","","1.24","1.24","","","","","has coordinates","191032","2020-10-21","18:00:00",""
"2000580","7.651","0.002","21.79","0.01","6.689","0.002","90","","113.85","0.03","90","","1019.9","0.7","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- H26 N4 O20 P4 Te -","- H26 N4 O20 P4 Te -","- H52 N8 O40 P8 Te2 -","2","0.5","PA9258","Averbuch-Pouchot, M. T.; Durif, A.","Structure of an adduct between diammonium dihydrogendiphosphate and telluric acid: 2(NH~4~)~2~H~2~P~2~O~7~.Te(OH)~6~. Erratum","Acta Crystallographica Section C","1992","48","10","1912","","10.1107/S0108270192007984","","","0.5608","Ag","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000581","10.1291","0.0008","5.9038","0.0005","14.961","0.001","90","","103.64","0.008","90","","869.44","0.12","","","","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","","- H K3 O8 Se2 -","- H K3 O8 Se2 -","- H4 K12 O32 Se8 -","4","0.5","AB0265","Ichikawa, M.; Sato, S.; Komukae, M.; Osaka, T.","Structure of ferroelastic K~3~H(SeO~4~)~2~","Acta Crystallographica Section C","1992","48","9","1569","1571","10.1107/S0108270192001379","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205833","2020-10-21","18:00:00",""
"2000582","5.5448","0.0003","5.8829","0.0003","7.7434","0.0004","90","","90","","90","","252.59","0.02","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- H I O3 -","- H I O3 -","- H4 I4 O12 -","4","1","AB0266","Ståhl, K.; Szafranski, M.","A neutron powder diffraction study of HIO~3~ and DIO~3~","Acta Crystallographica Section C","1992","48","9","1571","1574","10.1107/S0108270192001094","","neutron","1.47","Neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000583","5.5408","0.0004","5.8745","0.0004","7.7356","0.0005","90","","90","","90","","251.79","0.03","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- D I O3 -","- D I O3 -","- D4 I4 O12 -","4","1","AB0266","Ståhl, K.; Szafranski, M.","A neutron powder diffraction study of HIO~3~ and DIO~3~","Acta Crystallographica Section C","1992","48","9","1571","1574","10.1107/S0108270192001094","","neutron","1.47","Neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000584","10.0422","0.0005","14.1044","0.0007","6.3273","0.0006","100.369","0.005","98.655","0.006","81.354","0.004","864.49","0.1","","","","","","","","","","","","6","P -1","-P 1","2","","","","- Cl H25 N5 O12 Ru S2 -","- Cl H23 N5 O12 Ru S2 -","- Cl2 H46 N10 O24 Ru2 S4 -","2","1","GR0193","John, E.; Schugar, H. J.; Potenza, J. A.","Structure of pentaamminechlororuthenium(III) bisulfate tetrahydrate","Acta Crystallographica Section C","1992","48","9","1574","1576","10.1107/S010827019200146X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000585","4.413","0.002","14.585","0.009","6.7","0.004","90","","104.3","0.04","90","","417.9","0.4","","","","","","","","","","","","4","P 1 21/m 1","","","","","","- B5 Ba2 Li O10 -","- B5 Ba2 Li O10 -","- B10 Ba4 Li2 O20 -","2","0.5","LI0114","Huang, Q.; Lu, S.; Dai, G.; Liang, J.","A new type of borate double salt: structure of LiBa~2~B~5~O~10~","Acta Crystallographica Section C","1992","48","9","1576","1578","10.1107/S0108270191013549","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000586","6.954","0.001","17.196","0.003","15.333","0.002","90","","99.53","0.01","90","","1808.2","0.5","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 Fe2 N4 O8 -","- C40 H32 Fe2 N4 O8 -","- C80 H64 Fe4 N8 O16 -","2","0.5","AL0515","Dušek, M.; Petříček, V.; Kameníček, J.; Šindelář, Z.","Structure of μ-(tetraphthalato)-bis[<i>N</i>,<i>N</i>'-ethylenebis(salicylaldiminato)iron(III)]","Acta Crystallographica Section C","1992","48","9","1579","1582","10.1107/S0108270192000982","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000587","9.536","0.004","11.221","0.002","11.613","0.001","62.55","0.01","65.81","0.02","73.05","0.02","997.8","0.5","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C36 Cl2 F30 P2 Pt -","- C36 Cl2 F30 P2 Pt -","- C36 Cl2 F30 P2 Pt -","1","0.5","HH0588","Schaefer, W. P.; Lyon, D. K.; Labinger, J. A.; Bercaw, J. E.","A platinum chloro (fluoroaryl)phosphine complex","Acta Crystallographica Section C","1992","48","9","1582","1584","10.1107/S0108270192001008","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000588","12.683","0.004","10.374","0.002","19.229","0.004","90","","111.92","0.02","90","","2347.1","1","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H30 Cu N7 O8 -","- C16 H30 Cu N7 O8 -","- C64 H120 Cu4 N28 O32 -","4","1","LI0124","Driessen, W. L.; Haanstra, W. G.; Reedijk, J.","Structure of the dinuclear copper(II) compound of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis[2-(3,5-dimethyl-1-pyrazolyl)ethyl]-1,2-ethylenediamine (tped), [Cu~2~(tped)(H~2~O)~2~(NO~3~)~2~](NO~3~)~2~.2CH~3~OH","Acta Crystallographica Section C","1992","48","9","1585","1587","10.1107/S0108270192001082","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000589","14.76","0.001","12.486","0.001","8.5623","0.0007","90","","101.78","0.004","90","","1544.7","0.2","","","","","","","","","","","","5","C 1 2/c 1","","","","","","- C15 H15 Ga N2 O4 -","- C15 H18 Ga N2 O4 -","- C60 H72 Ga4 N8 O16 -","4","0.5","HH0599","Rettig, S. J.; Storr, A.; Trotter, J.","Structure of methylbis(salicylaldoximato-<i>O</i>^1^,<i>N</i>)gallium(III)","Acta Crystallographica Section C","1992","48","9","1587","1590","10.1107/S0108270192001318","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000590","7.214","0.002","19.554","0.004","10.877","0.004","90","","103.82","0.03","90","","1489.9","0.8","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H20 Cl4 Cu2 O10 -","- C28 H20 Cl4 Cu2 O10 -","- C56 H40 Cl8 Cu4 O20 -","2","0.5","AS0583","Kawata, T.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.","Structures of aqua and pyridine adducts of dimeric copper(II) 2-chlorobenzoate","Acta Crystallographica Section C","1992","48","9","1590","1594","10.1107/S010827019200129X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206335","2020-10-21","18:00:00",""
"2000591","23.365","0.003","10.688","0.001","20.542","0.002","90","","100.03","0.01","90","","5051.5","1","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C40 H26 Cl12 Cu2 N2 O8 -","- C40 H26 Cl12 Cu2 N2 O8 -","- C160 H104 Cl48 Cu8 N8 O32 -","4","1","AS0583","Kawata, T.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.","Structures of aqua and pyridine adducts of dimeric copper(II) 2-chlorobenzoate","Acta Crystallographica Section C","1992","48","9","1590","1594","10.1107/S010827019200129X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206336","2020-10-21","18:00:00",""
"2000592","7.844","0.002","10.244","0.019","26.55","0.005","90","","90","","90","","2133","4","","","","","","","","","","","","5","P 21 c a","P -2ac 2a","29","","","","- C17 H23 Cl2 Fe O6 -","- C17 H23 Cl2 Fe O6 -","- C68 H92 Cl8 Fe4 O24 -","4","1","BR0016","Pang, L.; Hynes, R. C.; Whitehead, M. A.","Structure of the clathrate compound tris(2,4-pentanedionato)iron(III)-<i>trans</i>-1,2-dichloroethene (1/1)","Acta Crystallographica Section C","1992","48","9","1594","1597","10.1107/S0108270192001331","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","205966","2020-10-21","18:00:00",""
"2000593","7.692","0.002","11.351","0.002","16.89","0.003","90","","97.98","0.02","90","","1460.4","0.5","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H18 Au Cl N4 O -","- C10 H16 Au Cl2 N4 O2 -","- C40 H64 Au4 Cl8 N16 O8 -","4","1","BR0015","Britten, J. F.; Lock, C. J. L.; Wang, Z.","Bis(4,5-dimethylimidazol-2-ylidene)gold(I) chloride hydrate: an unexpected product from the reaction of tris(4,5-dimethylimidazol-2-yl)phosphine and tetrachloroauric acid","Acta Crystallographica Section C","1992","48","9","1600","1603","10.1107/S0108270192001513","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000594","9.106","0.003","14.803","0.003","15.147","0.003","112.95","0.02","103.68","0.02","95.1","0.02","1789","0.9","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C14 H32 Co O9 P3 Pt -","- C14 H32 Co O9 P3 Pt -","- C42 H96 Co3 O27 P9 Pt3 -","3","1.5","HH0605","Marsh, R. E.; Schaefer, W. P.; Lyon, D. K.; Labinger, J. A.; Bercaw, J. E.","Structure of trimethylplatinum(IV) with a tripod ligand","Acta Crystallographica Section C","1992","48","9","1603","1606","10.1107/S010827019200163X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208360","2020-10-21","18:00:00",""
"2000595","14.23","0.004","19.283","0.004","14.628","0.004","90","","90","","90","","4013.9","1.8","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","","","","","- C18 H26 F3 O3 S Ta -","- C18 H26 F3 O3 S Ta -","- C144 H208 F24 O24 S8 Ta8 -","8","1","HH0590","Schaefer, W. P.; Quan, R. W.; Bercaw, J. E.","Cp,Cp*-dimethyltantalum triflate","Acta Crystallographica Section C","1992","48","9","1610","1612","10.1107/S0108270192001628","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","190975","2020-10-21","18:00:00",""
"2000596","16.428","0.004","12.721","0.003","12.526","0.006","90","","114.53","0.03","90","","2381.4","1.5","","","","","","","","","","","","7","C 1 2/m 1","-C 2y","","","","","- C28 H40 Cl Cu2 F18 N8 P3 -","- C28 H40 Cl Cu2 F18 N8 P3 -","- C56 H80 Cl2 Cu4 F36 N16 P6 -","2","0.25","PA0275","Alilou, E. H.; Giorgi, M.; Pierrot, M.; Reglier, M.","Structure of μ-chloro-bis{bis[2-(2-pyridyl)ethylamine-<i>N</i>,<i>N</i>']copper(II)} trishexafluorophosphate","Acta Crystallographica Section C","1992","48","9","1612","1614","10.1107/S0108270192001549","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000597","10.21","0.01","13.99","0.01","5.91","0.01","90","","90","","90","","844.2","1.8","","","","","","","","","","","","5","P m m n","","","","","","- C15 H25 F3 N2 O2 -","- C30 H50 F16 N4 O4 -","- C60 H100 F32 N8 O8 -","2","","HU0404","Patel, D.; Brown, D. S.; Traynor, J. R.","3,3,6,9,9-Pentamethyl-2,10-diazabicyclo[4.4.0]dec-1-ene hydrogen trifluoroacetate","Acta Crystallographica Section C","1992","48","9","1614","1616","10.1107/S0108270192001732","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000598","21.335","0.002","8.516","0.001","9.273","0.001","90","","93.645","0.001","90","","1681.4","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 N2 O5 -","- C17 H18 N2 O5 -","- C68 H72 N8 O20 -","4","1","CR0357","Kokila, M. K.; Nirmala, K. A.; Puttaraja; Kulkarni, M. V.; Shivaprakash, N. C.","Structure of ethyl 2-(2-amino-3-ethoxycarbonyl-4<i>H</i>-chromen-4-yl)-2-cyanoacetate","Acta Crystallographica Section C","1992","48","9","1619","1622","10.1107/S0108270192000209","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000599","11.453","0.003","7.163","0.004","11.929","0.002","90","","111.86","0.02","90","","908.3","0.6","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","(4S)-4-Benzyl-3-[(4S,5S)-(1-methoxy-5-methylcyclohexen-4-yl)carbonyl]-2-oxazolidinone","","- C19 H23 N O4 -","- C19 H23 N O4 -","- C38 H46 N2 O8 -","2","1","HH0568","Marsh, R. E.; Schaefer, W. P.; Kukkola, P. J.; Myers, A. G.","A chiral <i>N</i>-crontonyloxazolidinone Diels-Alder adduct","Acta Crystallographica Section C","1992","48","9","1622","1624","10.1107/S0108270192000738","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206336","2020-10-21","18:00:00",""
"2000600","14.686","0.005","7.59","0.002","23.578","0.006","90","","107.47","0.01","90","","2506.9","1.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H33 Cl2 N3 O3 -","- C23 H33 Cl2 N3 O3 -","- C92 H132 Cl8 N12 O12 -","4","1","CR0394","Mehdi, S.; Ravikumar, K.","Crystal structure of a calcium channel antagonist: 4-(2,4-dichlorophenyl)-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetraethyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide","Acta Crystallographica Section C","1992","48","9","1627","1630","10.1107/S0108270192001446","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000601","9.304","0.002","10.987","0.002","11.833","0.002","90","","109.65","0.01","90","","1139.2","0.4","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H34 Cl N O3 -","- C25 H34 Cl N O3 -","- C50 H68 Cl2 N2 O6 -","2","1","AL0525","Woudenberg, R. H.; Lie, T. S.; van Koningsveld, H.; Maat, L.","Structure of 5β,10α,10β-triethylthebaine hydrochloride","Acta Crystallographica Section C","1992","48","9","1630","1633","10.1107/S0108270192000994","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206330","2020-10-21","18:00:00",""
"2000602","10.946","0.004","5.817","0.002","10.551","0.004","90","","94.15","0.03","90","","670.1","0.4","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","acenaphtho[1,2-a]acenaphthylene","","- C22 H12 -","- C22 H12 -","- C44 H24 -","2","0.5","HA0107","Jones, P. G.; Bubenitschek, P.; Sheldrick, G. M.; Dyker, G.","Acenaphtho[1,2-<i>a</i>]acenaphthylene at 178 K","Acta Crystallographica Section C","1992","48","9","1633","1635","10.1107/S0108270192001458","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206334","2020-10-21","18:00:00",""
"2000603","10.482","0.003","8.084","0.001","18.081","0.004","90","","92.59","0.02","90","","1530.6","0.6","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 O4 -","- C20 H16 O4 -","- C80 H64 O16 -","4","1","ST0570","Valente, E. J.; Ruggiero, G.; Eggleston, D. S.","Structure of racemic (±)-6,8-dimethyl-6,12-methano-6<i>H</i>,12<i>H</i>,13<i>H</i>-[1]benzopyran[4,3-<i>d</i>][1,3]benzodioxocin-13-one","Acta Crystallographica Section C","1992","48","9","1635","1637","10.1107/S0108270192001471","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000604","18.055","0.003","15.048","0.003","17.173","0.003","90","","91.7","0.1","90","","4663.7","1.5","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- C20 H35 N3 O6 -","- C20.5 H34 N3 O6 -","- C164 H272 N24 O48 -","8","2","GE0294","Bardi, R.; Piazzesi, A. M.; Crisma, M.; Toniolo, C.; Sukumar, M.; Balaram, P.","Structure of <i>N</i>-<i>tert</i>-butyloxycarbonyl-α-aminoisobutyryl-<small>DL</small>-pipecolyl-α-aminoisobutyric acid methyl ester","Acta Crystallographica Section C","1992","48","9","1645","1648","10.1107/S0108270192001070","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000605","8.568","0.003","8.568","0.003","6.531","0.005","90","","90","","90","","479.4","0.4","","","","","","","","","","","","4","P 4/n :2","-P 4a","85","","","","- Cl4 F6 P Sb -","- Cl4 F6 P Sb -","- Cl8 F12 P2 Sb2 -","2","0.25","BX0585","Preut, H.; Lennhoff, D.; Minkwitz, R.","Structure of tetrachlorophosphonium hexafluoroantimonate","Acta Crystallographica Section C","1992","48","9","1648","1650","10.1107/S0108270192001173","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206022","2020-10-21","18:00:00",""
"2000606","8.311","0.004","7.363","0.004","4.902","0.003","99.67","0.02","81.77","0.02","114.48","0.01","268.2","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- Al H3 Na2 O14 P4 -","- Al Na2 O14 P4 -","- Al Na2 O14 P4 -","1","0.5","MU0258","Galí, S.; Cárdenas, A.; Byrappa, K.; Gopalakrishna, G. S.","Structure of aluminium disodium trihydrogenbis(diphosphate)","Acta Crystallographica Section C","1992","48","9","1650","1652","10.1107/S0108270192000611","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000607","10.41","0.01","10.63","0.02","13.63","0.02","81.8","0.1","76.6","0.1","69.8","0.1","1374","4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H45 N5 Ni S2 -","- C23 H45 N5 Ni S2 -","- C46 H90 N10 Ni2 S4 -","2","1","MU0254","Koman, M.; Jóna, E.; Ďurčanská, E.","Structural investigations of nickel(II) complexes. X. Tris(3,5-dimethylpiperidine)bis(isothiocyanato)nickel(II), [Ni(NCS)~2~(3,5-diMepip)~3~]","Acta Crystallographica Section C","1992","48","9","1652","1654","10.1107/S0108270192000635","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000608","26.499","0.013","9.037","0.006","17.419","0.007","90","","107.33","0.03","90","","3982","4","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H42 Ni2 P2 S4 -","- C42 H42 Ni2 P2 S4 -","- C168 H168 Ni8 P8 S16 -","4","0.5","AS0501","Cao, R.; Huang, Z.; Lei, X.; Kang, B.; Hong, M.; Liu, H.","Structure of a dinuclear nickel compound, Ni~2~(PPh~3~)~2~(SC~3~H~6~S)~2~","Acta Crystallographica Section C","1992","48","9","1654","1655","10.1107/S0108270192000647","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206336","2020-10-21","18:00:00",""
"2000609","16.149","0.001","7.205","0.005","15.358","0.005","90","","115.09","0.05","90","","1618.3","1.4","","","","","","","","","","","","5","A 1 2/a 1","-A 2ya","15","","","","- C12 H22 Cu I N4 -","- C12 H22 Cu I N4 -","- C48 H88 Cu4 I4 N16 -","4","0.5","HH0580","Bao, X.; Holt, E. M.","Structure of the condensation product formed by pyrrolidine, acetonitrile and copper(I) iodide","Acta Crystallographica Section C","1992","48","9","1655","1657","10.1107/S0108270192000684","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206034","2020-10-21","18:00:00",""
"2000610","9.7484","0.0007","10.3086","0.0006","19.2656","0.0008","90","","90","","90","","1936","0.2","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H19 N O3 Sn -","- C21 H19 N O3 Sn -","- C84 H76 N4 O12 Sn4 -","4","1","AS0552","Lo, K. M.; Ng, S. W.; Wei, C.; Kumar Das, V. G.","Structure of triphenyltin glyoxalate <i>O</i>-methyloxime","Acta Crystallographica Section C","1992","48","9","1657","1658","10.1107/S0108270192000945","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000611","14.5752","0.0017","9.7304","0.0008","15.163","0.005","90","","97.454","0.015","90","","2132.3","0.8","","","","","","","","","","","","7","P 1 21/c 1","","","","","","- C13 H30 Cl3 Ir O2 P2 S -","- C15 H35 Cl3 Ir O2 P2 S -","- C60 H140 Cl12 Ir4 O8 P8 S4 -","4","1","HA0103","Blake, A. J.; Cockman, R. W.; Ebsworth, E. A. V.","Structure of [IrCl~2~(CO)(PEt~3~)~2~(SOCl)]","Acta Crystallographica Section C","1992","48","9","1658","1660","10.1107/S0108270192001240","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000612","21.077","0.005","13.296","0.003","11.525","0.002","90","","112.24","0.02","90","","2989.5","1.2","","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","","","","","- C15 H35 B2 F8 N5 O7 U -","- C16 H36 B2 F8 N5 O7 U -","- C64 H144 B8 F32 N20 O28 U4 -","4","0.5","DU0327","Deshayes, L.; Keller, N.; Lance, M.; Nierlich, M.; Vigner, D.","Structure of pentakis(<i>N</i>,<i>N</i>-dimethylformamide)dioxouranium(VI) tetrafluoroborate","Acta Crystallographica Section C","1992","48","9","1660","1661","10.1107/S0108270192001689","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","189213","2020-10-21","18:00:00",""
"2000613","9.188","0.002","19.307","0.003","15.545","0.003","90","","102.98","0.01","90","","2687.1","0.9","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H32 P2 Ru -","- C32 H32 P2 Ru -","- C128 H128 P8 Ru4 -","4","1","LI0120","Litster, S. A.; Redhouse, A. D.; Simpson, S. J.","Structure of [1,3-bis(diphenylphosphino)propane](η^5^-cyclopentadienyl)hydridoruthenium(II)","Acta Crystallographica Section C","1992","48","9","1661","1663","10.1107/S010827019200132X","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000614","7.398","0.001","11.439","0.002","10.727","0.002","90","","106.42","0.01","90","","870.8","0.3","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H28 Cl N2 Rh -","- C17 H28 Cl N2 Rh -","- C34 H56 Cl2 N4 Rh2 -","2","1","SE0084","Flörke, U.; Ortmann, U.; Haupt, H.-J.","Rhodium(I)-cyclooctadiene (cod) complexes with the <i>N</i>-donor ligands 1,8-diazabicyclo[5.4.0]undec-7-ene (dbu) and 1,5-diazabicyclo[4.3.0]non-5-ene (dbn)","Acta Crystallographica Section C","1992","48","9","1663","1665","10.1107/S0108270191015111","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000615","7.231","0.001","15.87","0.003","15.918","0.003","90","","100.4","0.01","90","","1796.7","0.5","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C17 H28 Cl N2 O Rh -","- C18 H26 Cl N2 O Rh -","- C72 H104 Cl4 N8 O4 Rh4 -","4","1","SE0084","Flörke, U.; Ortmann, U.; Haupt, H.-J.","Rhodium(I)-cyclooctadiene (cod) complexes with the <i>N</i>-donor ligands 1,8-diazabicyclo[5.4.0]undec-7-ene (dbu) and 1,5-diazabicyclo[4.3.0]non-5-ene (dbn)","Acta Crystallographica Section C","1992","48","9","1663","1665","10.1107/S0108270191015111","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000616","9.272","0.002","13.031","0.003","15.24","0.003","80.04","0.03","79.15","0.03","73.46","0.03","1719.6","0.7","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H40 Cl6 O7 U2 -","- C20 H40 Cl6 O7 U2 -","- C40 H80 Cl12 O14 U4 -","2","1","HH0562","Noltemeyer, M.; Gilje, J. W.; Roesky, H. W.","Structure of chlorodioxotetrakis(tetrahydrofuran)uranium(VI) pentachloro(tetrahydrofuran)uranate(IV)","Acta Crystallographica Section C","1992","48","9","1665","1666","10.1107/S0108270192001896","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000617","13.2099","0.0009","12.1272","0.0012","21.847","0.002","90","","107.4","0.006","90","","3339.7","0.5","","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C13 H32 Co F12 N4 Na O16 S4 -","- C13 H32 Co F12 N4 Na O16 S4 -","- C52 H128 Co4 F48 N16 Na4 O64 S16 -","4","1","ST0558","Rawji, G. H.; Lynch, V. M.","Structure of diaqua[tris(3-aminopropyl)amine]cobalt(III) aquatetrakis(trifluoromethanesulfonato)sodate(I) monohydrate","Acta Crystallographica Section C","1992","48","9","1667","1669","10.1107/S0108270192001574","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000618","12.8896","0.0005","12.8896","0.0005","19.1855","0.0007","90","","90","","120","","2760.47","0.18","","","","","","","","","","","","4","R -3 :H","-R 3","148","","tris(phenylseleno)phosphine","","- C18 H15 P Se3 -","- C18 H15 P Se3 -","- C108 H90 P6 Se18 -","6","0.333333","HH0566","Keder, N. L.; Shibao, R. K.; Eckert, H.","Structure of tris(phenylseleno)phosphine","Acta Crystallographica Section C","1992","48","9","1670","1671","10.1107/S010827019101497X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206336","2020-10-21","18:00:00",""
"2000619","7.322","0.001","10.029","0.001","7.155","0.001","89.96","0.01","99.72","0.01","95.14","0.01","515.73","0.11","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C9 H12 N4 O3 -","- C9 H12 N4 O3 -","- C18 H24 N8 O6 -","2","1","PA0265","Gimeno, B.; Soto, L.; Sancho, A.; Dahan, F.; Legros, J.-P.","Structure of 3,3-bis(2-imidazolyl)propionic acid monohydrate","Acta Crystallographica Section C","1992","48","9","1671","1673","10.1107/S0108270191015068","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000620","12.62","0.003","15.719","0.005","9.945","0.002","90","","90.14","0.02","90","","1972.8","0.9","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C8 H24 Cl6 N2 Te -","- C8 H24 Cl6 N2 Te -","- C32 H96 Cl24 N8 Te4 -","4","1","AS0574","Ishida, H.; Kashino, S.","Structure of <i>tert</i>-butylammonium hexachlorotellurate(IV)","Acta Crystallographica Section C","1992","48","9","1673","1675","10.1107/S0108270191015147","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","199682","2020-10-21","18:00:00",""
"2000621","9.182","0.011","9.774","0.009","11.784","0.01","107.27","0.07","100.16","0.08","98.05","0.09","973","1.8","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H58 Ge2 N6 Si2 -","- C32 H58 Ge2 N6 Si2 -","- C32 H58 Ge2 N6 Si2 -","1","0.5","KA0016","Preut, H.; Klein, B.; Neumann, W. P.","1,3,7,9-Tetra-<i>tert</i>-butyl-2,2,8,8-tetramethyl-5,10-diphenyl-1,3,5,7,9,10-hexaaza-2,8-disila-4,6-digermadispiro[3.1.3.1]decane","Acta Crystallographica Section C","1992","48","9","1675","1677","10.1107/S0108270192000453","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000622","9.762","0.004","10.689","0.005","8.387","0.003","96.97","0.04","102.26","0.03","76.74","0.04","830","0.6","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H11 Cl N2 O4 S -","- C17 H11 Cl N2 O4 S -","- C34 H22 Cl2 N4 O8 S2 -","2","1","ST0564","Muir, J. A.; Cox, O.; Bernard, L. A.; Muir, M. M.","Structure of a twisted styrylbenzothiazole, 2-(α-acetoxy-2-chloro-5-nitrostyryl)benzothiazole","Acta Crystallographica Section C","1992","48","9","1677","1679","10.1107/S010827019200043X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000623","10.646","0.001","10.646","0.001","5.752","0.002","90","","90","","90","","651.9","0.2","","","","","","","","","","","","4","P 41","P 41","","","","","- C3 H5 N3 O5 -","- C3 H5 N3 O5 -","- C12 H20 N12 O20 -","4","1","HH0586","Gilardi, R.; George, C.; Flippen-Anderson, J. L.","Structure of 3-nitrato-1-nitroazetidine","Acta Crystallographica Section C","1992","48","9","1679","1680","10.1107/S0108270192000696","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000624","6.301","0.001","7.858","0.001","8.736","0.001","85.88","0.01","84.62","0.01","85.13","0.01","428.2","0.1","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C4 H4 N4 O8 -","- C4 H4 N4 O8 -","- C8 H8 N8 O16 -","2","1","HH0587","Gilardi, R.; George, C.; Flippen-Anderson, J. L.","Structure of 1,1,3,3-tetranitrocyclobutane","Acta Crystallographica Section C","1992","48","9","1680","1681","10.1107/S0108270192000702","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000625","8.67","0.001","17.149","0.001","9.224","0.001","90","","95.88","0.01","90","","1364.2","0.2","","","","","","","","","","","","4","P 1 21 1","","","","","","- C20 H36 O5 S5 -","- C20 H36 O5 S5 -","- C40 H72 O10 S10 -","2","1","GE0300","Divjaković, V.; Miljković, D.; Lajšić, S.; Klement, U.","Structure of 4,5-di-<i>O</i>-acetyl-6-<i>S</i>-acetyl-2,3-di-<i>S</i>-ethyl-2,3,6-trithio-<small>D</small>-allose diethyl dithioacetal","Acta Crystallographica Section C","1992","48","9","1685","1686","10.1107/S0108270192000775","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000626","16.8","0.002","20.071","0.002","9.429","0.001","90","","90","","90","","3179.4","0.6","","","","","","","","","","","","3","P b c a","","","","","","- C18 H20 O5 -","- C18 H20 O5 -","- C144 H160 O40 -","8","1","BR0013","Sicheri, F. V.; Derry, W. B.; Gupta, R. S.; Yang, D. S.-C.","Structure of 5-(2-hydroxyethoxy)-6-[1-(4-methoxyphenyl)ethyl]-1,3-benzodioxole","Acta Crystallographica Section C","1992","48","9","1687","1689","10.1107/S0108270192001197","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000627","7.598","0.003","25.635","0.002","5.774","0.003","90","","90","","90","","1124.6","0.7","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H14 O S2 -","- C11 H14 O S2 -","- C44 H56 O4 S8 -","4","1","LI0121","Barkley, J.; Harding, M. M.; Kariuki, B. M.; Namwindwa, E. S.; Page, P. C. B.","<i>syn</i>-2-Benzyl-1,3-dithiane 1-oxide","Acta Crystallographica Section C","1992","48","9","1689","1690","10.1107/S0108270192000878","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000628","8.633","0.001","9.966","0.002","13.317","0.004","92.01","0.02","102.9","0.02","106.25","0.01","1066.4","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H20 N O4 P -","- C24 H20 N O4 P -","- C48 H40 N2 O8 P2 -","2","1","CD0076","Fuquen, R. M.; Lechat, J. R.","Structure of the 1:1 complex formed by triphenylphosphine oxide and 4-nitrophenol","Acta Crystallographica Section C","1992","48","9","1690","1692","10.1107/S0108270192001227","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000629","7.6209","0.0002","9.1292","0.0003","9.6135","0.0005","90","","90","","90","","668.84","0.04","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C6 H10 O4 -","- C6 H10 O4 -","- C24 H40 O16 -","4","1","HH0600","Garcia, J. G.; Voll, R. J.; Fronczek, F. R.; Younathan, E. S.","Structure of 2,5:3,4-dianhydro-<small>D</small>-altritol","Acta Crystallographica Section C","1992","48","9","1692","1694","10.1107/S0108270192001057","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000630","3.8036","0.0007","7.643","0.001","22.818","0.005","90","","91.36","","90","","663.2","0.2","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H5 N O2 -","- C8 H5 N O2 -","- C32 H20 N4 O8 -","4","1","AS0549","Ng, S. W.","Structure of 1<i>H</i>-isoindole-1,3(2<i>H</i>)-dione (phthalimide)","Acta Crystallographica Section C","1992","48","9","1694","1695","10.1107/S0108270192000957","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000631","9.496","0.001","12.508","0.002","23.317","0.004","90","","90","","90","","2769.5","0.7","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H44 O7 Si -","- C24 H44 O7 Si -","- C96 H176 O28 Si4 -","4","1","ST0553","Abboud, K. A.; Enholm, E. J.; Trivellas, A.","Structure of a densely oxygenated carbocycle","Acta Crystallographica Section C","1992","48","9","1695","1698","10.1107/S0108270192001033","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208466","2020-10-21","18:00:00",""
"2000632","8.075","0.002","10.086","0.003","7.465","0.002","92.17","0.03","93.91","0.03","96.58","0.02","601.9","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C9 H14 Cl N O6 -","- C9 H14 Cl N O6 -","- C18 H28 Cl2 N2 O12 -","2","1","AS0581","Okabe, N.; Mori, S.","Structure of 3-methoxytyramine perchlorate","Acta Crystallographica Section C","1992","48","9","1698","1699","10.1107/S0108270192001367","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","200475","2020-10-21","18:00:00",""
"2000633","29.512","0.005","9.142","0.001","10.872","0.002","90","","92.46","0.01","90","","2930.5","0.8","","","","","","","","","","","","4","C 1 2/c 1","","","","","","- C12 H20 N6 O7 -","- C10.5 H17 N6 O6.5 -","- C84 H136 N48 O52 -","8","1","HH0607","George, C.; Gilardi, R.; Flippen-Anderson, J. L.","Structure of an acetone solvate of 7,9-diacetyl-2,5-dinitro-2,5,7,9-tetraazabicyclo[4.3.0]nonane","Acta Crystallographica Section C","1992","48","9","1699","1701","10.1107/S0108270192000933","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000634","8.1261","0.0011","14.4215","0.0009","7.6839","0.0006","90","","103.173","0.009","90","","876.79","0.15","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H9 Cl O2 -","- C9 H9 Cl O2 -","- C36 H36 Cl4 O8 -","4","1","ST0566","Evans, K. L.; Fronczek, F. R.; Gandour, R. D.","2-Chloro-2'-methoxyacetophenone and 2-chloro-4'-methoxyacetophenone","Acta Crystallographica Section C","1992","48","9","1701","1703","10.1107/S0108270192001586","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000635","7.6079","0.0007","12.296","0.002","9.924","0.0013","90","","111.097","0.009","90","","866.1","0.2","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H9 Cl O2 -","- C9 H9 Cl O2 -","- C36 H36 Cl4 O8 -","4","1","ST0566","Evans, K. L.; Fronczek, F. R.; Gandour, R. D.","2-Chloro-2'-methoxyacetophenone and 2-chloro-4'-methoxyacetophenone","Acta Crystallographica Section C","1992","48","9","1701","1703","10.1107/S0108270192001586","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000636","9.441","0.004","10.378","0.004","20.023","0.009","90","","91.56","0.03","90","","1961.1","1.4","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H29 I N2 -","- C20 H29 I N2 -","- C80 H116 I4 N8 -","4","1","ST0569","Lynch, V. M.; Liao, Y.; Martin, S. F.; Davis, B. E.","Structure of a tricyclic subunit of manzamine A","Acta Crystallographica Section C","1992","48","9","1703","1705","10.1107/S0108270192001045","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000637","10.4097","0.0007","22.186","0.002","12.742","0.001","90","","101.51","0.01","90","","2883.6","0.4","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H29 F6 N8 O4 P -","- C22 H29 F6 N8 O4 P -","- C88 H116 F24 N32 O16 P4 -","4","1","PA0273","Soto, L.; Garcia-Lozano, J.; Martinez, M.; Dahan, F.; Legros, J.-P.","Structure of mepirizole.H(mepirizole) hexafluorophosphate","Acta Crystallographica Section C","1992","48","9","1705","1707","10.1107/S0108270192001380","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000638","7.4783","0.0015","10.81","0.003","10.731","0.003","90","","90","","90","","867.5","0.4","150","0.1","","","","","","","","","","4","C m c m","-C 2c 2","","","","","- C5 I Mn O5 -","- C5 I Mn O5 -","- C20 I4 Mn4 O20 -","4","0.25","HA1007","Blake, A. J.; Johnson, B. F. G.; Sieker, A.","Pentacarbonyliodomanganese(I)","Acta Crystallographica Section C","1992","48","9","1708","1709","10.1107/S0108270192005559","","","0.71073","MoKα","","","0.0117","","","0.0163","","","","","0.68","0.68","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000639","6.462","0.001","6.278","0.001","18.72","0.003","90","","95.89","0.01","90","","755.4","0.2","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis-(pentacarbonylmanganese)-mercury","","- C10 Hg Mn2 O10 -","- C10 Hg Mn2 O10 -","- C20 Hg2 Mn4 O20 -","2","0.5","NA1007","Flörke, U.; Haupt, H.-J.","A new modification of Hg[Mn(CO)~5~]~2~","Acta Crystallographica Section C","1992","48","9","1709","1710","10.1107/S010827019200581X","","","0.71073","MolybdenumKα","","","0.027","","","0.029","","","","","1.543","1.543","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000640","11.476","0.001","13.177","0.001","9.267","0.001","106.19","0.01","96.38","0.01","96","0.01","1323.9","0.2","299","","299","1","","","","","","","","4","P -1","-P 1","2","","trans-1,3-bis(diphenylphosphinoyl)cyclohexane","","- C30 H30 O2 P2 -","- C30 H30 O2 P2 -","- C60 H60 O4 P4 -","2","1","AS1010","Morooka, M.; Hashimoto, T.; Maeta, H.; Matsumoto, T.; Suzuki, K.; Ohba, S.","<i>trans</i>-1,3-Bis(diphenylphosphinoyl)cyclohexane","Acta Crystallographica Section C","1992","48","9","1710","1712","10.1107/S010827019200605X","","","0.71073","MoKα","","","0.046","","","0.037","","","","","2.787","2.787","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000641","5.236","0.001","10.246","0.002","10.884","0.002","89.368","0.004","76.092","0.003","86.412","0.004","565.67","0.19","293","","","","","","","","","","","3","P -1","-P 1","2","","","","- C15 H10 O3 -","- C15 H10 O3 -","- C30 H20 O6 -","2","1","LI1005","Seetharaman, J.; Rajan, S. S.","Structure of 6-hydroxyflavone","Acta Crystallographica Section C","1992","48","9","1714","1715","10.1107/S0108270192005456","","","1.5418","CuKα","","","0.057","","","0.056","","","","","0.783","0.783","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000642","6.532","0.004","7.387","0.006","8.743","0.007","70.23","0.06","83.25","0.06","66.32","0.05","363.5","0.5","293","1","293","1","","","","","","","","3","P -1","-P 1","2","","1,4-Dibenzoylbenzene","","- C20 H14 O2 -","- C20 H14 O2 -","- C20 H14 O2 -","1","0.5","AL1018","Kolev, T.; Preut, H.; Bleckmann, P.; Juchnovski, I.","1,4-Dibenzoylbenzene","Acta Crystallographica Section C","1992","48","9","1715","1717","10.1107/S0108270192006887","","","0.71073","MoKα","","","0.039","","","0.062","","","","","0.85","0.85","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000643","16.636","0.004","16.873","0.003","8.881","0.002","90","","90","","90","","2492.9","0.9","296","","296","","","","","","","","","4","C c c a :2","-C 2a 2ac","68","cyclen","1,4,7,10-tetrazacyclododecane","","- C8 H26 N4 O3 -","- C8 H26 N4 O3 -","- C64 H208 N32 O24 -","8","0.5","ST1013","Reibenspies, J. H.","Structure of 1,4,7,10-tetraazacyclododecane trihydrate","Acta Crystallographica Section C","1992","48","9","1717","1718","10.1107/S0108270192006723","","","0.71073","MoKα","","0.0715","0.052","","0.0622","0.0586","","","","1.302","1.452","1.452","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000644","13.452","0.002","7.952","0.001","15.671","0.001","90","","106.97","0.01","90","","1603.3","0.3","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Benzenesulfonyl-3-acetoxy-1,3-dihydroindole-2-one","","- C17 H15 N O5 S -","- C17 H15 N O5 S -","- C68 H60 N4 O20 S4 -","4","1","ST1011","Grossie, D. A.; Ketcha, D. M.","1-Benzenesulfonyl-3-methyl-2-oxo-2,3-dihydroindol-3-yl acetate","Acta Crystallographica Section C","1992","48","9","1718","1720","10.1107/S0108270192006334","","","0.71069","MoKα","","0.052","0.041","","0.052","0.04","","","","1.179","1.015","1.015","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000645","6.548","0.002","9.685","0.002","21.282","0.008","90","","90","","90","","1349.6","0.7","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2α, 3α,-7α, 13α-diépoxyhimachalane","","- C15 H24 O2 -","- C15 H24 O2 -","- C60 H96 O8 -","4","1","PA1001","Chiaroni, A.; Riche, C.; Benharref, A.; Chekroun, A.; Lavergne, J.-P.","Structure du 2α,3α,7α,13α-diépoxyhimachalane","Acta Crystallographica Section C","1992","48","9","1720","1722","10.1107/S0108270192005316","","","1.5418","CuKα","","","0.054","","","0.071","","","","","0.96","0.96","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000646","14.932","0.003","14.85","0.002","7.173","0.002","90","","90","","90","","1590.5","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2'-S-Chloro-3',4'-dihydro-spiro[1,3-dioxolane-2,1'- (2'H)-naphthalene]-4,5-R,R-dicarboxylic Acid Dimethyl Ester","","- C16 H17 Cl O6 -","- C16 H17 Cl O6 -","- C64 H68 Cl4 O24 -","4","1","KA1004","Ianelli, S.; Nardelli, M.; Giordano, C.; Coppi, L.; Restelli, A.","Enantiomerically pure α-haloketals: structure and conformation of (2'<i>S</i>,4'<i>R</i>,5'<i>R</i>)-dimethyl 2'-halo-1',2',3',4'-tetrahydrospiro[1,3-dioxolane-2,1'-naphthalene]-4,5-dicarboxylates (halo = Cl, Br, I)","Acta Crystallographica Section C","1992","48","9","1722","1727","10.1107/S0108270192005699","","","0.7093","Mo-Kα~1~","","","0.0318","","","0.0407","","","","","0.4548","0.4548","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000647","15.054","0.003","14.924","0.002","7.207","0.002","90","","90","","90","","1619.2","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2'-S-Bromo-3',4'-dihydro-spiro[1,3-dioxolane-2,1'- (2'H)-naphthalene]-4,5-R,R-dicarboxylic Acid Dimethyl Ester","","- C16 H17 Br O6 -","- C16 H17 Br O6 -","- C64 H68 Br4 O24 -","4","1","KA1004","Ianelli, S.; Nardelli, M.; Giordano, C.; Coppi, L.; Restelli, A.","Enantiomerically pure α-haloketals: structure and conformation of (2'<i>S</i>,4'<i>R</i>,5'<i>R</i>)-dimethyl 2'-halo-1',2',3',4'-tetrahydrospiro[1,3-dioxolane-2,1'-naphthalene]-4,5-dicarboxylates (halo = Cl, Br, I)","Acta Crystallographica Section C","1992","48","9","1722","1727","10.1107/S0108270192005699","","","1.54056","Cu-Kα~1~","","","0.0431","","","0.0558","","","","","0.7118","0.7118","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000648","29.018","0.003","8.53","0.001","11.762","0.001","90","","90","","90","","2911.4","0.5","293","2","293","2","","","","","","","","4","P b c a","","","","1-Indanone-2-spiro-4'-N-phenylpiperidine","","- C19 H19 N O -","- C19 H19 N O -","- C152 H152 N8 O8 -","8","1","KA1005","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Forconi, H.; Caubère, P.","Structure and conformation of 1'-phenylindan-2-spiro-4'-piperidin-1-one","Acta Crystallographica Section C","1992","48","9","1727","1730","10.1107/S0108270192005328","","","1.54178","X-rayCuK-αmean","","","0.0395","","","0.0566","","","","","0.8064","0.8064","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000649","13.737","0.002","6.9879","0.0005","15.124","0.005","90","","94.37","0.01","90","","1447.6","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","cis,anti,cis-4b,5,6,6a,10b,10c-hexahydro-4b-hydroxybenzo[3,4]cyclobuta- [1,2a]biphenylene-4-carboxaldehyde","","- C19 H16 O2 -","- C19 H16 O2 -","- C76 H64 O8 -","4","1","KA1010","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Zouaoui, M. A.; Caubère, P.","Structure and conformation of <i>cis</i>,<i>anti</i>,<i>cis</i>-4b,4c,8b,9,10,10a-hexahydro-4b-hydroxybenzo[3,4]cyclobuta[1,2-<i>a</i>]biphenylene-4-carbaldehyde","Acta Crystallographica Section C","1992","48","9","1730","1733","10.1107/S0108270192005420","","","1.54178","CuKα~1~","","","0.0453","","","0.0468","","","","","0.7321","0.7321","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000650","13.474","0.002","12.54","0.001","7.632","0.001","101.78","0.01","95.02","0.01","87.14","0.01","1256.9","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","cis-9a-Methoxy-1,2,3,4,4a,9a,-hexahydrofluoren-9-one oxime","","- C14 H17 N O2 -","- C14 H17 N O2 -","- C56 H68 N4 O8 -","4","2","KA1012","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Caubère, P.","Structure and conformation of <i>cis</i>-9a-methoxy-1,2,3,4,4a,9a-hexahydrofluoren-9-one oxime","Acta Crystallographica Section C","1992","48","9","1734","1737","10.1107/S0108270192005912","","","1.54056","CuKα~1~","","","0.0846","","","0.0976","","","","","2.6728","2.6728","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000651","9.279","0.001","14.035","0.001","9.123","0.001","90","","117.37","0.01","90","","1055.1","0.2","295","","295","","","","","","","","","5","P 1 21 1","P 2yb","4","meropenem","(1R,5S,6S)-2-[(3S,5S)-5-Dimethylaminocarbonylpyrrolidin-3-ylthio]- 6-[(R)-1-hydroxyethyl]-1-methylcarbapen-2-em-3-carboxylate trihydrate","","- C17 H31 N3 O8 S -","- C17 H31 N3 O8 S -","- C34 H62 N6 O16 S2 -","2","1","AS1005","Yanagi, K.; Takeuchi, Y.; Sunagawa, M.","Structure of a novel carbapenem antibiotic, meropenem","Acta Crystallographica Section C","1992","48","9","1737","1739","10.1107/S0108270192004608","","","1.5418","CuKα","","0.036","0.034","","","0.046","","","","","1.82","1.82","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000652","8.3806","0.0004","8.3806","0.0004","8.3806","0.0004","65.527","0.003","65.527","0.003","65.527","0.003","535.72","0.05","","","","","","","","","","","","4","R 3 c :R","P 3* -2n","161","","","","- Al2 H6 O12 Se3 -","- Al2 O12 Se3 -","- Al4 O24 Se6 -","2","0.333333","CR0386","Harrison, W. T. A.; Stucky, G. D.; Morris, R. E.; Cheetham, A. K.","Synthesis and structure of aluminium selenite trihydrate, Al~2~(SeO~3~)~3~.3H~2~O","Acta Crystallographica Section C","1992","48","8","1365","1367","10.1107/S0108270192000015","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2000653","9.501","0.001","7.14","0.001","13.47","0.002","90","","94.27","0.01","90","","911.2","0.2","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C2 H6 N2 O3 S2 Sr -","- C2 H6 N2 O3 S2 Sr -","- C8 H24 N8 O12 S8 Sr4 -","4","1","SE0079","Mereiter, K.; Preisinger, A.","Structure of strontium thiocyanate trihydrate, Sr(SCN)~2~.3H~2~O, at 295 and 125 K","Acta Crystallographica Section C","1992","48","8","1367","1370","10.1107/S0108270191015081","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000654","9.452","0.002","7.103","0.002","13.373","0.003","90","","94.51","0.02","90","","895.1","0.4","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C2 H6 N2 O6 S2 Sr -","- C2 H6 N2 O3 S2 Sr -","- C8 H24 N8 O12 S8 Sr4 -","4","1","SE0079","Mereiter, K.; Preisinger, A.","Structure of strontium thiocyanate trihydrate, Sr(SCN)~2~.3H~2~O, at 295 and 125 K","Acta Crystallographica Section C","1992","48","8","1367","1370","10.1107/S0108270191015081","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000655","7.596","0.002","7.596","0.002","8.027","0.003","90","","90","","90","","463.2","0.2","","","","","","","","","","","","5","P 42/m n m","-P 4n 2n","","","","","- Cl4 Cu H4 O2 Rb2 -","- Cl4 Cu H4 O2 Rb2 -","- Cl8 Cu2 H8 O4 Rb4 -","2","0.125","AS0559","Waizumi, K.; Masuda, H.; Ohtaki, H.; Burkov, K. A.; Chernykh, L.","Structure of 2RbCl.CuCl~2~.2H~2~O","Acta Crystallographica Section C","1992","48","8","1374","1376","10.1107/S0108270192000180","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000656","3.8268","0.0002","14.3142","0.0006","6.1724","0.0004","90","","90","","90","","338.11","0.03","","","","","","","","","","","","3","C m c m","-C 2c 2","","","","","- Bi2 O5 Sr2 -","- Bi2 O6 Sr2 -","- Bi4 O12 Sr4 -","2","0.125","MU0273","Vente, J. F.; Helmholdt, R. B.; IJdo, D. J. W.","Structure of Sr~2~Bi~2~O~5~ from X-ray and neutron powder diffraction data","Acta Crystallographica Section C","1992","48","8","1380","1382","10.1107/S0108270192000581","","neutron","2.57171","neutron","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000657","10","0.002","14.202","0.002","7.421","0.001","90","","90","","90","","1053.9","0.3","","","","","","","","","","","","4","C 2 2 21","C 2c 2","","","","","- B3 Cl O9 Sr5 -","- B3 Cl O9 Sr5 -","- B12 Cl4 O36 Sr20 -","4","0.5","HH0561","Alekel, T.; Keszler, D. A.","Structure of Sr~5~(BO~3~)~3~Cl","Acta Crystallographica Section C","1992","48","8","1382","1386","10.1107/S0108270192000507","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000658","28.865","0.01","13.787","0.007","14.733","0.004","90","","104.67","0.02","90","","5671.86","","","","","","","","","","","","","5","C 1 2/c 1","","","","","","- C15 H8 Fe4 O12 Te4 -","- C15 Fe4 O12 Te4 -","- C120 Fe32 O96 Te32 -","8","1","AL0505","Das, K.; Sinha, U. C.; Mathur, P.","Structure of a Te-methylene-Te bridged double-butterfly complex","Acta Crystallographica Section C","1992","48","8","1386","1389","10.1107/S0108270191014488","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000659","28.865","0.01","13.787","0.007","14.733","0.004","90","","104.67","0.02","90","","5671.86","","","","","","","","","","","","","5","C 1 2/c 1","","","","","","- C15 H8 Fe4 O12 Te4 -","- C15 Fe4 O12 Te4 -","- C120 Fe32 O96 Te32 -","8","1","AL0505","Das, K.; Sinha, U. C.; Mathur, P.","Structure of a Te-methylene-Te bridged double-butterfly complex","Acta Crystallographica Section C","1992","48","8","1386","1389","10.1107/S0108270191014488","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000660","9.217","0.001","9.998","0.001","7.365","0.001","90","","117.07","0.01","90","","604.35","0.13","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C4 H4 Na O4 -","- C4 H6 Na O4 -","- C16 H24 Na4 O16 -","4","0.5","AB0263","Kalsbeek, N.","Structures of partially deuterated sodium hydrogen succinate at 295 and 120 K and rubidium hydrogen succinate at 120 K","Acta Crystallographica Section C","1992","48","8","1389","1394","10.1107/S0108270191014865","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000661","8.844","0.002","10.284","0.003","7.349","0.002","90","","117.33","0.02","90","","593.8","0.3","","","","","","","","","","","","4","C 1 2/c 1","","","","","","- C4 H4 Na O4 -","- C4 H6 Na O4 -","- C16 H24 Na4 O16 -","4","0.5","AB0263","Kalsbeek, N.","Structures of partially deuterated sodium hydrogen succinate at 295 and 120 K and rubidium hydrogen succinate at 120 K","Acta Crystallographica Section C","1992","48","8","1389","1394","10.1107/S0108270191014865","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000662","16.927","0.003","6.105","0.0006","6.3343","0.0009","90","","109.17","0.01","90","","618.28","0.16","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C4 H5 O4 Rb -","- C4 H6 O4 Rb -","- C16 H24 O16 Rb4 -","4","0.5","AB0263","Kalsbeek, N.","Structures of partially deuterated sodium hydrogen succinate at 295 and 120 K and rubidium hydrogen succinate at 120 K","Acta Crystallographica Section C","1992","48","8","1389","1394","10.1107/S0108270191014865","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000663","12.855","0.002","13.501","0.002","5.8864","0.0006","102.6","0.01","103.24","0.01","110.235","0.009","882.2","0.2","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C6 H8 Cd Cl O3 P -","- C6 Cd Cl O3 P -","- C24 Cd4 Cl4 O12 P4 -","4","2","HH0583","Du, J.-L.; Rettig, S. J.; Thompson, R. C.; Trotter, J.","Structure of a polymeric cadmium complex containing triply bridging monophenylphosphinate ligands","Acta Crystallographica Section C","1992","48","8","1394","1397","10.1107/S0108270191014841","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000664","9.772","0.003","15.366","0.004","20.973","0.005","90","","102.53","0.02","90","","3074.2","1.5","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26.84 H48 Au2 Br1.16 N0.84 P2 -","- C28 H48 Au2 Br2 N2 P2 -","- C112 H192 Au8 Br8 N8 P8 -","4","1","HH0581","Schaefer, W. P.; McCleskey, T. M.; Gray, H. B.","A μ-bis(phosphino)ethane gold(I) dimer","Acta Crystallographica Section C","1992","48","8","1397","1399","10.1107/S010827019101507X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000665","9.306","0.003","16.247","0.003","8.972","0.002","104.72","0.02","96.38","0.02","80.44","0.02","1290.4","0.6","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C18 H24 Cl4 Co Fe N6 O4 -","- C18 H24 Cl4 Co Fe N6 O4 -","- C36 H48 Cl8 Co2 Fe2 N12 O8 -","2","1","AS0557","Xu, D.; Lei, L.; Xu, Y.; Cheng, C.; Chen, J.","Structure of <i>trans</i>-bis[dimethylglyoximato(1-)-<i>N</i>,<i>N</i>']bis(pyridine-<i>N</i>)cobalt(III) tetrachloroferrate(III)","Acta Crystallographica Section C","1992","48","8","1399","1402","10.1107/S0108270192000088","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206341","2020-10-21","18:00:00",""
"2000666","13.489","0.0005","9.6913","0.0007","16.6847","0.0005","90","","112.365","0.003","90","","2017.06","0.18","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C12 H24 Cl2 N6 O6 Ru -","- C12 H24 Cl2 N6 O6 Ru -","- C48 H96 Cl8 N24 O24 Ru4 -","4","0.5","HE0033","Taqui Khan, M. M.; Venkatasubramanian, K.; Abdi, S. H. R.; Bhadbhade, M. M.; Tyagi, B.","Structure of tris(dimethylglyoxime)ruthenium(II) dichloride","Acta Crystallographica Section C","1992","48","8","1402","1405","10.1107/S010827019101510X","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000667","8.501","0.001","8.59","0.001","10.854","0.002","84.54","0.02","82.1","0.02","84.73","0.02","779","0.2","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H19 Cu N2 O4 S -","- C12 H19 Cu N2 O4 S -","- C24 H38 Cu2 N4 O8 S2 -","2","1","LI0117","Haanstra, W. G.; Driessen, W. L.; Reedijk, J.; Wood, J. S.","Structure of <i>catena</i>-poly-[{tetrakis-μ-(acetato-<i>O</i>:<i>O</i>')-dicopper(II)}-μ-{1,8-bis(3,5-dimethyl-1-pyrazolyl)-3,6-dithiaoctane-<i>N</i>^2^,<i>N</i>^2^'}]","Acta Crystallographica Section C","1992","48","8","1405","1407","10.1107/S0108270192000362","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000668","9.802","0.002","13.288","0.002","22.686","0.003","88.69","0.01","89.29","0.02","82.4","0.02","2928","0.8","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C66 H54 Fe N6 O6 P3 -","- C66 H54 Fe N6 O6 P3 -","- C132 H108 Fe2 N12 O12 P6 -","2","1","MU0279","Matt, D.; Lakkis, D.; Grandjean, D.; Balegroune, F.; Laidoudi, A.","Structure of tris(4-diphenylphosphinoyl-3-methyl-1-phenylpyrazol-5-onato-<i>O</i>,<i>O</i>')iron(III)","Acta Crystallographica Section C","1992","48","8","1408","1411","10.1107/S0108270192000374","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000669","9.3667","0.0008","13.689","0.002","23.042","0.002","90","","90","","90","","2954.5","0.6","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C30 H32 O6 P2 Ru -","- C30 H32 O6 P2 Ru -","- C120 H128 O24 P8 Ru4 -","4","1","MU0244","Blake, A. J.; Crook, J. R.; Mawby, R. J.; Reid, A. J.; Reynolds, C. D.","Structure of <i>cis</i>-dicarbonyl[2-carboxylato-1-methoxycarbonyl-2-(4-methylphenyl)vinyl]-<i>trans</i>-bis(dimethylphenylphosphine)ruthenium(II), a complex containing a bidentate vinyl ligand","Acta Crystallographica Section C","1992","48","8","1411","1414","10.1107/S010827019200057X","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000670","32.017","0.009","23.557","0.007","7.933","0.003","90","","90","","90","","5983","3","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","","","","","- C18 H34 N3 Nd O17 S3 -","- C18 H33 N3 Nd O17 S3 -","- C144 H264 N24 Nd8 O136 S24 -","8","1","MU0260","Starynowicz, P.","Structure of bis(4-aminobenzenesulfonato-<i>O</i>)heptaaquaneodymium 4-aminobenzenesulfonate hydrate","Acta Crystallographica Section C","1992","48","8","1414","1416","10.1107/S0108270192000593","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","191087","2020-10-21","18:00:00",""
"2000671","8.924","0.004","18.467","0.005","22.165","0.003","91.42","0.02","92.36","0.02","92.21","0.03","3646","2","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C50 H114 B18 Li2 O3 Sc2 Si4 -","- C50 H114 B18 Li2 O3 Sc2 Si4 -","- C100 H228 B36 Li4 O6 Sc4 Si8 -","2","1","HH0559","Marsh, R. E.; Schaefer, W. P.; Bazan, G. C.; Bercaw, J. E.","A permethylcyclopentadienyl carbollide scandium complex, Sc~2~Si~4~O~3~C~50~B~18~Li~2~H~114~","Acta Crystallographica Section C","1992","48","8","1416","1419","10.1107/S0108270192000714","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206333","2020-10-21","18:00:00",""
"2000672","18.172","0.002","17.95","0.003","12.086","0.004","90","","90","","90","","3942.3","1.5","","","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C35 H28 Cl3 N9 O12 Pt2 -","- C35 H31 Cl3 N9 O15 Pt2 -","- C140 H124 Cl12 N36 O60 Pt8 -","4","0.5","HH0585","Bailey, J. A.; Gray, H. B.","A μ-pyrazolyl terpyridineplatinum(II) dimer","Acta Crystallographica Section C","1992","48","8","1420","1422","10.1107/S010827019200074X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2000673","7.901","0.001","10.147","0.001","11.37","0.002","90","","93.6","0.01","90","","909.8","0.2","","","","","","","","","","","","6","P 1 21 1","","","","","","- C19 H14 N O2 S2 Tc -","- C19 H14 N O2 S2 Tc -","- C38 H28 N2 O4 S4 Tc2 -","2","1","SE0080","Bandoli, G.; Mazzi, U.; Pietzsch, H.-J.; Spies, H.","Structure of (benzenethiolato)oxo[<i>N</i>-(2-sulfidophenyl)salicylideneiminato(2-)-<i>O</i>,<i>N</i>,<i>S</i>]technetium(V)","Acta Crystallographica Section C","1992","48","8","1422","1425","10.1107/S0108270191014798","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","189098","2020-10-21","18:00:00",""
"2000674","7.914","0.002","30.983","0.003","6.629","0.001","90","","102.38","0.01","90","","1587.6","0.5","","","","","","","","","","","","4","P 1 21/m 1","","","","","","- C38 H25 Fe N8 -","- C38 H25 Fe N8 -","- C76 H50 Fe2 N16 -","2","0.5","PA0263","Bravic, G.; Gaultier, J.; Chasseau, D.; Lequan, R. M.; Lequan, M.","Structure of (η^5^-cyclopentadienyl)(η^6^-1,3,5-trimethylbenzene)iron-7,7,8,8-tetracyano-<i>p</i>-quinodimethane (1/2)","Acta Crystallographica Section C","1992","48","8","1425","1428","10.1107/S0108270192000532","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000675","20.435","0.011","20.435","0.011","20.435","0.011","90","","90","","90","","8533","8","","","","","","","","","","","","6","P a -3","-P 2ac 2ab 3","","","","","- C7 H11 Cl N Nd O12 -","- C7 H9 Cl1.16667 N Nd O16 -","- C168 H216 Cl28 N24 Nd24 O384 -","24","1","MU0259","Starynowicz, P.","Structure of tetraaqua(2,6-pyridinedicarboxylato)neodymium perchlorate","Acta Crystallographica Section C","1992","48","8","1428","1430","10.1107/S010827019200060X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","191087","2020-10-21","18:00:00",""
"2000676","9.608","0.002","10.034","0.002","7.033","0.001","94.29","0.01","96.95","0.01","64.52","0.01","607.4","0.2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H28 Li4 O20 -","- C14 H28 Li4 O20 -","- C14 H28 Li4 O20 -","1","0.5","ST0556","Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E.","Structure of tetralithium 1,4,5,8-naphthalenetetracarboxylate dodecahydrate","Acta Crystallographica Section C","1992","48","8","1430","1434","10.1107/S0108270192000428","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000677","14.318","0.002","16.427","0.002","16.299","0.002","90","","100.01","0.01","90","","3775.2","0.8","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 Cu N4 -","- C22 H22 Cu N4 -","- C176 H176 Cu8 N32 -","8","2","HH0609","Cotton, F. A.; Czuchajowska-Wiesinger, J.","The structure of copper(II) 5,7,12,14-tetramethyldibenzo[<i>b</i>,<i>i</i>][1,4,8,11]tetraazacyclotetradeca-2,4,7,9,11,14-hexaenediide","Acta Crystallographica Section C","1992","48","8","1434","1437","10.1107/S0108270192000726","","","1.54183","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000678","13.592","0.003","11.46","0.003","25.751","0.009","90","","101.08","0.02","90","","3936.3","1.9","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","3,5-dimethyl-1,2-tellurazole","","- C5 H7 N Te -","- C5 H7 N Te -","- C120 H168 N24 Te24 -","24","6","GE0290","De Munno, G.; Lucchesini, F.","Structure of 3,5-dimethyl-1,2-tellurazole","Acta Crystallographica Section C","1992","48","8","1437","1439","10.1107/S0108270191014907","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","203714","2020-10-21","18:00:00",""
"2000679","12.529","0.001","13.068","0.001","15.815","0.001","90","","93.58","0.01","90","","2584.3","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 N4 O2 -","- C28 H40 N4 O2 -","- C112 H160 N16 O8 -","4","1","AL0518","Venkatasubramanian, K.; Paul, P.; Nanda, K. K.; Adhikary, B.; Nag, K.","Structure of a tetratertiaryamino-diphenolato macrocyclic ligand","Acta Crystallographica Section C","1992","48","8","1440","1442","10.1107/S0108270191014993","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000680","10.496","0.003","17.305","0.004","7.5","0.002","90","","128.94","0.02","90","","1059.6","0.6","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","","","","","- C9 H18 O3 -","- C9 H18 O3 -","- C36 H72 O12 -","4","0.5","HH0569","Romero, R. R.; Cervantes-Lee, F.; Porter, L. C.","Structure of 2,6-dihydroxy-2,6-dimethylheptan-4-one","Acta Crystallographica Section C","1992","48","8","1442","1444","10.1107/S0108270191014853","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000681","23.671","0.006","5.48","0.001","20.644","0.008","90","","123.82","0.02","90","","2224.8","1.2","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H9 Cl N2 O S -","- C10 H9 Cl N2 O S -","- C80 H72 Cl8 N16 O8 S8 -","8","1","HE0045","Beddoes, R. L.; Kearney, T.; Jackson, A.; Joule, J. A.","Structure of 5-chloro-2-methylthio-3<i>H</i>-indol-3-one 3-oxime <i>O</i>-methyl ether","Acta Crystallographica Section C","1992","48","8","1444","1446","10.1107/S0108270191015093","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000682","9.829","0.001","13.29","0.002","18.864","0.003","90","","90","","90","","2464.2","0.6","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C24 H24 N6 O4 S2 -","- C24 H24 N6 O4 S2 -","- C96 H96 N24 O16 S8 -","4","1","HH0557","Shin, W.; Kim, Joonyeong","Structure of diphenylmethyl 7β-amino-7α-methoxy-3-[(1-methyl-1<i>H</i>-tetrazol-5-ylthio)methyl]-3-cephem-4-carboxylate","Acta Crystallographica Section C","1992","48","8","1451","1453","10.1107/S0108270192000489","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","199682","2020-10-21","18:00:00",""
"2000683","11.038","0.005","11.211","0.006","14.436","0.008","90","","90","","90","","1786.4","1.6","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C16 H19 N3 O6 S -","- C16 N3 O6 S -","- C64 N12 O24 S4 -","4","1","HH0558","Shin, W.; Cho, S. W.","Structure of cefadroxil monohydrate","Acta Crystallographica Section C","1992","48","8","1454","1456","10.1107/S0108270192000490","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000684","22.04","0.005","10.295","0.004","11.827","0.003","90","","120.57","0.02","90","","2310.6","1.3","","","","","","","","","","","","5","C 1 2/m 1","","","","","","- C42 H48 Cl2 O14 S6 -","- C42 H48 Cl2 O14 S6 -","- C84 H96 Cl4 O28 S12 -","2","0.25","AB0262","Noreland, J.; Olovsson, G.; Olovsson, I.","Structure of the organic semiconducting radical cation salt tris[2,6-dimethoxy-3,7-bis(methylthio)naphthalene] diperchlorate","Acta Crystallographica Section C","1992","48","8","1459","1462","10.1107/S0108270192000027","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000685","25.01","0.002","6.144","0.001","8.169","0.001","90","","93.3","0.02","90","","1253.2","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-[(benzyloxycarbonyl)amino]cyclopropane-1-carbohydroxamic acid","","- C12 H14 N2 O4 -","- C12 H14 N2 O4 -","- C48 H56 N8 O16 -","4","1","GE0293","Busetti, V.; Crisma, M.; Toniolo, C.","Structure of 1-[(benzyloxycarbonyl)amino]cyclopropane-1-carbohydroxamic acid","Acta Crystallographica Section C","1992","48","8","1464","1466","10.1107/S0108270192000763","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206335","2020-10-21","18:00:00",""
"2000686","10.673","0.003","15.776","0.003","16.103","0.004","122.77","0.02","110.09","0.02","68.13","0.02","2080.5","1","","","","","","","","","","","","3","P 1","P 1","1","","","","- C67 H120 O38 -","- C68 H110 O39 -","- C68 H110 O39 -","1","1","PA0255","Rysanek, N.; Le Bas, G.; Villain, F.; Tsoucaris, G.","Structure of the (1:1:1) complex 2<i>a</i>,2<i>b</i>,2<i>c</i>,2<i>d</i>,2<i>e</i>,2<i>f</i>,3<i>a</i>,3<i>g</i>,6<i>a</i>,6<i>b</i>,6<i>c</i>,6<i>d</i>,6<i>e</i>,6<i>f</i>,6<i>g</i>-pentadeca-<i>O</i>-methyl-β-cyclodextrin-1,7-dioxaspiro[5.5]undecane-methanol","Acta Crystallographica Section C","1992","48","8","1466","1471","10.1107/S0108270192000520","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","278201","2022-09-27","00:27:37",""
"2000687","15.809","0.004","12.207","0.002","19.772","0.005","90","","90","","90","","3815.6","1.5","","","","","","","","","","","","6","P b c a","","","","","","- C21 H18 Cl N3 O S -","- C21 H18 Cl N3 O S -","- C168 H144 Cl8 N24 O8 S8 -","8","1","HU0407","Cheung, K.-K.; Echevarria, A.; Galembeck, S.; Maciel, M. A. M.; Miller, J.; Rumjanek, V. M.; Simas, A. M.","Mesoionic compounds. 3. Structure of the hydrochloride of 5(4-methoxyphenyl)-4-phenyl-1,3,4-thiadiazolium-2-phenylaminide","Acta Crystallographica Section C","1992","48","8","1471","1474","10.1107/S0108270192000283","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","190730","2020-10-21","18:00:00",""
"2000688","9.328","0.001","19.348","0.003","25.939","0.005","90","","90","","90","","4681.4","1.3","","","","","","","","","","","","3","P b c m","","","","","","- C53 H68 O5 -","- C54 H47 O5 -","- C216 H188 O20 -","4","0.5","AS0555","Armah, A. E.; Suzuki, K.; Fujii, S.; Tomita, K.; Asfari, Z.; Vicens, J.","Structure of <i>p</i>-<i>tert</i>-butylbishomooxacalix[4]arene-<i>m</i>-xylene (1:1) complex","Acta Crystallographica Section C","1992","48","8","1474","1476","10.1107/S0108270192000179","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000689","11.237","0.003","13.073","0.002","8.04","0.003","106.4","0.02","105.48","0.02","85.7","0.02","1091.9","0.6","","","","","","","","","","","","5","P -1","-P 1","2","","trimethylsilylethyl cis-4,5-dimethyl-1-(o-nitrobenzyl)-3-oxopyrazolidine-2-carboxylate","","- C18 H27 N3 O5 Si -","- C18 H27 N3 O5 Si -","- C36 H54 N6 O10 Si2 -","2","1","HH0564","Johnson, A. T.; Keszler, D. A.; Perri, S. T.; White, J. D.","Structure of a highly substituted pyrazolidin-3-one","Acta Crystallographica Section C","1992","48","8","1476","1479","10.1107/S0108270192000519","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206333","2020-10-21","18:00:00",""
"2000690","23.866","0.011","9.571","0.005","6.686","0.003","90","","90","","90","","1527.2","1.3","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C18 H15 N3 O4 -","- C18 H15 N3 O4 -","- C72 H60 N12 O16 -","4","1","GE0276","Agmon, I.; Ashkenazi, P.; Kaftory, M.","Structure of Diels-Alder reaction adducts of certain propellanes with 4-phenyl-1,2,4-triazoline-3,5-dione","Acta Crystallographica Section C","1992","48","8","1479","1484","10.1107/S0108270192001069","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000691","24.104","0.012","9.774","0.005","6.463","0.003","90","","90","","90","","1522.6","1.3","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C18 H15 N3 O4 -","- C18 H15 N3 O4 -","- C72 H60 N12 O16 -","4","1","GE0276","Agmon, I.; Ashkenazi, P.; Kaftory, M.","Structure of Diels-Alder reaction adducts of certain propellanes with 4-phenyl-1,2,4-triazoline-3,5-dione","Acta Crystallographica Section C","1992","48","8","1479","1484","10.1107/S0108270192001069","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000692","13.096","0.006","12.653","0.006","10.696","0.005","90","","90","","90","","1772.4","1.4","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C20 H19 N3 O4 -","- C20 H19 N3 O4 -","- C80 H76 N12 O16 -","4","1","GE0276","Agmon, I.; Ashkenazi, P.; Kaftory, M.","Structure of Diels-Alder reaction adducts of certain propellanes with 4-phenyl-1,2,4-triazoline-3,5-dione","Acta Crystallographica Section C","1992","48","8","1479","1484","10.1107/S0108270192001069","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000693","26.724","0.013","11.985","0.006","11.453","0.006","90","","99.96","0.02","90","","3613","3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C20 H19 N3 O4 -","- C20 H19 N3 O4 -","- C160 H152 N24 O32 -","8","2","GE0276","Agmon, I.; Ashkenazi, P.; Kaftory, M.","Structure of Diels-Alder reaction adducts of certain propellanes with 4-phenyl-1,2,4-triazoline-3,5-dione","Acta Crystallographica Section C","1992","48","8","1479","1484","10.1107/S0108270192001069","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000694","13.474","0.007","11.422","0.006","11.534","0.006","90","","97.73","0.02","90","","1759","1.6","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C20 H19 N3 O4 -","- C20 H19 N3 O4 -","- C80 H76 N12 O16 -","4","1","GE0276","Agmon, I.; Ashkenazi, P.; Kaftory, M.","Structure of Diels-Alder reaction adducts of certain propellanes with 4-phenyl-1,2,4-triazoline-3,5-dione","Acta Crystallographica Section C","1992","48","8","1479","1484","10.1107/S0108270192001069","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000695","14.586","0.0008","14.586","0.0008","52.351","0.004","90","","90","","120","","9645.6","1.1","","","","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C72 H60 Au Cl O4 Sb4 -","- C72 H60 Au Cl O6 Sb4 -","- C432 H360 Au6 Cl6 O36 Sb24 -","6","0.333333","HA0090","Jones, P. G.","Tetrakis(triphenylstibine)gold(I) perchlorate","Acta Crystallographica Section C","1992","48","8","1487","1488","10.1107/S0108270192000246","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","199739","2020-10-21","18:00:00",""
"2000696","10.764","0.001","12.557","0.004","19.626","0.002","90","","90","","90","","2652.7","0.9","","","","","","","","","","","","6","P b c a","","","","","","- C12 H17 Cl N2 O Pd -","- C12 H17 Cl N2 O Pd -","- C96 H136 Cl8 N16 O8 Pd8 -","8","1","AS0592","Cho, I.; Yeo, H.; Whang, D.; Kim, K.","Structure of chloro[<i>N</i>-(3-dimethylamino-1-propyl)salicylideneaminato]palladium(II)","Acta Crystallographica Section C","1992","48","8","1488","1489","10.1107/S0108270192002543","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000697","15.67","0.02","13.54","0.02","13.24","0.02","90","","127.9","0.2","90","","2217","8","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H20 Cl10 N2 Sn -","- C8 H20 Cl10 N2 Sn -","- C32 H80 Cl40 N8 Sn4 -","4","0.5","HH0578","Kane, C. J.; Long, R.; Pettit, W. E.; Breneman, G. L.; Pettit, G. R.","Structure of bis(2-chloroethyl)ammonium hexachlorostannate","Acta Crystallographica Section C","1992","48","8","1490","1491","10.1107/S0108270191015135","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2000698","10.535","0.002","10.936","0.002","16.5","0.003","90","","90","","90","","1901","0.6","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 Br P S Sn -","- C16 H20 Br P S Sn -","- C64 H80 Br4 P4 S4 Sn4 -","4","1","AL0519","Preut, H.; Godry, B.; Mitchell, T. N.","[2-(Bromodimethylstaannyl)ethyl]diphenylphosphine sulfide","Acta Crystallographica Section C","1992","48","8","1491","1493","10.1107/S0108270191014750","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000699","21.654","0.003","10.581","0.001","16.82","0.001","90","","90","","90","","3853.8","0.7","","","","","","","","","","","","5","P n a 21","","","","","","- C44 H45 Ir O P2 -","- C44 H45 Ir O P2 -","- C176 H180 Ir4 O4 P8 -","4","1","BR0014","Janik, T. S.; Churchill, M. R.; See, R. F.; Randall, S. L.; McFarland, J. M.; Atwood, J. D.","Structure of <i>trans</i>-carbonylmethylbis(tri-<i>p</i>-tolylphosphine)iridium(I), <i>trans</i>-[Ir(CO)(CH~3~){P(<i>p</i>-C~6~H~4~CH~3~)~3~}~2~]","Acta Crystallographica Section C","1992","48","8","1493","1495","10.1107/S0108270191014890","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000700","9.029","0.004","13.265","0.004","21.426","0.011","90","","92.62","0.04","90","","2563.5","1.9","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C32 H25 O2 S -","- C32 H25 O2 S -","- C128 H100 O8 S4 -","4","1","LI0092","Vojtěchovský, J.; Hašek, J.","Structure of 1,1-dioxo-2,4,4,6-tetraphenyl-4<i>H</i>-thiopyran benzene solvate","Acta Crystallographica Section C","1992","48","8","1495","1497","10.1107/S0108270191014099","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","194538","2020-10-21","18:00:00",""
"2000701","10.622","0.003","11.448","0.002","12.343","0.003","96.08","0.02","69.42","0.02","67.69","0.02","1249.3","0.6","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C30.5 H23.5 O S -","- C35 H22 O S -","- C70 H44 O2 S2 -","2","1","LI9092","Vojtěchovský, J.; Hašek, J.","Structure of 1-oxo-2,4,4,6-tetraphenyl-4<i>H</i>-thiopyran benzene solvate","Acta Crystallographica Section C","1992","48","8","1497","1499","10.1107/S0108270192002117","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000702","8.239","0.001","9.75","0.001","7.856","0.001","105.67","0.01","118.14","0.01","79.85","0.01","534.91","0.12","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C26 H26 N2 O4 -","2","1","AL0510","Kakehi, A.; Kitajima, K.; Ito, S.; Takusagawa, N.","Structure of a cyclopenta[<i>hi</i>]indolizine","Acta Crystallographica Section C","1992","48","8","1499","1500","10.1107/S0108270191014531","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000703","6.5675","0.0008","11.9949","0.0014","5.1052","0.0006","93.418","0.004","100.42","0.004","74.612","0.006","381.33","0.08","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C16 H24 O4 -","- C16 H24 O4 -","- C16 H24 O4 -","1","0.5","ST0550","Choubal, M. D.; Fernandez, E. J.; Crumrine, D. S.; Pavkovic, S. F.","Structure of diethyl <i>cis</i>,<i>cis</i>-3,8-cyclodecadiene-<i>trans</i>-1,6-dicarboxylate","Acta Crystallographica Section C","1992","48","8","1501","1502","10.1107/S0108270191014191","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206333","2020-10-21","18:00:00",""
"2000704","12.058","0.004","7.791","0.001","17.006","0.003","90","","91.74","0.03","90","","1596.9","0.6","","","","","","","","","","","","5","I 1 a 1","I -2ya","9","","","","- C16 H20 N O3 P -","- C16 H20 N O3 P -","- C64 H80 N4 O12 P4 -","4","1","HA0081","Bartczak, T. J.; Wolf, W. M.; Stoeckli-Evans, H.","Structure of <i>r</i>-5-cyano-5-methyl-<i>t</i>-4-methyl-<i>t</i>-7-oxo-7-phenyl-8-oxa-7-phosphabicyclo[4.3.0]non-2-ene monohydrate","Acta Crystallographica Section C","1992","48","8","1502","1504","10.1107/S0108270191014440","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","203584","2020-10-21","18:00:00",""
"2000705","13.345","0.003","7.729","0.002","10.471","0.002","90","","101.18","0.02","90","","1059.5","0.4","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H37 D3 O3 -","- C23 H37 D3 O3 -","- C46 H74 D6 O6 -","2","1","CR0374","McMullan, R. K.; Koetzle, T. F.; Fronckowiak, M. D.","Structure of [20-CH~3~],[20-CD~3~]-methylpregnene-3,20-diol methanolate from neutron diffraction at 123 K","Acta Crystallographica Section C","1992","48","8","1509","1512","10.1107/S0108270192000234","","neutron","1.0508","neutron","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000706","9.123","0.003","15.727","0.003","11.916","0.003","90","","106.53","0.02","90","","1639","0.8","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C19 H18 O4 -","- C19 H18 O4 -","- C76 H72 O16 -","4","1","HU0403","Linden, A.","Structure of 3-benzyloxy-5-(benzyloxymethyl)-5<i>H</i>-furan-2-one","Acta Crystallographica Section C","1992","48","8","1514","1516","10.1107/S0108270192000337","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000707","8.4118","0.0002","11.9934","0.0004","7.9901","0.0004","83.493","0.003","114.946","0.003","101.598","0.003","715.59","0.05","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H16 N2 O2 -","- C18 H16 N2 O2 -","- C36 H32 N4 O4 -","2","1","CR0392","Sui, X.; Codding, P. W.","Structure of 3,4-diethylcanthine-5,6-dione","Acta Crystallographica Section C","1992","48","8","1516","1518","10.1107/S0108270192000222","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000708","24.386","0.003","10.816","0.002","9.983","0.001","90","","92.71","0.01","90","","2630.2","0.6","","","","","","","","","","","","4","P 1 21 1","","","","","","- C46 H83 N O18 -","- C46 H77 N O19 -","- C92 H154 N2 O38 -","2","1","AS0564","Nakai, H.; Matsutani, S.","Structure of concanamycin A pentahydrate","Acta Crystallographica Section C","1992","48","8","1519","1521","10.1107/S0108270191014749","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","191088","2020-10-21","18:00:00",""
"2000709","12.8198","0.0009","6.9843","0.0008","23.0717","0.0013","90","","102.981","0.005","90","","2013","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H17 N3 S3 -","- C22 H17 N3 S3 -","- C88 H68 N12 S12 -","4","1","AL0516","Husebye, S.; Maartmann-Moe, K.; Mikalsen, Ø.","The structure of a trisubstituted 3<i>H</i>-1,2-dithiole","Acta Crystallographica Section C","1992","48","8","1521","1523","10.1107/S0108270191015007","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000710","10.1406","0.0005","10.1948","0.0006","18.87","0.001","90","","97.253","0.002","90","","1935.2","0.18","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 P S4 -","- C18 H15 P S4 -","- C72 H60 P4 S16 -","4","1","HH0567","Shibao, R. K.; Keder, N. L.; Eckert, H.","Structure of tris(phenylthio)phosphine sulfide","Acta Crystallographica Section C","1992","48","8","1525","1527","10.1107/S0108270191014919","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206034","2020-10-21","18:00:00",""
"2000711","10.615","0.001","9.115","0.002","12.948","0.002","90","","108.57","0.01","90","","1187.6","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-acetyl-2,5,9-trinitro-2,5,7,9-tetraazabicyclo[4.3.0]nonan-8-one","","- C7 H9 N7 O8 -","- C7 H9 N7 O8 -","- C28 H36 N28 O32 -","4","1","HH0573","George, C.; Gilardi, R.; Flippen-Anderson, J. L.","Structure of 7-acetyl-2,5,9-trinitro-2,5,7,9-tetraazabicyclo[4.3.0]nonan-8-one","Acta Crystallographica Section C","1992","48","8","1527","1528","10.1107/S0108270191014956","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","296843","2024-12-11","14:15:26",""
"2000712","6.151","0.002","13.484","0.007","15.165","0.009","90","","90.94","0.05","90","","1257.6","1.1","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 N4 O5 -","- C10 H16 N4 O5 -","- C40 H64 N16 O20 -","4","1","HH0576","Gilardi, R.; George, C.; Flippen-Anderson, J. L.","Structures of (I) 6-nitro-2,4-dipropionyl-8-oxa-2,4,6-triazabicyclo[3.3.0]octane and (II) 2,4-diacetyl-6-nitro-8-oxa-2,4,6-triazabicyclo[3.3.0]octane","Acta Crystallographica Section C","1992","48","8","1528","1530","10.1107/S0108270191014944","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000713","7.801","0.001","19.885","0.003","7.077","0.001","90","","91.35","0.02","90","","1097.5","0.3","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- C8 H12 N4 O5 -","- C8 H18 N4 O5 -","- C32 H72 N16 O20 -","4","1","HH0576","Gilardi, R.; George, C.; Flippen-Anderson, J. L.","Structures of (I) 6-nitro-2,4-dipropionyl-8-oxa-2,4,6-triazabicyclo[3.3.0]octane and (II) 2,4-diacetyl-6-nitro-8-oxa-2,4,6-triazabicyclo[3.3.0]octane","Acta Crystallographica Section C","1992","48","8","1528","1530","10.1107/S0108270191014944","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000714","6.552","0.002","25.794","0.006","19.412","0.005","90","","90","","90","","3280.7","1.5","","","","","","","","","","","","4","P b c a","","","","","","- C11 H18 N8 O8 -","- C11 H18 N8 O8 -","- C88 H144 N64 O64 -","8","1","HH0579","Flippen-Anderson, J. L.; George, C.; Gilardi, R.","Structure of 2,4,6-trinitro-8,10-dipropionyl-2,4,6,8,10-pentaazabicyclo[5.3.0]decane","Acta Crystallographica Section C","1992","48","8","1530","1531","10.1107/S0108270191015123","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000715","8.482","0.001","11.844","0.002","11.943","0.002","90","","90","","90","","1199.8","0.3","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H12 N6 O6 -","- C8 H12 N6 O6 -","- C32 H48 N24 O24 -","4","1","HH0606","Gilardi, R.; George, C.; Flippen-Anderson, J. L.","Structure of 6,8-diacetyl-2,4-dinitro-2,4,6,8-tetraazabicyclo[3.3.0]octane","Acta Crystallographica Section C","1992","48","8","1532","1533","10.1107/S0108270191014968","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000716","10.636","0.002","12.759","0.001","18.185","0.002","90","","90","","90","","2467.8","0.6","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H41 N2 O2 P -","- C25 H41 N2 O2 P -","- C100 H164 N8 O8 P4 -","4","1","CD0065","Bélanger-Gariépy, F.; Bennani, Y. L.; Beaudoin, S.; Hanessian, S.","Structure of a chiral bicyclic β-hydroxyphosphonamide - an asymmetric olefination intermediate, C~25~H~41~N~2~O~2~P","Acta Crystallographica Section C","1992","48","8","1533","1535","10.1107/S0108270191014671","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000717","9.101","0.003","8.612","0.006","13.79","0.005","90","","92.29","0.03","90","","1080","0.9","","","","","","","","","","","","5","P 1 21 1","","","","","","- C22 H35 N2 O2 P -","- C22 H35 N2 O2 P -","- C44 H70 N4 O4 P2 -","2","1","CD0066","Simard, M.; Beaudoin, S.; Hanessian, S.","Structure of a chiral bicyclic β-hydroxyphosphonamide - a product of kinetic resolution in an olefination reaction, C~22~H~35~N~2~O~2~P","Acta Crystallographica Section C","1992","48","8","1535","1537","10.1107/S0108270191014695","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000718","13.703","0.002","9.122","0.002","18.028","0.002","90","","107.15","0.01","90","","2153.3","0.6","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H22 O5 -","- C27 H22 O5 -","- C108 H88 O20 -","4","1","ST0562","Prince, P.; Fronczek, F. R.; Gandour, R. D.","Methyl 8-[(2,7-dimethoxynaphthyl)ethynyl]-7-methoxy-2-naphthoate","Acta Crystallographica Section C","1992","48","8","1538","1540","10.1107/S0108270191014786","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000719","7.842","0.001","13.84","0.002","8.536","0.001","90","","100.04","0.01","90","","912.3","0.2","292","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H24 O5 -","- C20 H24 O5 -","- C40 H48 O10 -","2","1","NA1003","Rychlewska, U.; Szczepańska, B.; Serkerov, S. V.","Two eudesmanolide-type sesquiterpene lactones from <i>Umbelliferae</i>","Acta Crystallographica Section C","1992","48","8","1543","1547","10.1107/S0108270192004268","","","1.54178","CuKα","","","0.039","","","0.053","","","","","3.4","3.4","","","","","has coordinates","296843","2024-12-11","14:15:26",""
"2000720","8.035","0.001","7.208","0.001","15.887","0.003","90","","90.92","0.01","90","","920","0.2","292","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H26 O4 -","- C20 H26 O4 -","- C40 H52 O8 -","2","1","NA1003","Rychlewska, U.; Szczepańska, B.; Serkerov, S. V.","Two eudesmanolide-type sesquiterpene lactones from <i>Umbelliferae</i>","Acta Crystallographica Section C","1992","48","8","1543","1547","10.1107/S0108270192004268","","","1.54178","CuKα","","","0.041","","","0.051","","","","","3.1","3.1","","","","","has coordinates","296843","2024-12-11","14:15:26",""
"2000721","8.465","0.002","6.062","0.001","11.901","0.002","90","","95.78","0.01","90","","607.6","0.2","293","1","293","1","","","","","","","","3","P 1 21 1","P 2yb","4","","2-(4-methylphenyl)-1H-indene-1,3(2H)-dione","","- C16 H12 O2 -","- C16 H12 O2 -","- C32 H24 O4 -","2","1","AL1009","Kolev, T.; Preut, H.; Bleckmann, P.; Juchnovski, I.","Structure of 2-(4-methylphenyl)-1<i>H</i>-indene-1,3(2<i>H</i>)-dione","Acta Crystallographica Section C","1992","48","8","1547","1549","10.1107/S0108270192005742","","","0.71073","MoKα","","","0.033","","","0.043","","","","","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000722","8.81","0.002","9.231","0.003","9.34","0.002","84.48","0.02","75.88","0.02","66.49","0.02","675.5","0.3","296","","296","","","","","","","","","4","P -1","-P 1","2","","4-methoxycarbonyl-8,9-methylenedioxy-1,2,5,6,10b-pentahydro-2- oxobenzo[d]cyclopen[b]azepine","","- C16 H15 N O5 -","- C16 H15 N O5 -","- C32 H30 N2 O10 -","2","1","CR1010","Robinson, P. D.; Hua, D. H.; Hong, Y.; Miao, S. W.","Methyl 1,2,4,5,6,10b-hexahydro-8,9-methylenedioxy-2-oxobenzo[<i>d</i>]cyclopenta[<i>b</i>]azepine-4-carboxylate","Acta Crystallographica Section C","1992","48","8","1549","1551","10.1107/S0108270192005626","","","0.71069","MoKα","","","0.049","","","0.047","","","","","1.32","1.32","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000723","8.321","0.003","10.271","0.003","15.313","0.004","71.59","0.02","84.88","0.02","73.5","0.02","1190.6","0.7","293","1","293","1","","","","","","","","5","P -1","-P 1","2","","Ethyl (Z)-4-(chlorodimethylstannyl)-6-hydroxy-7-oxo- 6,7-diphenyl-3-heptenoate","","- C23 H27 Cl O4 Sn -","- C23 H27 Cl O4 Sn -","- C46 H54 Cl2 O8 Sn2 -","2","1","KA1011","Preut, H.; Dornseifer, N. M.; Mitchell, T. N.","Structure of ethyl (<i>Z</i>)-4-(chlorodimethyl-stannyl)-6-hydroxy-7-oxo-6,7-diphenyl-3-heptenoate","Acta Crystallographica Section C","1992","48","8","1551","1553","10.1107/S0108270192005705","","","0.71073","MoKα","","0.0413","0.0323","","0.0435","0.0388","","","","","0.8672","0.8672","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000724","10.657","0.001","5.12","0.001","14.813","0.002","90","","109.06","0.01","90","","763.9","0.2","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C20 H12 N2 S2 -","- C20 H12 N2 S2 -","- C40 H24 N4 S4 -","2","0.5","SE1004","Mizuguchi, J.; Rihs, G.","Structure of 5,7,12,14-tetrahydroquinolino[2,3-<i>b</i>]acridine-7,14-dithione","Acta Crystallographica Section C","1992","48","8","1553","1555","10.1107/S0108270192004475","","","1.5418","CuKα","","","0.056","","","0.066","","","","","1.48","1.48","","","","warnings","has coordinates","249446","2020-10-21","18:00:00",""
"2000725","8.871","0.001","10.256","0.001","7.345","0.001","90","","117.27","0.01","90","","593.98","0.13","123","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C4 H5 Na O4 -","- C4 H5 Na O4 -","- C16 H20 Na4 O16 -","4","0.5","MU1014","Mallinson, P. R.; Frampton, C. S.","Structure of sodium hydrogen succinate at 123 K","Acta Crystallographica Section C","1992","48","8","1555","1556","10.1107/S0108270192006310","","","0.71069","MoKα","","","0.0276","","","0.0363","","","","","2.29","2.29","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000726","9.288","0.001","11.301","0.002","12.737","0.002","101.1","0.01","95.39","0.01","109.46","0.01","1218.8","0.3","293","","","","","","","","","","","3","P -1","-P 1","2","","","","- C58 H40 Se8 -","- C58 H40 Se8 -","- C58 H40 Se8 -","1","0.5","MU1012","MacNicol, D. D.; Mallinson, P. R.; Robertson, C. D.","Octakis(phenylseleno)naphthalene","Acta Crystallographica Section C","1992","48","8","1557","1558","10.1107/S0108270192006255","","","0.71069","MoKα","","","0.044","","","0.047","","","","","1.9","1.9","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000727","6.4253","0.0006","10.7241","0.0008","13.049","0.001","84.084","0.006","82.435","0.007","87.378","0.007","886.1","0.13","293","","293","","","","","","","","","5","P -1","-P 1","2","","δ-[3,4;3',4'-bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalenium] hexafluorophosphate","","- C10 H8 F6 P S8 -","- C10 H8 F6 P S8 -","- C20 H16 F12 P2 S16 -","2","1","CR1000","Bu, X.; Cisarova, I.; Coppens, P.","Structure of δ-(BEDT-TTF)PF~6~","Acta Crystallographica Section C","1992","48","8","1558","1560","10.1107/S0108270192005250","","","0.71073","MoKα","","","0.042","","","0.054","","","","","2.55","2.55","","","","","has coordinates","190435","2020-10-21","18:00:00",""
"2000728","14.744","0.001","6.676","0.002","32.151","0.003","90","","90","","90","","3164.7","1","293","","293","","","","","","","","","4","P c c a","-P 2a 2ac","54","","Di[3,4;3',4'-bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalenium] Dicyanamide","","- C22 H16 N3 S16 -","- C22 H16 N3 S16 -","- C88 H64 N12 S64 -","4","0.5","CR1001","Bu, X.; Coppens, P.; Lederle, B.; Naughton, M. J.","Structure of (BEDT-TTF)~2~N(CN)~2~","Acta Crystallographica Section C","1992","48","8","1560","1561","10.1107/S0108270192005262","","","0.71073","MoKα","","","0.077","","","0.125","","","","","5.05","5.05","","","","","has coordinates","190435","2020-10-21","18:00:00",""
"2000729","14.527","0.001","10.735","0.002","5.9233","0.0006","90","","105.559","0.008","90","","889.9","0.2","293","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","ε-[3,4;3',4'-bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalenium] hexafluorophosphate","","- C10 H8 F6 P S8 -","- C10 H8 F6 P S8 -","- C20 H16 F12 P2 S16 -","2","0.25","CR1002","Bu, X.; Cisarova, I.; Coppens, P.","Structure of {εpsilon}-(BEDT-TTF)PF~6~","Acta Crystallographica Section C","1992","48","8","1562","1563","10.1107/S0108270192005274","","","0.71073","MoKα","","","0.082","","","0.114","","","","","6.4","6.4","","","","","has coordinates","190435","2020-10-21","18:00:00",""
"2000730","8.293","0.001","6.703","0.001","33.02","0.008","90","","91.87","0.02","90","","1834.5","0.6","293","","293","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","ζ-di[3,4;3',4'-bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalenium] hexafluorophosphate","","- C24 H24 F6 O P S16 -","- C24 H24 F6 O2 P S16 -","- C48 H48 F12 O4 P2 S32 -","2","0.5","CR1003","Bu, X.; Cisarova, I.; Coppens, P.","Structure of ζ-(BEDT-TTF)~2~PF~6~.C~4~H~8~O~2~","Acta Crystallographica Section C","1992","48","8","1563","1565","10.1107/S0108270192005286","","","0.71073","MoKα","","","0.119","","","0.141","","","","","3.39","3.39","","","","","has coordinates","190435","2020-10-21","18:00:00",""
"2000731","8.892","0.001","15.627","0.002","17.84","0.002","66.169","0.009","79.791","0.009","85.81","0.009","2231.7","0.5","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H32 Hg2 I14 S32 -","- C40 H32 Hg2 I14 S32 -","- C40 H32 Hg2 I14 S32 -","1","0.5","CR1004","Bu, X.; Coppens, P.","Structure of (BEDT-TTF)~4~Hg~2~I~6~(I~8~)","Acta Crystallographica Section C","1992","48","8","1565","1566","10.1107/S0108270192005298","","","0.71073","MoKα","","","0.07","","","0.089","","","","","3.77","3.77","","","","","has coordinates","190435","2020-10-21","18:00:00",""
"2000732","9.181","0.003","14.841","0.006","11.598","0.004","90","","113.3","0.02","90","","1451.4","0.9","298","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C32 H34 Cl2 P2 Ru -","- C32 H34 Cl2 P2 Ru -","- C64 H68 Cl4 P4 Ru2 -","2","1","HA1005","Blake, A. J.; Easton, T.; Stephenson, T. A.","<i>cis</i>-Dichlorobis(1-butenyldiphenylphosphine)ruthenium(II)","Acta Crystallographica Section C","1992","48","8","1567","1568","10.1107/S0108270192004955","","","0.71073","MoKα","","","0.0583","","","0.0704","","","","","1.29","1.29","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000733","12.262","0.003","4.121","0.003","14.713","0.002","90","","90","","90","","743.5","0.6","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ba S4 Sm2 -","- Ba S4 Sm2 -","- Ba4 S16 Sm8 -","4","0.5","ST0546","Carpenter, J. D.; Hwu, S.-J.","Single-crystal structure of BaSm~2~S~4~","Acta Crystallographica Section C","1992","48","7","1164","1167","10.1107/S010827019101418X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2000735","5.598","0.002","15.292","0.009","5.532","0.002","90","","90","","90","","473.6","0.4","","","","","","","","","","","","3","A b a 2","A 2 -2ab","","","","","- Bi2 O5.5 V -","- Bi2 O6 V -","- Bi8 O24 V4 -","4","","DU0318","Touboul, M.; Lokaj, J.; Tessier, L.; Kettman, V.; Vrabel, V.","Structure of dibismuth vanadate Bi~2~VO~5.5~","Acta Crystallographica Section C","1992","48","7","1176","1179","10.1107/S010827019101421X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000736","6.51","0.001","6.51","0.001","6.51","0.001","89.47","0.02","89.47","0.02","89.47","0.02","275.86","0.07","","","","","","","","","","","","3","R -3","-P 3*","","","","","- Mo6 S8 Sn0.854 -","- Mo6 S8 Sn -","- Mo6 S8 Sn -","1","","CR0368","Le Lay, L.; Powell, D. R.; Willis, T. C.","Structure of Sn~0.854~Mo~6~S~8~","Acta Crystallographica Section C","1992","48","7","1179","1182","10.1107/S0108270191014609","","","0.71073","Mo","","","","","","","","","","","","","","","","warnings","has coordinates","249446","2020-10-21","18:00:00",""
"2000737","7.139","0.006","19.008","0.009","8.469","0.009","90","","90","","90","","1149.2","1.6","","","","","","","","","","","","4","P c 21 b","P -2bc -2c","","","","","- H La O6 Se2 -","- La O6 Se2 -","- La8 O48 Se16 -","8","2","CR0356","Morris, R.; Harrison, W. T. A.; Stucky, G. D.; Cheetham, A. K.","The synthesis and crystal structure of LaHSe~2~O~6~, a layered anhydrous selenite","Acta Crystallographica Section C","1992","48","7","1182","1185","10.1107/S0108270191014300","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000738","9.536","0.002","11.095","0.004","9.291","0.002","106.58","0.02","100.42","0.02","113.01","0.02","818.2","0.5","","","","","","","","","","","","4","P -1","-P 1","2","","","","- Al Br3 H18 O18 -","- Al Br3 H18 O18 -","- Al2 Br6 H36 O36 -","2","1","CR0351","Blackburn, A. C.; Gallucci, J. C.; Gerkin, R. E.","The structure of hexaaquaaluminium(III) bromate trihydrate, [Al(H~2~O)~6~](BrO~3~)~3~.3H~2~O","Acta Crystallographica Section C","1992","48","7","1185","1188","10.1107/S0108270191014804","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000739","9.227","0.003","10.599","0.003","11.089","0.002","74.01","0.02","67.36","0.02","77.02","0.02","953.5","0.5","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H54 Cl6 O22 Th2 -","- C12 H54 Cl6 O22 Th2 -","- C12 H54 Cl6 O22 Th2 -","1","0.5","CD0073","Rogers, R. D.; Bond, A. H.","Structure of [ThCl(OH)(OH~2~)~6~]~2~Cl~4~.18-crown-6.2H~2~O","Acta Crystallographica Section C","1992","48","7","1199","1201","10.1107/S0108270191014142","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000740","10.447","0.0006","13.947","0.002","11.296","0.003","90","","106.1","0.01","90","","1581.3","0.5","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 Cl2 K N2 O8 Ru -","- C10 H15 Cl2 K N2 O9 Ru -","- C40 H60 Cl8 K4 N8 O36 Ru4 -","4","1","HA0077","Taqui Khan, M. M.; Bhadbhade, M. M.; Venkatasubramanian, K.; Siddiqui, M. R. H.","Structure of potassium dichloro(ethylenediaminetetraacetato)ruthenate(III)","Acta Crystallographica Section C","1992","48","7","1202","1204","10.1107/S0108270191013999","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000741","9.11","0.004","22.472","0.009","21.01","0.01","90","","95.28","0.04","90","","4283","3","","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H20 Cl2 Co7 N O21 Si -","- C29 H20 Cl2 Co7 N O21 Si -","- C116 H80 Cl8 Co28 N4 O84 Si4 -","4","1","LI0098","Barris, G. C.; Mackay, K. M.; Nicholson, B. K.","Structure of tetraethylammonium nonacarbonyl-μ~3~-{[dichloro(undecacarbonylcobaltio)silyl]oxymethylidyne}-tricobaltate, [Et~4~N][Cl~2~SiCo~7~(CO)~21~]","Acta Crystallographica Section C","1992","48","7","1204","1207","10.1107/S0108270191013641","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000742","5.379","0.004","11.074","0.009","19.582","0.017","90","","90","","90","","1166.4","1.6","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C6 H18 N2 O6 V2 -","- C6 H18 N2 O6 V2 -","- C24 H72 N8 O24 V8 -","4","0.5","AB0238","Tyršelová, J.; Pavelčík, F.","Structure of 1,6-hexanediammonium metavanadate","Acta Crystallographica Section C","1992","48","7","1207","1209","10.1107/S0108270191014269","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000743","11.258","0.003","13.586","0.003","13.969","0.003","108.77","0.02","101.69","0.02","112.07","0.01","1742.6","0.9","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C35 H21 Au F15 O P -","- C35 H21 Au F15 O P -","- C70 H42 Au2 F30 O2 P2 -","2","1","HA0089","Jones, P. G.","[(Methyldiphenylphosphonio)methanide]tris(pentafluorophenyl)gold(III) acetone solvate","Acta Crystallographica Section C","1992","48","7","1209","1211","10.1107/S0108270191013914","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000744","8.53","0.002","11.928","0.001","12.118","0.003","90","","103.67","0.02","90","","1198","0.4","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C10 H38 Cl2 Co N2 O12 -","- C10 H38 Cl2 Co N2 O12 -","- C20 H76 Cl4 Co2 N4 O24 -","2","0.5","AS0565","Chen, X.-M.; Mak, T. C. W.","Structure of <i>trans</i>-tetraaquabis(trimethylammonioacetato)cobalt(II) dichloride tetrahydrate","Acta Crystallographica Section C","1992","48","7","1211","1214","10.1107/S0108270191014373","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2000745","8.014","0.004","13.66","0.007","18.023","0.007","90","","90","","90","","1973","1.6","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H26 Co N4 S2 -","- C17 H26 Co N4 S2 -","- C68 H104 Co4 N16 S8 -","4","1","HA0093","Jupp, K. M.; Raithby, P. R.","Structure of dithiocyanato[({-})-spartein]cobalt(II)","Acta Crystallographica Section C","1992","48","7","1214","1216","10.1107/S0108270191014439","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000746","8.794","0.003","20.333","0.007","4.247","0.002","90","","90","","90","","759.4","0.5","","","","","","","","","","","","5","P m n n","-P 2n 2","58","","","","- C10 H4 Ag N2 S8 -","- C10 H4 Ag N2 S8 -","- C20 H8 Ag2 N4 S16 -","2","0.25","ST0531","Morosin, B.; Nigrey, P. J.","Structure of bis(methylenedithio)tetrathiafulvalene dicyanoargentate(I)","Acta Crystallographica Section C","1992","48","7","1216","1218","10.1107/S0108270191014282","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206034","2020-10-21","18:00:00",""
"2000747","7.538","0.001","7.416","0.003","30.803","0.004","90","","90","","90","","1722","1","","","","","","","","","","","","5","A e m a","-A 2ab 2ab","64","","","","- C8 H24 Cd Cl4 N2 -","- C8 Cd Cl4 N2 -","- C32 Cd4 Cl16 N8 -","4","0.25","MU0240","Doudin, B.; Chapuis, G.","Structure of bis(<i>n</i>-butylammonium) tetrachlorocadmate(II)","Acta Crystallographica Section C","1992","48","7","1218","1220","10.1107/S010827019101452X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208233","2020-10-21","18:00:00",""
"2000748","7.538","0.001","7.416","0.003","30.803","0.004","90","","90","","90","","1722","1","","","","","","","","","","","","5","A e m a","-A 2ab 2ab","64","","","","- C8 H24 Cd Cl4 N2 -","- C16 Cd Cl4 N4 -","- C64 Cd4 Cl16 N16 -","4","0.25","MU0240","Doudin, B.; Chapuis, G.","Structure of bis(<i>n</i>-butylammonium) tetrachlorocadmate(II)","Acta Crystallographica Section C","1992","48","7","1218","1220","10.1107/S010827019101452X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208233","2020-10-21","18:00:00",""
"2000749","10.081","0.004","13.339","0.004","15.083","0.003","85.24","0.04","82.673","0.005","67.37","0.04","1855.5","1.1","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C45 H57 Cl U -","- C45 H57 Cl U -","- C90 H114 Cl2 U2 -","2","1","AB0235","Spirlet, M. R.; Rebizant, J.; Bettonville, S.; Goffart, J.","Structure of chlorotris(1,2,4,5,6,7-hexamethylindenyl)uranium(IV)","Acta Crystallographica Section C","1992","48","7","1221","1223","10.1107/S0108270191014592","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000750","21.37","0.02","22.04","0.01","8.66","0.01","90","","90","","90","","4079","6","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H44 Ba2 N10 O28 P2 -","- C20 H44 Ba2 N10 O28 P2 -","- C80 H176 Ba8 N40 O112 P8 -","4","1","SE0083","Churchill, M. E. A.; Pritchard, R. G.; Helliwell, M.","Structure of barium guanosine 5'-monophosphate","Acta Crystallographica Section C","1992","48","7","1223","1227","10.1107/S0108270192001136","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000752","12.413","0.003","14.645","0.003","12.287","0.002","90","","90","","90","","2233.6","0.8","","","","","","","","","","","","6","P b c n","","","","","","- C20 H16 Cl2 Cu N4 O8 -","- C20 H16 Cl2 Cu N4 O8 -","- C80 H64 Cl8 Cu4 N16 O32 -","4","0.5","AS0546","Chen, C.; Xu, D.; Xu, Y.; Cheng, C.; Ling, R.","Structure of <i>catena</i>-poly[{(2,2'-bipyridyl)(diperchlorato)copper(II)}-μ-4,4'-bipyridyl]","Acta Crystallographica Section C","1992","48","7","1231","1233","10.1107/S0108270191014361","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000753","6.7","0.001","20.911","0.009","9.609","0.002","90","","104.24","0.02","90","","1304.9","0.7","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C16 H36 F12 N2 O4 P2 -","- C16 H36 F28 N2 O4 P2 -","- C32 H72 F56 N4 O8 P4 -","2","0.5","GE0275","Suwińska, K.","Structure of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethyldiazonia-18-crown-6 with PF^{-^}~6~ and I^{-^} as the counterions","Acta Crystallographica Section C","1992","48","7","1234","1237","10.1107/S0108270191013690","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000754","6.482","0.001","16.932","0.002","10.871","0.001","90","","106.63","0.02","90","","1143.2","0.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H36 I2 N2 O4 -","- C16 H36 I2 N2 O4 -","- C32 H72 I4 N4 O8 -","2","0.5","GE0275","Suwińska, K.","Structure of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethyldiazonia-18-crown-6 with PF^{-^}~6~ and I^{-^} as the counterions","Acta Crystallographica Section C","1992","48","7","1234","1237","10.1107/S0108270191013690","","","0.71078","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000755","13.602","0.001","14.477","0.002","6.969","0.001","90","","90","","90","","1372.3","0.3","","","","","","","","","","","","4","P c a b","-P 2bc 2ac","61","","2,4-dioxido-1,2,3,4-benzotetrazine-2,4-diium","","- C6 H4 N4 O2 -","- C6 H4 N4 O2 -","- C48 H32 N32 O16 -","8","1","AS0556","Yamaguchi, K.; Takahashi, H.; Kaihoh, T.; Itoh, T.; Okada, M.; Nagata, K.; Matsumura, G.; Ohsawa, A.","Structure of benzo-1,2,3,4-tetrazine 1,3-dioxide","Acta Crystallographica Section C","1992","48","7","1237","1239","10.1107/S0108270191013781","","","1.5405","Cu","","","","","","","","","","","","","","","","","has coordinates","205890","2020-10-21","18:00:00",""
"2000756","9.385","0.004","12.314","0.004","18.573","0.006","90","","90","","90","","2146.4","1.3","","","","","","","","","","","","4","P b n 21","P 2c -2ab","33","","N-benzyl-3-benzylidene-4-methyl-4-nitro-5-phenyl-2-pyrrolidinone","","- C25 H22 N2 O3 -","- C25 H22 N2 O3 -","- C100 H88 N8 O12 -","4","1","HE0036","Mostafa, G.; Mukherjee, M.; Ray, S.","Structure of <i>N</i>-benzyl-3-benzylidene-4-methyl-4-nitro-5-phenyl-2-pyrrolidinone","Acta Crystallographica Section C","1992","48","7","1241","1243","10.1107/S0108270191013975","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","206332","2020-10-21","18:00:00",""
"2000757","7.961","0.005","11.863","0.006","24.873","0.008","90","","92.29","0.01","90","","2347","2","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H28 N2 O4 -","- C27 H28 N2 O4 -","- C108 H112 N8 O16 -","4","1","PA0228","Warin, V.; Lamiot, J.; Baert, F.; Ait Mansour, H.; Houssin, R.; Lesieur, D.","Structure of 6-benzyl-5-(3,4-dimethoxybenzyl)-3-methyl-5,6,7,8-tetrahydro-3<i>H</i>-oxazolo[5,4-<i>g</i>]isoquinolin-2-one","Acta Crystallographica Section C","1992","48","7","1243","1246","10.1107/S0108270191013720","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000758","16.454","0.003","17.353","0.003","17.674","0.001","90","","90","","90","","5046.4","1.3","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C25 H27 N5 Si -","- C25 H27 N5 Si -","- C200 H216 N40 Si8 -","8","1","HA0095","Whitby, R. J.; Webster, M.; Dennehy, R. D.","Structure of 6-(<i>tert</i>-butylimino)-4,4,5,5-tetracyano-3-(1-phenylethylidene)-1-(trimethylsilyl)cyclohex-1-ene","Acta Crystallographica Section C","1992","48","7","1252","1253","10.1107/S0108270191014464","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000759","11.2191","0.0004","15.9824","0.0005","17.7311","0.0007","90","","90","","90","","3179.3","0.2","","","","","","","","","","","","4","C m c 21","C 2c -2","","","","","- C32 H46 N4 O8 -","- C32 H48 N4 O8 -","- C128 H192 N16 O32 -","4","0.5","GE0295","Kanters, J. A.; Schouten, A.; Kroon, J.; Grech, E.","Complexes of the `proton sponge' 1,8-bis(dimethylamino)naphthalene (DMAN). IV. Structure of [DMANH]~2~^+^.[squarate]^2{-^} tetrahydrate at 100 K","Acta Crystallographica Section C","1992","48","7","1254","1257","10.1107/S0108270191014348","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000760","8.63","0.001","9.908","0.004","13.549","0.016","107.73","0.03","94.96","0.05","112.51","0.03","991.9","1.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H19 N O3 -","- C26 H19 N O3 -","- C52 H38 N2 O6 -","2","1","HA0079","Hursthouse, M. B.; Karaulov, A. I.; Ciechanowicz-Rutkowska, M.; Kolasa, A.; Zankowska-Jasińska, W.","Structure of 3-benzoyl-4-methyl-1-phenyl-1,2,3,4-tetrahydro-5<i>H</i>-indeno[1,2-<i>b</i>]pyridine-2,5-dione","Acta Crystallographica Section C","1992","48","7","1257","1260","10.1107/S0108270191014476","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000761","6.756","0.002","13.012","0.004","10.931","0.004","90","","91.5","0.02","90","","960.6","0.5","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H9 B2 Br N4 -","- C6 H8 B2 Br N4 -","- C24 H32 B8 Br4 N16 -","4","1","CR0390","Hodgkins, T. G.; Powell, D. R.","Structure of 4-bromopyrazabole","Acta Crystallographica Section C","1992","48","7","1260","1262","10.1107/S0108270191013872","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000762","12.456","0.002","6.735","0.004","16.135","0.003","90","","92.17","0.01","90","","1352.6","0.9","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C18 H15 N O3 -","- C18 H15 N O3 -","- C72 H60 N4 O12 -","4","1","GE0291","Kaufmann, M.; Berger, D.; Härter, R.; Hirschi, D.; Bürgi, H.-B.; Raselli, A.; Röhr, C.","Structure of 1-morpholinoanthraquinone at 110 K","Acta Crystallographica Section C","1992","48","7","1262","1265","10.1107/S0108270191014336","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000763","11.782","0.002","9.058","0.002","9.766","0.002","90","","109.3","0.01","90","","983.7","0.3","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H28 N2 O8 S2 -","- C14 H28 N2 O8 S2 -","- C28 H56 N4 O16 S4 -","2","0.5","BX0561","Paulus, E. F.; Porz, C.","Structure of <i>meso</i>-(<i>R</i>,<i>R</i>,<i>S</i>,<i>S</i>)-<i>trans</i>-4,5,4',5'-tetrahydroxy-2,2'-bi(1,3-thiaoxolane)-dimethylacetamide (1:2)","Acta Crystallographica Section C","1992","48","7","1267","1269","10.1107/S0108270191014683","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000764","13.391","0.002","28.817","0.003","6.667","0.002","90","","97.256","0.017","90","","2552.1","0.9","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H37 N O3 -","- C32 H2 N O3 -","- C128 H8 N4 O12 -","4","1","CR0359","Luss, H. R.; Texter, J.","Structure of <i>N</i>-{2-[2,4-bis(1,1-dimethylpropyl)phenoxy]ethyl}-1-hydroxy-2-naphthalenecarboxamide","Acta Crystallographica Section C","1992","48","7","1269","1272","10.1107/S0108270191013847","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000765","19.307","0.003","19.307","0.003","26.735","0.004","90","","90","","120","","8631","2","","","","","","","","","","","","3","R -3 :H","-R 3","","","","","- C19 H16 O -","- C38 H30 O2 -","- C912 H720 O48 -","24","1.33333","MU0292","Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Low, J. N.; Scrimgeour, S. N.","The structure of triphenylmethanol, Ph~3~COH","Acta Crystallographica Section C","1992","48","7","1272","1275","10.1107/S0108270191015044","","","0.71073","Mo","","","","","","","","","","","","","","","","warnings","has coordinates","249444","2020-10-21","18:00:00",""
"2000766","13.82","0.002","6.205","0.001","17.55","0.003","90","","106.06","0.01","90","","1446.2","0.4","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C12 H20 I N O2 -","- C12 H20 I N O2 -","- C48 H80 I4 N4 O8 -","4","1","CD0061","Friesen, R. W.; Kolaczewska, A. E.; Lough, A. J.","<i>trans</i>-5-(<i>n</i>-Heptyl)-4-(1-iodovinyl)-2-oxazolidinone and <i>syn</i>-[4-cyclohexyl-2-iodo-3-(<i>N</i>-tosylamino)-1-buten-4-yl] acetate","Acta Crystallographica Section C","1992","48","7","1275","1279","10.1107/S0108270191014130","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","190730","2020-10-21","18:00:00",""
"2000767","12.233","0.003","13.733","0.003","14.169","0.006","90","","112.75","0.03","90","","2195.1","1.3","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","","","","","- C19 H26 I N O4 S -","- C19 H26 I N O4 S -","- C76 H104 I4 N4 O16 S4 -","4","1","CD0061","Friesen, R. W.; Kolaczewska, A. E.; Lough, A. J.","<i>trans</i>-5-(<i>n</i>-Heptyl)-4-(1-iodovinyl)-2-oxazolidinone and <i>syn</i>-[4-cyclohexyl-2-iodo-3-(<i>N</i>-tosylamino)-1-buten-4-yl] acetate","Acta Crystallographica Section C","1992","48","7","1275","1279","10.1107/S0108270191014130","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","190713","2020-10-21","18:00:00",""
"2000768","7.527","0.001","9.157","0.001","9.988","0.001","96.39","0.01","110.4","0.01","93.24","0.01","637.87","0.14","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H30 N4 O2 S2 -","- C28 H30 N4 O2 S2 -","- C28 H30 N4 O2 S2 -","1","0.5","BX0570","Mizuguchi, J.; Rihs, G.","Structures of complexes of 2,3,3a,5,6,6a-hexahydro-3,6-diphenyl-1<i>H</i>,4<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dithione with <i>N</i>-methyl-2-pyrrolidone and dimethyl sulfoxide","Acta Crystallographica Section C","1992","48","7","1279","1283","10.1107/S0108270191014701","","","0.70926","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000769","12.674","0.001","10.318","0.001","8.761","0.001","90","","100.32","0.01","90","","1127.14","0.19","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C22 H24 N2 O2 S4 -","- C22 H24 N2 O2 S4 -","- C44 H48 N4 O4 S8 -","2","0.5","BX0570","Mizuguchi, J.; Rihs, G.","Structures of complexes of 2,3,3a,5,6,6a-hexahydro-3,6-diphenyl-1<i>H</i>,4<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dithione with <i>N</i>-methyl-2-pyrrolidone and dimethyl sulfoxide","Acta Crystallographica Section C","1992","48","7","1279","1283","10.1107/S0108270191014701","","","0.70926","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000770","23.08","0.03","7.842","0.003","28.081","0.013","90","","105.97","0.07","90","","4886","7","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C6 H2 Br2 N2 O2 -","- C6 H2 Br2 N2 O2 -","- C144 H48 Br48 N48 O48 -","24","3","CR0354","Britton, D.","The crystal packing of 4,7-dibromobenzofurazan 1-oxide","Acta Crystallographica Section C","1992","48","7","1283","1285","10.1107/S0108270191014774","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000771","6.105","0.002","16.634","0.003","14.356","0.003","90","","90","","90","","1457.9","0.6","","","","","","","","","","","","4","P b c n","","","","","","- C18 H15 F2 P -","- C18 H15 F2 P -","- C72 H60 F8 P4 -","4","0.5","HH0563","Doxsee, K. M.; Hanawalt, E. M.; Weakley, T. J. R.","Structure of difluorotriphenylphosphorane","Acta Crystallographica Section C","1992","48","7","1288","1290","10.1107/S0108270191014889","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000772","13.561","0.004","6.598","0.001","14.108","0.004","90","","118.37","0.02","90","","1110.7","0.5","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C13 H14 O3 -","- C13 H14 O3 -","- C52 H56 O12 -","4","1","HH0572","Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Lu, S.-P.","Three substituted hexahydro-5,8-dimethanonaphthalenes","Acta Crystallographica Section C","1992","48","7","1290","1294","10.1107/S0108270191014877","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000773","6.556","0.002","25.739","0.01","7.436","0.005","90","","111.25","0.04","90","","1169.5","1","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 Br2 O2 -","- C12 H10 Br2 O2 -","- C48 H40 Br8 O8 -","4","1","HH0572","Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Lu, S.-P.","Three substituted hexahydro-5,8-dimethanonaphthalenes","Acta Crystallographica Section C","1992","48","7","1290","1294","10.1107/S0108270191014877","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000774","10.827","0.004","8.395","0.002","12.997","0.002","90","","105.34","0.02","90","","1139.2","0.5","","","","","","","","","","","","3","C 1 c 1","C -2yc","","","","","- C13 H16 O3 -","- C13 H16 O3 -","- C52 H64 O12 -","4","1","HH0572","Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Lu, S.-P.","Three substituted hexahydro-5,8-dimethanonaphthalenes","Acta Crystallographica Section C","1992","48","7","1290","1294","10.1107/S0108270191014877","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000775","8.604","0.002","14.29","0.004","24.924","0.004","90","","90","","90","","3064.4","1.2","","","","","","","","","","","","6","P b c a","","","","","","- C14 H10 F3 N3 O2 S -","- C14 H10 F3 N3 O2 S -","- C112 H80 F24 N24 O16 S8 -","8","1","CR0380","Wang, X.; Deng, R.; Wu, J.; Chen, Z.","Structure of 2-thionyltrifluoroacetone isonicotinyl hydrazone","Acta Crystallographica Section C","1992","48","7","1295","1297","10.1107/S0108270191014762","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000776","7.44","0.002","7.44","0.002","16.097","0.006","90","","90","","90","","891","0.5","","","","","","","","","","","","4","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- Ba Cu O10 Si4 -","- Ba2 Cu4 O10 Si4 -","- Ba8 Cu16 O40 Si16 -","4","0.25","BX0572","Lin, H. C.; Liao, F. L.; Wang, S. L.","Structure of BaCuSi~4~O~10~","Acta Crystallographica Section C","1992","48","7","1297","1299","10.1107/S0108270192001203","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176343","2020-10-21","18:00:00",""
"2000777","7.447","0.001","7.447","0.001","16.138","0.002","90","","90","","90","","895","0.2","","","","","","","","","","","","4","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- Ba Cu O10 Si4 -","- Ba Cu O10 Si4 -","- Ba4 Cu4 O40 Si16 -","4","0.25","AB0258","Janczak, J.; Kubiak, R.","Refinement of the structure of barium copper silicate BaCu[Si~4~O~10~] at 300 K","Acta Crystallographica Section C","1992","48","7","1299","1301","10.1107/S0108270191014580","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176343","2020-10-21","18:00:00",""
"2000778","4.41","0.002","4.41","0.002","24.27","0.02","90","","90","","120","","408.8","0.4","","","","","","","","","","","","3","R -3 m","-R 3 2""","","","","","- Er K Te2 -","- Er K Te2 -","- Er3 K3 Te6 -","3","","ST0551","Keane, P. M.; Ibers, J. A.","Structure of KErTe~2~","Acta Crystallographica Section C","1992","48","7","1301","1303","10.1107/S0108270191014208","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000779","14.902","0.001","10.815","0.004","14.941","0.001","90","","103.29","0.01","90","","2343.5","0.9","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H29 I N2 Pt -","- C26 H29 I N2 Pt -","- C104 H116 I4 N8 Pt4 -","4","1","GE0287","Smeets, W. J. J.; Spek, A. L.; van Beek, J. A. M.; van Koten, G.","Structure of {<i>ad</i>,<i>be</i>-bis[(8-dimethylamino-κ<i>N</i>)naphthyl-κ<i>C</i>^1^]}-<i>f</i>-ethyl-<i>c</i>-iodoplatinum(IV)","Acta Crystallographica Section C","1992","48","7","1303","1305","10.1107/S0108270192001616","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000780","12.252","0.003","9.176","0.002","11.974","0.008","90","","115.06","0.03","90","","1219.4","1","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","","","","","- C12 H32 Cl8 N4 O2 Os -","- C12 H32 Cl8 N4 O2 Os -","- C24 H64 Cl16 N8 O4 Os2 -","2","0.5","AB0247","Arrieta, J. M.; Germain, G.; Vlassi, M.; Craciunescu, D. G.; Parrondo Iglesias, E.; Debaerdemaeker, T.","Bis[2-(2-hydroxyethyl)piperazinium] hexachloroosmate(IV) dichloride","Acta Crystallographica Section C","1992","48","7","1305","1307","10.1107/S0108270191014117","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2000781","8.545","0.003","3.8691","0.001","12.692","0.004","90","","90","","90","","419.6","0.2","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C2 H3 Cl Cu N -","- C2 H3 Cl Cu N -","- C8 H12 Cl4 Cu4 N4 -","4","0.5","HA0086","Jones, P. G.","Redetermination of the structure of (acetonitrile)chlorocopper(I) [(H~3~CCN)CuCl] at 178 K","Acta Crystallographica Section C","1992","48","7","1307","1308","10.1107/S0108270191013926","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2000782","7.674","0.002","11.113","0.003","13.346","0.004","71.64","0.02","79.49","0.02","86.62","0.02","1062.1","0.5","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H32 O4 Sn -","- C20 H36 O4 Sn -","- C40 H72 O8 Sn2 -","2","1","CD0062","Bélanger-Gariépy, F.; Léger, R.; Hanessian, S.","Structure of a bicyclic organostannane resulting from a trimethyltin hydride addition-cyclization reaction","Acta Crystallographica Section C","1992","48","7","1309","1310","10.1107/S0108270191013793","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000783","21.817","0.003","21.817","0.003","30.658","0.005","90","","90","","90","","17759","5","","","","","","","","","","","","6","I -4 2 d","I -4 2bw","","","","","- C65 H69 F12 N4 P10 Rh2 -","- C65 H69 F12 N4 P6 Rh2 -","- C520 H552 F96 N32 P48 Rh16 -","8","0.5","CR0383","Tortorelli, L. J.; Woods, C.; Campana, C. F.","Structure of the mixed-valence complex [Rh~2~(μ-{(C~6~H~5~)~2~PCH~2~P(C~6~H~5~)~2~})~2~(μ-N~2~C~5~H~7~)(<i>tert</i>-C~4~H~9~NC)~2~](PF~6~)~2~","Acta Crystallographica Section C","1992","48","7","1311","1312","10.1107/S0108270191014294","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","203310","2020-10-21","18:00:00",""
"2000784","14.141","0.004","20.209","0.005","14.207","0.004","90","","95.85","0.03","90","","4038.9","1.9","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H22 Au2 F10 P2 -","- C37 H22 Au2 F10 P2 -","- C148 H88 Au8 F40 P8 -","4","1","HA0092","Jones, P. G.; Thöne, C.","μ-[Bis(diphenylphosphino)methane]-bis[pentafluorophenylgold(I)] at 178 K","Acta Crystallographica Section C","1992","48","7","1312","1314","10.1107/S0108270191014518","","","0.71069","monoclinic","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000785","8.5402","0.0014","10.0286","0.0016","10.584","0.002","110.221","0.01","95.476","0.01","93.42","0.012","842.6","0.3","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C26 H28 Ag2 Cu I4 N4 O2 -","- C26 H28 Ag2 Cu I4 N4 O2 -","- C26 H28 Ag2 Cu I4 N4 O2 -","1","0.5","HA0094","Jones, P. G.","Bis[1,1-di(2-pyridyl)ethyl methyl ether-<i>N</i>,<i>N</i>',<i>O</i>]copper(II) di-μ-iodo-bis[iodoargentate(I)]","Acta Crystallographica Section C","1992","48","7","1314","1315","10.1107/S0108270191014506","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000786","10.2","0.02","13.55","0.04","7.98","0.01","90.7","0.2","99.7","0.2","105.1","0.2","1048","4","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H16 Cl Cu N5 O5 -","- C21 H16 Cl Cu N5 O5 -","- C42 H32 Cl2 Cu2 N10 O10 -","2","1","AL0480","McAuliffe, C. A.; Pritchard, R. G.; Bermejo, M. R.; Garcia-Vazquez, A.; Macias, A.; Sanmartín, J.; Romero, J.; Sousa, A.","Bis(2,2'-bipyridine)isocyanatocopper(II) perchlorate","Acta Crystallographica Section C","1992","48","7","1316","1317","10.1107/S010827019101449X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000787","11.268","0.003","12.815","0.003","13.72","0.004","107.37","0.01","98.15","0.02","110.42","0.01","1703.7","0.8","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H22 N5 O2 -","- C17 H22 N5 O1.5 -","- C68 H88 N20 O6 -","4","2","PA0256","Dupont, L.; Englebert, S.; Dideberg, O.; Liégeois, J. F.; Delarge, J.","Structure du 6-(4-méthylpipérazin-1-yl)-11<i>H</i>-pyrido[2,3-<i>b</i>][1,4]benzodiazépine 1,5-hydrate","Acta Crystallographica Section C","1992","48","7","1322","1324","10.1107/S0108270191013744","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000788","5.63","0.001","9.341","0.002","15.531","0.003","90","","98.4","0.01","90","","808","0.3","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C11 H8 O2 -","- C11 H8 O2 -","- C44 H32 O8 -","4","1","AL0517","Maniukiewicz, W.; Bukowska-Strzyżewska, M.","Structure of 2-hydroxy-1-naphthaldehyde","Acta Crystallographica Section C","1992","48","7","1324","1326","10.1107/S0108270191013628","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000789","9.149","0.002","10.934","0.001","12.064","0.001","90","","93.14","0.01","90","","1205","0.3","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C10 H18 N2 O3 -","- C10 H18 N2 O3 -","- C40 H72 N8 O12 -","4","1","AS0509","Okabe, N.; Tatsumi, M.; Sasaki, Y.","Structure of <small>DL</small>-desthiobiotin","Acta Crystallographica Section C","1992","48","7","1326","1327","10.1107/S010827019101380X","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000790","12.301","0.003","13.3","0.004","10.817","0.003","90","","110.94","0.02","90","","1652.8","0.8","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C16 H14 Cl N3 O5 -","- C16 H14 Cl N3 O5 -","- C64 H56 Cl4 N12 O20 -","4","1","CR0377","Boggess, R. K.","Monoprotonated perchlorate salt of tris(2-pyridyl)methanol","Acta Crystallographica Section C","1992","48","7","1327","1329","10.1107/S0108270191013860","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000791","10.936","0.002","8.846","0.001","14.6","0.003","89.08","0.02","105.16","0.02","100.12","0.02","1341.4","0.4","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H33 N3 O5 -","- C30 H33 N3 O5 -","- C60 H66 N6 O10 -","2","1","PA0252","Theobald, F.; Rodier, N.; Moustaid, K.; Nguyen Dinh An; Laude, B.","Structure of ethyl 1-<i>p</i>-anisyl-7,8-dimethoxy-4,5-dimethyl-3-phenyl-3a,4,5,9b-tetrahydropyrazolo[3,4-<i>c</i>]isoquinoline-3a-carboxylate","Acta Crystallographica Section C","1992","48","7","1329","1331","10.1107/S0108270191013719","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000792","5.4732","","8.6274","","19.4255","","90","","90","","90","","917.262","","","","","","","","","","","","","5","P b c 21","P 2c -2b","29","","N-benzylmethanesulfonamide","","- C8 H11 N O2 S -","- C8 H11 N O2 S -","- C32 H44 N4 O8 S4 -","4","1","HA0085","Elmore, D. T.; Jones, J. H.; Raissi, M.; Prout, K.","<i>N</i>-Benzylmethanesulfonamide","Acta Crystallographica Section C","1992","48","7","1331","1333","10.1107/S0108270191013987","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","205890","2020-10-21","18:00:00",""
"2000793","9.203","0.003","9.81","0.03","12.705","0.006","90","","90","","90","","1147","4","","","","","","","","","","","","3","P b c a","","","","","","- C10 H2 F12 -","- C10 H2 F12 -","- C40 H8 F48 -","4","0.5","ST0561","Lynch, V. M.; Kampa, J. J.; Lagow, R. J.; Davis, B. E.","Structure of 1,2,4,5-tetrakis(trifluoromethyl)benzene","Acta Crystallographica Section C","1992","48","7","1339","1341","10.1107/S0108270191013963","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000794","20.301","0.005","8.952","0.002","14.707","0.006","90","","90","","90","","2672.8","1.4","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C12 H16 O5 S -","- C12 H16 O5 S -","- C96 H128 O40 S8 -","8","1","AB0261","Frydenvang, K.; Jensen, B.","Structure of <i>cis</i>-2-methyl-4-tosyloxymethyl-1,3-dioxolane","Acta Crystallographica Section C","1992","48","7","1341","1343","10.1107/S0108270191014622","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000795","6.7895","0.0009","22.054","0.002","9.713","0.001","90","","103.5","0.01","90","","1414.2","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H16 N4 O8 -","- C11 H16 N4 O8 -","- C44 H64 N16 O32 -","4","1","AB0260","Frydenvang, K.; Jensen, B.; Nielsen, K.","Structure of choline picrate","Acta Crystallographica Section C","1992","48","7","1343","1345","10.1107/S0108270191014610","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000796","15.603","0.003","13.7397","0.0006","23.717","0.005","90","","90.28","0.015","90","","5084.4","1.5","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H15 Cl10 N3 O2 -","- C17 H15 Cl10 N3 O2 -","- C136 H120 Cl80 N24 O16 -","8","2","GE0296","Kanters, J. A.; ter Horst, E. H.; Grech, E.","Structure of [<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylguanidinium(1+) pentachlorophenolate(1-) pentachlorophenol]~2~","Acta Crystallographica Section C","1992","48","7","1345","1347","10.1107/S010827019101435X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000797","7.825","0.001","14.254","0.001","18.91","0.002","90","","90","","90","","2109.2","0.4","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","ent-3α,11b-Diacetoxy-2β-hydroxy-16-oxo-17,20-dinor-9α,15α- cyclogibberell- 1(10)-ene-7,19-dioic Acid 7-Methyl Ester 19,2-Lactone","","- C23 H24 O9 -","- C23 H24 O9 -","- C92 H96 O36 -","4","1","HL1000","Furber, M.; Mander, L. N.; Patrick, G. L.; Willis, A. C.","A 9,5-cyclogibberellin formed from a bromogibberellin-16-one derivative","Acta Crystallographica Section C","1992","48","7","1348","1350","10.1107/S0108270192003767","","","0.71069","MoKαradiation","","0.059","0.04","","0.056","0.048","","","","1.352","1.419","1.419","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000798","6.292","0.001","12.329","0.001","9.233","0.001","90","","105.91","0.01","90","","688.8","0.15","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- F2 H20 N2 Ni O12 P2 -","- F2 H20 N2 Ni O12 P2 -","- F4 H40 N4 Ni2 O24 P4 -","2","0.5","AL1003","Berraho, M.; R'Kha, C.; Vegas, A.; Rafiq, M.","Structure of Ni(H~2~O)~6~(NH~4~)~2~(PO~3~F)~2~","Acta Crystallographica Section C","1992","48","7","1350","1352","10.1107/S0108270192003044","","","0.7107","MoKα","","","0.03","","","0.034","","","","","0.996","0.996","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000799","8.767","0.001","7.117","0.002","7.26","0.002","90","","110.23","0.02","90","","425.04","0.18","293","","293","","","","","","","","","4","P 1 n 1","P -2yac","7","","(±)-cis-6-Acetylamino-5-hydroxy-1,3-dioxepane","","- C7 H13 N O4 -","- C7 H13 N O4 -","- C14 H26 N2 O8 -","2","1","AB1006","Vinković, M.; Dumić, M.; Kamenar, B.","(±)-<i>cis</i>-6-Acetylamino-5-hydroxy-1,3-dioxepane","Acta Crystallographica Section C","1992","48","7","1352","1354","10.1107/S0108270192003755","","","0.7101","MoKα","","0.036","0.032","","0.045","0.041","","","","0.7691","0.7693","0.7693","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000800","8.86","0.008","11.007","0.002","16.316","0.004","90","","90","","90","","1591.2","1.5","293","","","","","","","","","","","5","P n n 2","P 2 -2n","","","","","- C14 H11 Fe N2 O10 -","- C14 H11 Fe N2 O10 -","- C56 H44 Fe4 N8 O40 -","4","1","DU1001","Cousson, A.; Nectoux, F.; Rizkalla, E. N.","Structure of bis(dipicolinato)ferrate(III) dihydrate","Acta Crystallographica Section C","1992","48","7","1354","1357","10.1107/S0108270192002877","","","0.71069","MoKα","","","0.041","","","0.04","","","","","2.15","2.15","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000801","5.135","0.001","5.135","0.001","33.882","0.005","90","","90","","90","","893.4","0.4","293","","","","","","","","","","","5","I 41/a","-I 4ad","","","","","- As Ca2 O12 W2 Y -","- As Ca2 O12 W2 Y -","- As4 Ca8 O48 W8 Y4 -","4","","NA1005","Demartin, F.; Gramaccioli, C. M.; Pilati, T.","Structure of a new natural tungstate arsenate, [Ca~2~Y(AsO~4~)(WO~4~)~2~], structurally related to scheelite","Acta Crystallographica Section C","1992","48","7","1357","1359","10.1107/S0108270192003688","","","0.71073","MoKα","","","0.024","","","0.027","","","","","1.104","1.104","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000802","10.928","0.004","37.398","0.004","6.139","0.004","90","","90","","90","","2508.9","1.9","297","","297","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","16-(p-butoxybenzylidene)androsta-1,4-diene-3,17-dione","","- C30 H36 O3 -","- C30 H36 O3 -","- C120 H144 O12 -","4","1","HL1004","Ogawa, K.; Yoshimura, S.; Kaji, M.; Kagawa, H.; Kakuta, A.","16-(<i>p</i>-Butoxybenzylidene)androsta-1,4-diene-3,17-dione","Acta Crystallographica Section C","1992","48","7","1359","1361","10.1107/S0108270192003925","","","1.54184","","","0.057","0.05","","0.059","0.058","","","","2.441","2.58","2.58","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000803","19.72","0.009","7.703","0.003","7.753","0.003","90","","96.57","0.04","90","","1170","0.8","178","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C4 Ag2 N4 S4 Zn -","- C4 Ag2 N4 S4 Zn -","- C16 Ag8 N16 S16 Zn4 -","4","0.5","HA1006","Jones, P. G.; Bembenek, E.","Redetermination of the structure of zinc disilver(I) tetrathiocyanate (at 178 K)","Acta Crystallographica Section C","1992","48","7","1361","1362","10.1107/S0108270192003986","","","0.71069","MoKα","","","0.026","","","0.03","","","","","1.6","1.6","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000804","28.795","0.003","8.887","0.001","12.139","0.001","90","","103.17","0.01","90","","3024.7","0.5","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(tert-butyl)-cis-5-(p-chlorophenylthio)-trans-5-methyl-1,3-dioxolan-4-one","","- C14 H17 Cl O3 S -","- C14 H17 Cl O3 S -","- C112 H136 Cl8 O24 S8 -","8","1","HL1010","Beckwith, A. L. J.; Chai, C. L. L.; Willis, A. C.","2-(<i>tert</i>-Butyl)-<i>cis</i>-5-(<i>p</i>-chlorophenylthio)-<i>trans</i>-5-methyl-1,3-dioxolan-4-one","Acta Crystallographica Section C","1992","48","7","1362","1364","10.1107/S0108270192004165","","","0.71069","molybdenumKα","","0.061","0.031","","0.047","0.039","","","","1.258","1.311","1.311","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2000805","7.651","0.002","21.79","0.01","6.689","0.002","90","","113.85","0.03","90","","1020","1","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- H16 N2 O13 P2 Te -","- H13 N2 O10 P2 Te0.5 -","- H52 N8 O40 P8 Te2 -","4","1","PA0258","Averbuch-Pouchot, M. T.; Durif, A.","Structure of an adduct between diammonium dihydrogendiphoshate and telluric acid: (NH~4~)~2~H~2~P~2~O~7~.Te(OH)~6~","Acta Crystallographica Section C","1992","48","6","973","975","10.1107/S0108270191013604","","","0.5608","Ag","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000806","5.616","0.002","10.062","0.001","8.727","0.001","90","","90.9","0.02","90","","493.09","0.19","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- Ba O6 P V -","- Ba O6 P V -","- Ba4 O24 P4 V4 -","4","1","BR0009","Kang, H. Y.; Wang, S. L.; Lii, K. H.","Hydrothermal synthesis and structures of two layered dioxovanadium(V) phosphates <i>A</i>(VO~2~)PO~4~ (<i>A</i> = Ba, Sr)","Acta Crystallographica Section C","1992","48","6","975","978","10.1107/S0108270191014038","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000807","5.43","0.001","9.846","0.002","8.517","0.002","90","","90.6","0.02","90","","455.33","0.16","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- O6 P Sr V -","- O6 P Sr V -","- O24 P4 Sr4 V4 -","4","1","BR0009","Kang, H. Y.; Wang, S. L.; Lii, K. H.","Hydrothermal synthesis and structures of two layered dioxovanadium(V) phosphates <i>A</i>(VO~2~)PO~4~ (<i>A</i> = Ba, Sr)","Acta Crystallographica Section C","1992","48","6","975","978","10.1107/S0108270191014038","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000808","12.45","0.002","12.727","0.003","12.694","0.002","90","","97.99","0.01","90","","1991.9","0.7","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- As2 Ba3 H14 O7 S8 -","- As2 Ba3 H14 O7 S8 -","- As8 Ba12 H56 O28 S32 -","4","1","SE0081","Mereiter, K.; Preisinger, A.","Structure of Ba~3~(AsS~4~)~2~.7H~2~O at 125 K","Acta Crystallographica Section C","1992","48","6","984","987","10.1107/S0108270191013938","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000809","11.996","0.005","15.298","0.006","16.508","0.009","90","","105.4","0.03","90","","2921","2","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H28 Cr O4 P2 -","- C32 H28 Cr O4 P2 -","- C128 H112 Cr4 O16 P8 -","4","1","AS0545","Ueng, C.-H.; Shih, G.-Y.","Structures of [1,4-bis(diphenylphosphino)butane]tetracarbonylchromium(0) (1) and [1,4-bis(diphenylphosphino)butane]tetracarbonyltungsten(0) (2)","Acta Crystallographica Section C","1992","48","6","988","991","10.1107/S0108270191012404","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000810","12.055","0.001","15.352","0.005","16.544","0.004","90","","104.68","0.02","90","","2961.8","1.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H28 O4 P2 W -","- C32 H28 O4 P2 W -","- C128 H112 O16 P8 W4 -","4","1","AS0545","Ueng, C.-H.; Shih, G.-Y.","Structures of [1,4-bis(diphenylphosphino)butane]tetracarbonylchromium(0) (1) and [1,4-bis(diphenylphosphino)butane]tetracarbonyltungsten(0) (2)","Acta Crystallographica Section C","1992","48","6","988","991","10.1107/S0108270191012404","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000811","5.161","0.002","12.251","0.004","11.266","0.003","90","","94.87","0.02","90","","709.7","0.4","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H11 Ge N O4 -","- C4 H11 Ge N O4 -","- C16 H44 Ge4 N4 O16 -","4","1","AS0538","Chiang, H.-C.; Lin, S.-M.; Ueng, C.-H.","Synthesis and structure of dihydroxo(η^3^-2,2'-iminodiethoxo)germanium(IV)","Acta Crystallographica Section C","1992","48","6","991","993","10.1107/S0108270191012398","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000812","12.583","0.007","12.667","0.008","13.08","0.008","76.59","0.04","86.72","0.04","79.34","0.04","1993","2","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C78 H72 I6 In2 P6 -","- C78 H72 I6 In2 P6 -","- C78 H72 I6 In2 P6 -","1","0.5","LI0104","Degnan, I. A.; Alcock, N. W.; Roe, S. M.; Wallbridge, M. G. H.","Structures of adducts formed by indium(III) halides and phosphine ligands: tris[1,2-bis(diphenylphosphino)ethane]bis[triiodoindium(III)] and trichlorobis(trimethylphosphine)indium(III)","Acta Crystallographica Section C","1992","48","6","995","999","10.1107/S0108270191013033","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000813","10.418","0.008","10.769","0.009","13.808","0.009","90","","90","","90","","1549","2","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C6 H18 Cl3 In P2 -","- C6 H18 Cl3 In P2 -","- C24 H72 Cl12 In4 P8 -","4","0.5","LI0104","Degnan, I. A.; Alcock, N. W.; Roe, S. M.; Wallbridge, M. G. H.","Structures of adducts formed by indium(III) halides and phosphine ligands: tris[1,2-bis(diphenylphosphino)ethane]bis[triiodoindium(III)] and trichlorobis(trimethylphosphine)indium(III)","Acta Crystallographica Section C","1992","48","6","995","999","10.1107/S0108270191013033","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2000814","10.058","0.001","14.182","0.003","17.988","0.003","90","","97.94","0.02","90","","2541.3","0.7","","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","","","","","- C20 H9 I N O9 P Ru3 -","- C20 H9 I N O9 P Ru3 -","- C80 H36 I4 N4 O36 P4 Ru12 -","4","1","PA0254","Lugan, N.; Lavigne, G.; Bonnet, J.-J.","Structural characterization of 1,1,1,2,2,2,3,3,3-nonacarbonyl-1,2-μ-iodo-1,2,3-[μ~3~-(phenylpyridylphosphido)-μ-<i>P</i>,<i>N</i>]-<i>triangulo</i>-triruthenium","Acta Crystallographica Section C","1992","48","6","999","1002","10.1107/S010827019101260X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000815","26.374","0.003","12.22","0.002","16.278","0.003","90","","90","","90","","5246.2","1.4","","","","","","","","","","","","6","F d d 2","F 2 -2d","","","","","- C26 H26 Cl2 N2 O2 Zn -","- C32 H12 Cl2 N2 O2 Zn -","- C256 H96 Cl16 N16 O16 Zn8 -","8","0.5","BX0556","Hajjem, B.; Kallel, A.; Svoboda, I.; Sakurai, J.","Structure of di(5-β-methylallyl-2-phenyl-1,3-oxazole)zinc(II) dichloride","Acta Crystallographica Section C","1992","48","6","1002","1004","10.1107/S0108270191013343","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000816","7.761","0.005","20.578","0.01","15.634","0.011","90","","103.1","0.06","90","","2432","3","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C13 H12 Mn N O2 -","- C13 H12 Mn N O2 -","- C104 H96 Mn8 N8 O16 -","8","2","AB0251","Crocock, B.; Long, C.; Howie, R. A.","The synthesis and structure of the pyridine-substituted derivative of tricarbonyl(η^5^-methylcyclopentadienyl)manganese(I)","Acta Crystallographica Section C","1992","48","6","1004","1007","10.1107/S0108270191013161","","","0.710692","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000817","7.929","0.002","8.716","0.003","10.914","0.003","98.77","0.02","90.3","0.02","105.79","0.02","716.4","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H20 N O13 V -","- C6 H20 N O13 V -","- C12 H40 N2 O26 V2 -","2","1","AS0562","Okamoto, K.; Hidaka, J.; Fukagawa, M.; Kanamori, K.","Structure of triaqua(nitrilotriacetato)vanadium(III) tetrahydrate","Acta Crystallographica Section C","1992","48","6","1025","1027","10.1107/S010827019101377X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206333","2020-10-21","18:00:00",""
"2000818","14.332","0.003","16.592","0.003","17.42","0.003","90","","90","","90","","4142.4","1.3","","","","","","","","","","","","6","P b c a","","","","","","- C10 H30 Cl2 O3 P4 Pd -","- C10 H30 Cl2 O3 P4 Pd -","- C80 H240 Cl16 O24 P32 Pd8 -","8","1","CR0282","Davies, J. A.; Pinkerton, A. A.; Vilmer, M.","<i>cis</i>-Di[bis(dimethylphosphino)methane <i>P</i>-oxide-<i>P</i>']dichloropalladium(II) monohydrate","Acta Crystallographica Section C","1992","48","6","1027","1029","10.1107/S0108270191013859","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","189069","2020-10-21","18:00:00",""
"2000819","12.082","0.001","8.965","0.001","22.888","0.002","90","","91.25","0.01","90","","2478.5","0.4","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H24 Cl3 N4 Nd O22 -","- C8 Cl3 N4 Nd O37 -","- C32 Cl12 N16 Nd4 O148 -","4","1","KA0012","Csöregh, I.; Huskowska, E.; Legendziewicz, J.","Structure of a neodymium diglycine complex, [Nd(Gly-Gly)~2~(H~2~O)~2~](ClO~4~)~3~.2H~2~O","Acta Crystallographica Section C","1992","48","6","1030","1033","10.1107/S0108270191014257","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000820","16.58","0.03","8.34","0.01","24.35","0.03","90","","91.2","0.2","90","","3366","8","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C20 H22 O3 -","- C20 H22 O3 -","- C160 H176 O24 -","8","2","CR0353","Robinson, P. D.; Meyers, C. Y.; Kolb, V. M.; Tunnell, J. L.; Ferrara, J. D.","Structure of the crystalline dimer of α-hydroxyisobutyrophenone: (<i>R</i>,<i>S</i>)-3,3,6,6-tetramethyl-1,4-diphenyl-2,5,7-trioxabicyclo[2.2.1]heptane","Acta Crystallographica Section C","1992","48","6","1033","1036","10.1107/S0108270191012428","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000821","13.49","0.003","7.734","0.002","8.211","0.003","90","","97.6","0.04","90","","849.1","0.4","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C18 H22 N4 -","- C18 H22 N4 -","- C36 H44 N8 -","2","0.5","PA0236","Bocelli, G.; Cantoni, A.; Tosi, G.","Structure of butanedione bis(methylphenylhydrazone)","Acta Crystallographica Section C","1992","48","6","1041","1043","10.1107/S010827019101257X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000822","9.734","0.002","10.873","0.007","7.256","0.002","101.47","0.04","106.31","0.02","81.6","0.04","719","0.5","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H15 Cl2 N S -","- C14 H15 Cl2 N S -","- C28 H30 Cl4 N2 S2 -","2","1","PA0247","Enjalbert, R.; Galy, J.; Géhénot, A.; Rao, R. C.; Maire, G.","Structure of ticlopidine hydrochloride - a platelet antiaggregating agent","Acta Crystallographica Section C","1992","48","6","1043","1045","10.1107/S0108270191012593","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000823","7.659","0.001","12.741","0.001","15.095","0.001","90","","90","","90","","1473","0.2","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H17 N3 O2 -","- C17 H17 N3 O2 -","- C68 H68 N12 O8 -","4","1","LI0105","Priya, V.; Shamala, N.; Viswamitra, M. A.; Senthil Kumar, U. P.; Jeyaraman, R.","Structure of <i>N</i>-nitroso-<i>r</i>-2,<i>c</i>-7-diphenylhexahydro-1,4-diazepin-5-one","Acta Crystallographica Section C","1992","48","6","1048","1051","10.1107/S0108270191012982","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000824","14.232","0.001","14.232","0.001","10.169","0.004","90","","90","","90","","2059.7","0.8","","","","","","","","","","","","4","P -4 21 c","P -4 2n","","","","","- C9 H11 N3 O3 -","- C9 H11 N3 O3 -","- C72 H88 N24 O24 -","8","1","AS0547","Yamaguchi, K.; Matsumura, G.; Tanno, M.; Sueyoshi, S.; Miyata, N.","Structure of <i>N</i>-aryl-<i>N</i>-nitrosoureas","Acta Crystallographica Section C","1992","48","6","1051","1054","10.1107/S0108270191012908","","","1.5405","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000825","13.854","0.001","9.071","0.001","11.808","0.004","90","","92.14","0.01","90","","1482.9","0.5","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C14 H21 N3 O2 -","- C14 H21 N3 O2 -","- C56 H84 N12 O8 -","4","1","AS0547","Yamaguchi, K.; Matsumura, G.; Tanno, M.; Sueyoshi, S.; Miyata, N.","Structure of <i>N</i>-aryl-<i>N</i>-nitrosoureas","Acta Crystallographica Section C","1992","48","6","1051","1054","10.1107/S0108270191012908","","","1.5405","Cu","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2000826","12.639","0.001","10.185","0.001","7.851","0.004","90","","96.92","0.01","90","","1003.3","0.5","","","","","","","","","","","","4","P 1 21 1","","","","","","- C22 H21 N3 O2 -","- C22 H21 N3 O2 -","- C44 H42 N6 O4 -","2","1","AS0547","Yamaguchi, K.; Matsumura, G.; Tanno, M.; Sueyoshi, S.; Miyata, N.","Structure of <i>N</i>-aryl-<i>N</i>-nitrosoureas","Acta Crystallographica Section C","1992","48","6","1051","1054","10.1107/S0108270191012908","","","1.5405","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000827","7.311","0.001","5.565","0.001","88.01","0.01","90","","90","","90","","3580.7","0.9","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","","","","","- C18 H34 O2 -","- C18 H34 O2 -","- C144 H272 O16 -","8","1","AS0516","Kaneko, F.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M.","Structure of the low-melting phase of petroselinic acid","Acta Crystallographica Section C","1992","48","6","1054","1057","10.1107/S0108270191012921","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000828","5.359","0.001","8.874","0.002","41.391","0.005","90.49","0.01","89.12","0.02","113.81","0.02","1800.6","0.6","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C18 H34 O2 -","- C18 H34 O2 -","- C72 H136 O8 -","4","2","AS0527","Kaneko, F.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M.","Structure of the high-melting phase of petroselinic acid","Acta Crystallographica Section C","1992","48","6","1057","1060","10.1107/S0108270191013173","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000829","5.462","0.001","5.197","0.001","44.16","0.01","91.2","0.01","90.85","0.02","117.32","0.02","1113","0.4","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H42 O2 -","- C22 H42 O2 -","- C44 H84 O4 -","2","1","AS0523","Kaneko, F.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M.","Structure of the γ~1~ phase of erucic acid","Acta Crystallographica Section C","1992","48","6","1060","1063","10.1107/S0108270191012994","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000830","9.266","0.007","14.57","0.01","7.404","0.005","90","","108.6","0.06","90","","947.4","1.2","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 O4 -","- C10 H10 O4 -","- C40 H40 O16 -","4","1","KA0011","Lokaj, J.; Sivý, P.; Ilavsky, D.; Marchalin, S.; Vrabel, V.; Kettmann, V.","Structure of (4<i>Z</i>,6<i>Z</i>)-6-acetyl-7-hydroxy-2,4,6-octatriene-4-olide","Acta Crystallographica Section C","1992","48","6","1063","1065","10.1107/S0108270191013021","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000831","29.056","0.009","13.127","0.003","10.068","0.002","90","","90","","90","","3840.1","1.7","","","","","","","","","","","","3","P b c a","","","","","","- C20 H36 O4 -","- C20 H36 O4 -","- C160 H288 O32 -","8","1","AS0535","Yasui, M.; Tsuchiya, T.; Iwasaki, F.; Nakayama, J.","Structure of 2,3,-di-<i>tert</i>-butyl-5,6,7,8-<i>endo</i>-tetrakis(hydroxymethyl)bicyclo[2.2.2]oct-2-ene","Acta Crystallographica Section C","1992","48","6","1065","1068","10.1107/S010827019101301X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000832","15.492","0.002","6.592","0.001","17.193","0.002","90","","99.96","0.01","90","","1729.3","0.4","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C17 H24 Cl N3 O2 -","- C17 H23 Cl N3 O2 -","- C68 H92 Cl4 N12 O8 -","4","1","AL0483","Ciechanowicz-Rutkowska, M.; Stadnicka, K.; Filippini, G.; Pilati, T.","Structure of an anti-arrhythmic and hypotensive agent: 1-{3-[4-(3-chlorophenyl)-1-piperazinyl]-2-hydroxypropyl}pyrrolidin-2-one","Acta Crystallographica Section C","1992","48","6","1068","1071","10.1107/S0108270191013112","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000833","11.313","0.001","19.187","0.001","9.6363","0.0009","90","","90","","90","","2091.7","0.3","","","","","","","","","","","","4","P n a 21","","","","","","- C24 H21 N3 O3 -","- C24 H21 N3 O3 -","- C96 H84 N12 O12 -","4","1","AS0533","Ogawa, K.; Yoshimura, S.; Takeuchi, Y.; Katritzky, A.; Murugan, R.","Structure of 1,3,5-tribenzoylperhydro-1,3,5-triazine","Acta Crystallographica Section C","1992","48","6","1071","1074","10.1107/S0108270191013008","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000834","6.995","0.002","14.902","0.005","9.803","0.004","90","","110.33","0.03","90","","958.2","0.6","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 N4 O4 P2 -","- C18 H22 N4 O4 P2 -","- C36 H44 N8 O8 P4 -","2","0.5","BX0558","Englehardt, U.; Stromburg, B.","2,8-Dioxo-2,8-diphenoxy-1,3,7,9-tetraaza-2λ^5^,8λ^5^-diphosphatricyclo[7.3.0.0^3,7^]dodekan","Acta Crystallographica Section C","1992","48","6","1074","1076","10.1107/S0108270191013331","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206334","2020-10-21","18:00:00",""
"2000835","8.248","0.001","5.145","0.002","19.724","0.002","90","","90.67","0.01","90","","836.9","0.4","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","1","LI0100","Begum, N. S.; Jain, M.; Chandrasekhar, S.; Venkatesan, K.","Structure of 3-(2-hydroxyphenyl)propionic acid","Acta Crystallographica Section C","1992","48","6","1076","1078","10.1107/S0108270191012970","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000836","9.35","0.006","9.271","0.002","9.695","0.012","90","","108.38","0.03","90","","797.5","1.1","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H20 N2 O3 -","- C16 H20 N2 O3 -","- C32 H40 N4 O6 -","2","1","LI0095","Nigović, B.; Kojić-Prodić, B.; Puntarec, V.","Structure of a biologically active conjugate of auxin: <i>N</i>-indol-3-ylacetyl-<small>L</small>-norleucine at 297 and 133 K","Acta Crystallographica Section C","1992","48","6","1079","1082","10.1107/S0108270191012969","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000837","9.474","0.006","9.163","0.004","9.524","0.006","90","","107.83","0.03","90","","787.1","0.8","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H20 N2 O3 -","- C16 H20 N2 O3 -","- C32 H40 N4 O6 -","2","1","LI0095","Nigović, B.; Kojić-Prodić, B.; Puntarec, V.","Structure of a biologically active conjugate of auxin: <i>N</i>-indol-3-ylacetyl-<small>L</small>-norleucine at 297 and 133 K","Acta Crystallographica Section C","1992","48","6","1079","1082","10.1107/S0108270191012969","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000838","6.579","0.005","8.441","0.007","13.893","0.014","101.92","0.09","103.38","0.06","97.44","0.06","721.5","1.2","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C17 H14 O7 -","- C17 H14 O7 -","- C34 H28 O14 -","2","1","LI0106","Parmar, V. S.; Vardhan, A.; Sharma, R. K.; Alcock, N. W.; Errington, W.","Structure of prudomestin","Acta Crystallographica Section C","1992","48","6","1090","1092","10.1107/S0108270191013823","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000839","7.353","0.001","10.153","0.001","25.324","0.003","90","","90","","90","","1890.6","0.4","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H32 N2 O2 -","- C21 H32 N2 O2 -","- C84 H128 N8 O8 -","4","1","HE0035","Maes, D.; Wyns, L.; Lisgarten, J.; Lisgarten, D.; Palmer, R.","Structure of (20<i>R</i>)-5α-pregnano[3,4-<i>c</i>][1,2,5]oxadiazol-20-ol (HS1011)","Acta Crystallographica Section C","1992","48","6","1092","1095","10.1107/S010827019101466X","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000840","8.564","0.005","9.439","0.009","9.566","0.005","86.01","0.09","72.3","0.06","78.09","0.09","720.8","1","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H36 Cl6 O10 Pr2 -","- C16 H36 Cl6 O10 Pr2 -","- C16 H36 Cl6 O10 Pr2 -","1","0.5","CD0074","Rogers, R. D.; Henry, R. F.","Structure of [PrCl~3~(EO4)]~2~","Acta Crystallographica Section C","1992","48","6","1099","1101","10.1107/S0108270191012763","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000841","14.533","0.003","18.004","0.005","8.538","0.002","100.37","0.01","105.92","0.05","74.69","0.03","2058.1","1","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C10 H20 Au F6 N2 S4 Sb -","- C10 H20 Au F6 N2 S4 Sb -","- C40 H80 Au4 F24 N8 S16 Sb4 -","4","2","AS0529","Hong, M.; Huang, Z.; Lei, X.; Jiang, F.; Liu, H.","Structure of bis(<i>N</i>,<i>N</i>-diethyldithiocarbamato)gold(III) hexafluoroantimonate","Acta Crystallographica Section C","1992","48","6","1101","1102","10.1107/S010827019101291X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000842","16.908","0.002","27.038","0.003","9.531","0.001","93.88","0.01","95.71","0.01","106.86","0.01","4127.8","0.8","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C45 H39 Fe N O6 P2 -","- C45 H39 Fe N O6 P2 -","- C180 H156 Fe4 N4 O24 P8 -","4","2","PA0260","Brunet, J.-J.; Dahan, F.; Passelaigue, E.","Structure of bis(triphenylphosphine)iminium tetracarbonyl(α-ethoxycarbonylethyl)ferrate: [{(C~6~H~5~)~3~P}~2~N][Fe(CO)~4~{CH(CH~3~)COOC~2~H~5~}]","Acta Crystallographica Section C","1992","48","6","1103","1105","10.1107/S0108270191012945","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000843","8.027","0.001","5.725","0.002","11.43","0.002","90","","97.08","0.01","90","","521.3","0.2","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- Cl4 Fe H14 N4 O2 -","- Cl4 Fe H14 N4 O2 -","- Cl8 Fe2 H28 N8 O4 -","2","0.5","AB0163","Kumar, N. R. S.; Nethaji, M.","Structure of diaquadichlorobis(hydrazinium)iron(II) dichloride","Acta Crystallographica Section C","1992","48","6","1105","1107","10.1107/S010827019101329X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000844","6.73","0.001","8.366","0.001","8.835","0.001","74.15","0.01","74.32","0.01","72.27","0.01","446.19","0.1","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C4 H6 F K N2 O6 S -","- C4 H6 F K N2 O6 S -","- C8 H12 F2 K2 N4 O12 S2 -","2","1","GE0289","Antolini, L.; Pecorari, P.","Structure of potassium 5-fluoro-5,6-dihydrouracil-6-sulfonate monohydrate","Acta Crystallographica Section C","1992","48","6","1107","1109","10.1107/S0108270191013550","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000845","9.623","0.002","8.202","0.001","18.757","0.003","90","","96.2","0.01","90","","1471.8","0.4","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 N O S Sn -","- C15 H15 N O S Sn -","- C60 H60 N4 O4 S4 Sn4 -","4","1","LI0115","Yeap, G.-Y.; Fun, H.-K.; Teo, S.-B.; Teoh, S.-G.","Structure of [<i>N</i>-(2-mercaptophenyl)salicylideneaminato-<i>N</i>,<i>O</i>,<i>S</i>]dimethyltin(IV)","Acta Crystallographica Section C","1992","48","6","1109","1110","10.1107/S0108270191013045","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000846","23.659","0.008","32.794","0.01","10.042","0.005","90","","90","","90","","7791","5","","","","","","","","","","","","7","F d d 2","","","","","","- C8 H24 Cl2 F6 Ir N2 P3 -","- C8 H24 Cl2 F6 Ir N2 P3 -","- C128 H384 Cl32 F96 Ir16 N32 P48 -","16","1","AS0553","Uekusa, H.; Ohba, S.; Simonsen, K. P.; Kojima, M.; Fujita, J.","Structure of <i>trans</i>(Cl,Cl),<i>trans</i>(P,P)-dichlorobis{[2-(dimethylphosphino)ethyl]amine-<i>N</i>,<i>P</i>}iridium(III) hexafluorophosphate, [IrCl~2~(edmp)~2~].PF~6~","Acta Crystallographica Section C","1992","48","6","1111","1112","10.1107/S0108270191013185","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000847","7.552","0.002","8.114","0.002","9.714","0.004","93.88","0.02","102.04","0.03","114.8","0.02","520.3","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C3 H11 Cl3 O3 Sn -","- C3 H11 Cl3 O3 Sn -","- C6 H22 Cl6 O6 Sn2 -","2","1","BX0564","Reuter, H.; Schröder, D.","Trichloromethoxytin(IV) dimethanolate, SnCl~3~(OCH~3~).2CH~3~OH","Acta Crystallographica Section C","1992","48","6","1112","1114","10.1107/S0108270191013288","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000848","6.906","0.003","14.545","0.003","21.236","0.009","90","","99.05","0.02","90","","2106.6","1.4","","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","","","","","- C13 H23 Co F9 N4 O3 P -","- C13 H23 Co F13 N4 O3 P -","- C52 H92 Co4 F52 N16 O12 P4 -","4","1","GE0283","Geremia, S.; Rahman, A.; Zangrando, E.","Structure of aqua{[3,3'-(1,3-propanediyldinitrilo)bis(2-butanone oximato)]-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>'''}(2,2,2-trifluoroethyl)cobalt(III) hexafluorophosphate","Acta Crystallographica Section C","1992","48","6","1114","1116","10.1107/S0108270191013562","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000849","11.418","0.002","7.989","0.001","11.231","0.002","90","","106.36","0.01","90","","983","0.3","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 O4 -","- C10 H12 O4 -","- C40 H48 O16 -","4","1","AL0507","Blaser, D.; Stoeckli-Evans, H.","Structure of the methyl ester of everninic acid (methyl 2-hydroxy-4-methoxy-6-methylbenzoate)","Acta Crystallographica Section C","1992","48","6","1124","1125","10.1107/S0108270191012738","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000850","7.931","0.001","7.95","0.001","8.929","0.001","90","","102.81","0.01","90","","548.97","0.12","","","","","","","","","","","","3","P 1 21 1","","","","","","- C11 H14 O4 -","- C11 H14 O4 -","- C22 H28 O8 -","2","1","AL0508","Blaser, D.; Gunzinger, J.; Stoeckli-Evans, H.; Tabacchi, R.","Structure of 2-methoxy methyl β-orcinol carboxylate (methyl 4-hydroxy-2-methoxy-3,6-dimethylbenzoate)","Acta Crystallographica Section C","1992","48","6","1126","1127","10.1107/S010827019101274X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000851","13.59","0.01","10.62","0.01","7.59","0.01","110","0.1","106.2","0.1","91.4","0.1","980","2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H13 F6 N -","- C26 H13 F6 N -","- C52 H26 F12 N2 -","2","1","AL0494","Halfpenny, J.","Structure of 6,7,8,9,10,11-hexafluoro-2,4-diphenyl-3<i>H</i>-naphtho[2,1-<i>b</i>]azepine","Acta Crystallographica Section C","1992","48","6","1127","1129","10.1107/S0108270191012349","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000852","9.027","0.004","3.922","0.001","13.396","0.006","90","","93.127","0.003","90","","473.6","0.3","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H8 O2 -","- C14 H8 O2 -","- C28 H16 O4 -","2","0.5","PA0245","Bideau, J.-P.; Cotrait, M.; Buisson, J.-P.; Demerseman, P.","Structure cristalline du [1]benzopyrano[6,5,4-<i>def</i>][1]benzopyrane (1,6-dioxapyrène)","Acta Crystallographica Section C","1992","48","6","1129","1131","10.1107/S0108270191012647","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000853","4.762","0.001","11.196","0.004","21.421","0.007","90","","90","","90","","1142.1","0.6","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C11 H13 F O2 S -","- C11 H13 F O2 S -","- C44 H52 F4 O8 S4 -","4","1","GE0292","Fabrizi, G.; Fedeli, W.; Lamba, D.","Structure of 2-(fluoromethyl)-2-[(<i>p</i>-tolylsulfinyl)methyl]oxirane","Acta Crystallographica Section C","1992","48","6","1131","1133","10.1107/S0108270191013574","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000854","7.752","0.004","7.539","0.003","12.096","0.007","90","","106.77","0.04","90","","676.9","0.6","","","","","","","","","","","","6","P 1 c 1","","","","","","- C9 H18 F6 N O P -","- C9 H18 F6 N O P -","- C18 H36 F12 N2 O2 P2 -","2","1","HE0037","Simpson, S. J.","2,2,6,6-Tetramethyl-4-oxopiperidinium hexafluorophosphate","Acta Crystallographica Section C","1992","48","6","1137","1138","10.1107/S0108270191013252","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000855","6.46","0.002","8.917","0.003","15.616","0.005","83.6","0.03","83.41","0.02","89.52","0.02","888","0.5","","","","","","","","","","","","4","P 1","P 1","1","","","","- C15 H26 O4 S2 -","- C15 H26 O4 S2 -","- C30 H52 O8 S4 -","2","2","ST0549","Lynch, V. M.; Lee, W.-C.; Martin, S. F.; Davis, B. E.","Structure of a protected C3-C10 subunit of erythromycin and its C8 epimer","Acta Crystallographica Section C","1992","48","6","1145","1148","10.1107/S0108270191013379","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208347","2020-10-21","18:00:00",""
"2000856","8.1849","0.0008","8.9456","0.0014","12.0258","0.0014","90","","100.878","0.008","90","","864.69","0.19","","","","","","","","","","","","4","P 1 21 1","","","","","","- C15 H26 O4 S2 -","- C15 H26 O4 S2 -","- C30 H52 O8 S4 -","2","1","ST0549","Lynch, V. M.; Lee, W.-C.; Martin, S. F.; Davis, B. E.","Structure of a protected C3-C10 subunit of erythromycin and its C8 epimer","Acta Crystallographica Section C","1992","48","6","1145","1148","10.1107/S0108270191013379","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000857","6.3847","0.0008","10.234","0.001","22.251","0.003","90","","90","","90","","1453.9","0.3","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H17 N3 O -","- C17 H17 N3 O -","- C68 H68 N12 O4 -","4","1","PA0257","Rodier, N.; Cense, J.-M.; Robert, J.-M.; Le Baut, G.","<i>N</i>-(4,6-Diméthylpyridin-2-yl)(1-méthylindol-2-yl)carboxamide","Acta Crystallographica Section C","1992","48","6","1148","1150","10.1107/S0108270191013732","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000858","7.746","0.003","11.965","0.005","12.538","0.004","90","","91.86","0.03","90","","1161.4","0.8","","","","","","","","","","","","6","P 1 21 1","","","","","","- C5 H15 N O4 S2 Si -","- C5 H15 N O4 S2 Si -","- C20 H60 N4 O16 S8 Si4 -","4","2","HA0087","Jones, P. G.; Weinkauf, A.","Redetermination of the structure of <i>N</i>-(trimethylsilyl)dimesylamine [(H~3~C)~3~SiN(SO~2~CH~3~)~2~] at 178 K","Acta Crystallographica Section C","1992","48","6","1150","1151","10.1107/S0108270191013355","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000859","19.057","0.007","7.473","0.003","7.286","0.003","90","","94.76","0.03","90","","1034","0.7","297","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-phenylpyridazino[2,1-f][1,2,4]triazin-4-one","","- C12 H8 N4 O -","- C12 H8 N4 O -","- C48 H32 N16 O4 -","4","1","AS1002","Yamaguchi, K.; Takahashi, H.; Itoh, T.; Ohsawa, A.","Two azabenzotriazines","Acta Crystallographica Section C","1992","48","6","1152","1154","10.1107/S0108270192002725","","","1.5405","CuKα_1","","","0.058","","","0.065","","","","","1.03","1.03","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000860","14.452","0.002","10.257","0.001","7.048","0.003","90","","98.11","0.02","90","","1034.3","0.5","297","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-phenylpyrazino[3,2-f][1,2,4]triazin-4-one","","- C12 H8 N4 O -","- C12 H8 N4 O -","- C48 H32 N16 O4 -","4","1","AS1002","Yamaguchi, K.; Takahashi, H.; Itoh, T.; Ohsawa, A.","Two azabenzotriazines","Acta Crystallographica Section C","1992","48","6","1152","1154","10.1107/S0108270192002725","","","1.5405","CuKα_1","","","0.062","","","0.054","","","","","1.38","1.38","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000861","5.493","0.004","7.262","0.005","22.459","0.015","98.51","0.03","93.75","0.03","102.53","0.02","860.5","1","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","3-Hydroxy-1-oxatricyclo[4.3.0^2,8^.0^3,7^]-8-undecene (compound 3)","","- C10 H14 O2 -","- C10 H14 O2 -","- C40 H56 O8 -","4","2","KA1000","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Girardot, S.; Caubère, P.","Structural aspects of reactions based on `aggregative activation': structures of 3-oxatricyclo[6.3.0.0^2,7^]undec-6-en-1-ol and 6,7-epoxy-3-oxatricyclo[6.4.0.0^2,7^]dodecan-1-ol","Acta Crystallographica Section C","1992","48","6","1155","1160","10.1107/S0108270192002993","","","0.71069","MoKα","","","0.0351","","","0.0452","","","","","0.5248","0.5248","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000862","7.741","0.001","21.032","0.011","6.05","0.001","90","","99.43","0.01","90","","971.7","0.5","293","2","293","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","9,10-Epoxy-3-hydroxy-1-oxatricyclo[4.4.0^2,9^.0^3,8^]dodecane compound (4)","","- C11 H16 O3 -","- C11 H16 O3 -","- C44 H64 O12 -","4","1","KA1000","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Girardot, S.; Caubère, P.","Structural aspects of reactions based on `aggregative activation': structures of 3-oxatricyclo[6.3.0.0^2,7^]undec-6-en-1-ol and 6,7-epoxy-3-oxatricyclo[6.4.0.0^2,7^]dodecan-1-ol","Acta Crystallographica Section C","1992","48","6","1155","1160","10.1107/S0108270192002993","","","1.54178","CuKα","","","0.0475","","","0.0787","","","","","1.0944","1.0944","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2000863","4.752","0.001","11.721","0.004","4.971","0.001","90","","90","","90","","276.88","0.12","","","","","","","","","","","","3","P b c n","-P 2n 2ab","","","","","- F4 In Li -","- F4 In Li -","- F16 In4 Li4 -","4","0.5","DU0320","Gravereau, P.; Chaminade, J. P.; Gaewdang, T.; Grannec, J.; Pouchard, M.; Hagenmuller, P.","Structure of lithium tetrafluoroindate","Acta Crystallographica Section C","1992","48","5","769","771","10.1107/S0108270191011915","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000864","8.849","0.002","3.937","0.001","14.348","0.005","90","","90","","90","","499.9","0.2","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Eu Se3 Zr -","- Eu Se3 Zr -","- Eu4 Se12 Zr4 -","4","0.5","ST0540","Mar, A.; Ibers, J. A.","Structure of europium zirconium selenide, EuZrSe~3~","Acta Crystallographica Section C","1992","48","5","771","773","10.1107/S0108270191011599","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2000865","5.952","0.001","13.576","0.002","7.908","0.001","90","","90.53","0.01","90","","638.9","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Co D8 O8 S -","- Co D8 O8 S -","- Co4 D32 O32 S4 -","4","1","AB0252","Kellersohn, T.","Structure of cobalt sulfate tetrahydrate","Acta Crystallographica Section C","1992","48","5","776","779","10.1107/S0108270191012003","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:26",""
"2000866","14.37","0.003","14.99","0.003","13.324","0.003","110.3","0.02","94.91","0.02","110.38","0.02","2452.8","1.1","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C51 H48 Mo O11 P2 S -","- C51 H50 Mo O11 P2 S -","- C102 H100 Mo2 O22 P4 S2 -","2","1","BR0008","Gibson, D. H.; Richardson, J. F.; Franco, J. O.","Dicarbonyl(η^5^-cyclopentadienyl)(triphenylphosphite)[(triphenylphosphonio)methanide]molybdenum <i>p</i>-toluenesulfonate","Acta Crystallographica Section C","1992","48","5","782","785","10.1107/S0108270191011824","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000867","14.457","0.004","21.38","0.006","10.209","0.003","90","","90","","90","","3155.5","1.6","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C28 H42 N3 O9 Tc -","- C28 H29 N4 O10 Tc -","- C112 H116 N16 O40 Tc4 -","4","1","CD0058","Rochon, F. D.; Melanson, R.; Kong, P.-C.","Structure of bis(4-nitro-1,2-catecholato)oxotechnetium(V)","Acta Crystallographica Section C","1992","48","5","785","788","10.1107/S010827019101185X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000868","17.094","0.002","16.842","0.001","15.198","0.002","90","","123","0.01","90","","3669.6","0.8","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C4 H10 Mg N4 O6 -","- C4 H10 Mg N4 O6 -","- C64 H160 Mg16 N64 O96 -","16","2","AS0495","Yamagata, K.; Achiwa, N.; Hashimoto, M.; Koyano, N.; Ridwan; Iwata, Y.; Shibuya, I.","Magnesium formate-urea (1/2)","Acta Crystallographica Section C","1992","48","5","793","795","10.1107/S0108270191012301","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000869","15.204","0.003","12.825","0.002","11.006","0.002","84.18","0.02","110.18","0.02","105.22","0.02","1943.5","0.7","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H32 Cu2 N6 O15 -","- C40 H32 Cu2 N6 O15 -","- C80 H64 Cu4 N12 O30 -","2","1","AL0502","Aguiló, M.; Solans, X.; Castro, I.; Faus, J.; Julve, M.","Two different (croconato)(2,2':6',2''-terpyridyl)copper(II) complexes in one single crystal: structure of [Cu(C~15~H~11~N~3~)(H~2~O)(C~5~O~5~)][Cu(C~15~H~11~N~3~)(C~5~O~5~)].4H~2~O","Acta Crystallographica Section C","1992","48","5","802","806","10.1107/S0108270191012325","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000870","13.229","0.002","11.069","0.002","12.849","0.001","90","","117.92","0.09","90","","1662.5","1.4","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C17 H11 Au Br N5 -","- C17 H11 Au Br N5 -","- C68 H44 Au4 Br4 N20 -","4","1","GE0297","Ferretti, V.; Gilli, P.; Bertolasi, V.; Marangoni, G.; Pitteri, B.; Chessa, G.","Structure of bromodicyano(2,2':6',2''-terpyridine)gold(III)","Acta Crystallographica Section C","1992","48","5","814","817","10.1107/S0108270191012830","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000871","11.471","0.002","12.555","0.003","13.159","0.002","90","","91.83","0.02","90","","1894.2","0.6","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C19 H15 Cl2 O4 P -","- C19 H15 Cl2 O4 P -","- C76 H60 Cl8 O16 P4 -","4","1","HA0048","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. Structure of the diphenyl phosphate ester of 2,6-dichlorobenzyl alcohol","Acta Crystallographica Section C","1992","48","5","824","826","10.1107/S0108270191012131","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000872","27.83","0.016","5.82","0.003","18.389","0.015","90","","106.46","0.06","90","","2856","3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C14 H14 N2 O6 -","- C14 H14 N2 O6 -","- C112 H112 N16 O48 -","8","2","HA0049","Jones, P. G.; Schmidt-Bäse, K.; Edwards, M. R.; Kirby, A. J.","Bond length and reactivity. Structure of 2-<i>endo</i>-bornyl <i>p</i>-toluenesulfonate","Acta Crystallographica Section C","1992","48","5","826","829","10.1107/S0108270191012143","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000873","7.9995","0.0014","9.87","0.002","11.975","0.002","112.84","0.02","105.1","0.02","93.56","0.02","827","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H24 O3 S -","- C17 H24 O3 S -","- C34 H48 O6 S2 -","2","1","HA0049","Jones, P. G.; Schmidt-Bäse, K.; Edwards, M. R.; Kirby, A. J.","Bond length and reactivity. Structure of 2-<i>endo</i>-bornyl <i>p</i>-toluenesulfonate","Acta Crystallographica Section C","1992","48","5","826","829","10.1107/S0108270191012143","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000874","15.415","0.003","9.003","0.002","15.454","0.003","90","","114.32","0.02","90","","1954.4","0.8","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 O -","- C26 H24 O -","- C104 H96 O4 -","4","1","HA0050","Jones, P. G.; Kirby, A. J.; Percy, J. M.","Bond length and reactivity. Structures of the triphenylmethyl ether and the 4-nitrobenzoate ester of <i>anti</i>-7-norbornenol","Acta Crystallographica Section C","1992","48","5","829","832","10.1107/S0108270191012155","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000875","9.3638","0.0012","10.4685","0.001","12.827","0.002","90","","94.875","0.012","90","","1252.8","0.3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C14 H13 N O4 -","- C14 H13 N O4 -","- C56 H52 N4 O16 -","4","1","HA0050","Jones, P. G.; Kirby, A. J.; Percy, J. M.","Bond length and reactivity. Structures of the triphenylmethyl ether and the 4-nitrobenzoate ester of <i>anti</i>-7-norbornenol","Acta Crystallographica Section C","1992","48","5","829","832","10.1107/S0108270191012155","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000876","7.353","0.001","8.136","0.001","24.307","0.004","94.44","0.01","89.81","0.01","105.51","0.01","1396.8","0.4","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H16 O3 S -","- C15 H16 O3 S -","- C60 H64 O12 S4 -","4","2","HA0051","Kirby, A. J.; Parker, J. K.; Raithby, P. R.","Bond length and reactivity. Structure of 2-phenylethyl <i>p</i>-toluenesulfonate","Acta Crystallographica Section C","1992","48","5","832","834","10.1107/S0108270191012167","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000877","8.333","0.0016","5.5554","0.0016","27.182","0.007","90","","90.78","0.03","90","","1258.2","0.5","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 F N O3 -","- C14 H13 F2 N O3 -","- C56 H52 F8 N4 O12 -","4","1","HA0052","Jones, P. G.; Dölle, A.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-nitrophenyl ether and the 4-nitrobenzoate ester of 2-fluoro-2-phenylethanol","Acta Crystallographica Section C","1992","48","5","835","837","10.1107/S0108270191012179","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000878","6.0219","0.0008","14.8748","0.0014","15.1877","0.0016","90","","90","","90","","1360.4","0.3","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C15 H12 F N O4 -","- C15 H12 F N O4 -","- C60 H48 F4 N4 O16 -","4","1","HA0052","Jones, P. G.; Dölle, A.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-nitrophenyl ether and the 4-nitrobenzoate ester of 2-fluoro-2-phenylethanol","Acta Crystallographica Section C","1992","48","5","835","837","10.1107/S0108270191012179","","","1.54179","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000879","11.941","0.003","7.871","0.003","15.688","0.003","90","","99.46","0.02","90","","1454.4","0.7","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C15 H15 F O3 S -","- C15 H15 F O3 S -","- C60 H60 F4 O12 S4 -","4","1","HA0053","Jones, P. G.; Dölle, A.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-methyl-, 4-chloro- and 4-nitrobenzenesulfonate esters of 2-fluoro-2-phenylethanol","Acta Crystallographica Section C","1992","48","5","838","841","10.1107/S0108270191012180","","","1.54179","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000880","12.079","0.004","7.87","0.003","15.337","0.004","90","","98.9","0.03","90","","1440.4","0.8","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C14 H12 Cl F O3 S -","- C14 H12 Cl F O3 S -","- C56 H48 Cl4 F4 O12 S4 -","4","1","HA0053","Jones, P. G.; Dölle, A.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-methyl-, 4-chloro- and 4-nitrobenzenesulfonate esters of 2-fluoro-2-phenylethanol","Acta Crystallographica Section C","1992","48","5","838","841","10.1107/S0108270191012180","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000881","5.7308","0.0008","24.877","0.005","10.1784","0.0014","90","","91.35","0.02","90","","1450.7","0.4","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 F N O5 S -","- C14 H12 F2 N O5 S -","- C56 H48 F8 N4 O20 S4 -","4","1","HA0053","Jones, P. G.; Dölle, A.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-methyl-, 4-chloro- and 4-nitrobenzenesulfonate esters of 2-fluoro-2-phenylethanol","Acta Crystallographica Section C","1992","48","5","838","841","10.1107/S0108270191012180","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000882","5.842","0.002","8.666","0.003","20.361","0.006","90","","96.6","0.02","90","","1024","0.6","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C8 H8 F N O5 S -","- C8 H8 F N O5 S -","- C32 H32 F4 N4 O20 S4 -","4","1","HA0054","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-nitrobenzenesulfonate esters of 2-fluoroethanol and 2,2,2-trifluoroethanol","Acta Crystallographica Section C","1992","48","5","841","844","10.1107/S0108270191012192","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000883","5.2568","0.0009","5.7559","0.0009","36.385","0.007","90","","90","","90","","1100.9","0.3","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C8 H6 F3 N O5 S -","- C8 H6 F3 N O5 S -","- C32 H24 F12 N4 O20 S4 -","4","1","HA0054","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-nitrobenzenesulfonate esters of 2-fluoroethanol and 2,2,2-trifluoroethanol","Acta Crystallographica Section C","1992","48","5","841","844","10.1107/S0108270191012192","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000884","6.376","0.002","14.317","0.007","21.792","0.008","90","","92.64","0.03","90","","1987.2","1.4","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H28 O2 -","- C23 H28 O2 -","- C92 H112 O8 -","4","1","HA0055","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. Structures of the 4-phenylbenzoate esters of <i>cis</i>- and <i>trans</i>-4-<i>tert</i>-butylcyclohexanol","Acta Crystallographica Section C","1992","48","5","844","847","10.1107/S0108270191012209","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000885","12.951","0.002","10.836","0.002","14.022","0.002","90","","102.66","0.02","90","","1920","0.6","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H28 O2 -","- C23 H28 O2 -","- C92 H112 O8 -","4","1","HA0055","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. Structures of the 4-phenylbenzoate esters of <i>cis</i>- and <i>trans</i>-4-<i>tert</i>-butylcyclohexanol","Acta Crystallographica Section C","1992","48","5","844","847","10.1107/S0108270191012209","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000886","13.921","0.002","11.408","0.003","12.591","0.003","90","","100.61","0.02","90","","1965.4","0.8","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C23 H28 O2 -","- C23 H28 O2 -","- C92 H112 O8 -","4","1","HA0056","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. Structure of the 4-phenylbenzoate ester of <i>trans</i>-3-<i>tert</i>-butylcyclohexanol","Acta Crystallographica Section C","1992","48","5","847","849","10.1107/S0108270191012210","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000887","9.424","0.005","17.177","0.009","8.321","0.003","90","","90","","90","","1347","1.1","","","","","","","","","","","","4","P c a 21","P 2c -2ac","","","","","- C11 H22 O3 S -","- C11 H22 O3 S -","- C44 H88 O12 S4 -","4","1","HA0057","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. Structures of the methanesulfonate esters of <i>cis</i>- and <i>trans</i>-4-<i>tert</i>-butylcyclohexanol","Acta Crystallographica Section C","1992","48","5","849","851","10.1107/S0108270191012222","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000888","21.081","0.003","6.0693","0.0006","10.3058","0.0016","90","","94.944","0.012","90","","1313.7","0.3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C11 H22 O3 S -","- C11 H22 O3 S -","- C44 H88 O12 S4 -","4","1","HA0057","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. Structures of the methanesulfonate esters of <i>cis</i>- and <i>trans</i>-4-<i>tert</i>-butylcyclohexanol","Acta Crystallographica Section C","1992","48","5","849","851","10.1107/S0108270191012222","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000889","6.971","0.001","9.3896","0.0011","23.826","0.004","90","","93.518","","90","","1556.6","0.4","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 F O2 -","- C19 H19 F O2 -","- C76 H76 F4 O8 -","4","1","HA0058","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-phenylbenzoate, the diphenyl phosphate and the 2-naphthalenesulfonate esters of <i>trans</i>-2-fluorocyclohexanol","Acta Crystallographica Section C","1992","48","5","852","855","10.1107/S0108270191012234","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000890","16.644","0.005","9.277","0.003","12.048","0.004","90","","109.8","0.03","90","","1750.3","1","","","","","","","","","","","","5","C 1 c 1","C -2yc","","","","","- C18 H20 F O4 P -","- C18 H20 F O4 P -","- C72 H80 F4 O16 P4 -","4","1","HA0058","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-phenylbenzoate, the diphenyl phosphate and the 2-naphthalenesulfonate esters of <i>trans</i>-2-fluorocyclohexanol","Acta Crystallographica Section C","1992","48","5","852","855","10.1107/S0108270191012234","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000891","11.7709","0.0015","15.601","0.002","8.2119","0.0012","90","","94.728","0.015","90","","1502.9","0.4","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C16 H17 F O3 S -","- C16 H17 F O3 S -","- C64 H68 F4 O12 S4 -","4","1","HA0058","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-phenylbenzoate, the diphenyl phosphate and the 2-naphthalenesulfonate esters of <i>trans</i>-2-fluorocyclohexanol","Acta Crystallographica Section C","1992","48","5","852","855","10.1107/S0108270191012234","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000892","7.559","0.002","9.869","0.002","14.347","0.004","103.17","0.02","92.8","0.02","104.33","0.02","1003.4","0.5","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C23 H27 F O2 -","- C23 H28 F2 O2 -","- C46 H56 F4 O4 -","2","1","HA0059","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-phenylbenzoate and methanesulfonate esters of <i>trans</i>,<i>cis</i>-4-<i>tert</i>-butyl-2-fluorocyclohexanol","Acta Crystallographica Section C","1992","48","5","855","858","10.1107/S0108270191012246","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000893","17.09","0.004","7.678","0.002","10.806","0.003","90","","106.54","0.02","90","","1359.3","0.6","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C11 H21 F O3 S -","- C11 H22 F2 O3 S -","- C44 H88 F8 O12 S4 -","4","1","HA0059","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 4-phenylbenzoate and methanesulfonate esters of <i>trans</i>,<i>cis</i>-4-<i>tert</i>-butyl-2-fluorocyclohexanol","Acta Crystallographica Section C","1992","48","5","855","858","10.1107/S0108270191012246","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000894","9.368","0.004","9.462","0.004","15.546","0.007","85.17","0.04","81.8","0.02","61.62","0.03","1199.8","1","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C29 H31 F O2 -","- C29 H32 F2 O2 -","- C58 H64 F4 O4 -","2","1","HA0060","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 9-(9-phenylxanthenyl) ether, and the 4-phenylbenzoate, diphenyl phosphate and methanesulfonate esters of <i>cis</i>,<i>trans</i>-4-<i>tert</i>-butyl-2-fluorocyclohexanol","Acta Crystallographica Section C","1992","48","5","859","864","10.1107/S0108270191012258","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000895","21.194","0.004","11.155","0.002","8.3306","0.0015","90","","95.512","","90","","1960.4","0.6","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C23 H27 F O2 -","- C23 H28 F2 O2 -","- C92 H112 F8 O8 -","4","1","HA0060","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 9-(9-phenylxanthenyl) ether, and the 4-phenylbenzoate, diphenyl phosphate and methanesulfonate esters of <i>cis</i>,<i>trans</i>-4-<i>tert</i>-butyl-2-fluorocyclohexanol","Acta Crystallographica Section C","1992","48","5","859","864","10.1107/S0108270191012258","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000896","5.8904","0.0015","10.96","0.003","33.09","0.008","90","","90","","90","","2136.3","1","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C22 H28 F O4 P -","- C22 H29 F2 O4 P -","- C88 H116 F8 O16 P4 -","4","1","HA0060","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 9-(9-phenylxanthenyl) ether, and the 4-phenylbenzoate, diphenyl phosphate and methanesulfonate esters of <i>cis</i>,<i>trans</i>-4-<i>tert</i>-butyl-2-fluorocyclohexanol","Acta Crystallographica Section C","1992","48","5","859","864","10.1107/S0108270191012258","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000897","21.127","0.003","6.2048","0.0008","10.4113","0.0015","90","","101.427","0.011","90","","1337.8","0.3","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C11 H21 F O3 S -","- C11 H22 F2 O3 S -","- C44 H88 F8 O12 S4 -","4","1","HA0060","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structures of the 9-(9-phenylxanthenyl) ether, and the 4-phenylbenzoate, diphenyl phosphate and methanesulfonate esters of <i>cis</i>,<i>trans</i>-4-<i>tert</i>-butyl-2-fluorocyclohexanol","Acta Crystallographica Section C","1992","48","5","859","864","10.1107/S0108270191012258","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000898","10.249","0.002","8.853","0.002","29.687","0.004","90","","90","","90","","2693.6","0.9","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C11 H21 F O3 S -","- C11 H21 F O3 S -","- C88 H168 F8 O24 S8 -","8","1","HA0061","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-fluorine. Structure of the methanesulfonate ester of <i>trans</i>,<i>trans</i>-5-<i>tert</i>-butyl-2-fluorocyclohexanol","Acta Crystallographica Section C","1992","48","5","864","866","10.1107/S010827019101226X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000899","6.256","0.001","16.608","0.003","17.012","0.004","90","","94.49","0.02","90","","1762.1","0.6","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C18 H22 O2 Si -","- C18 H22 O2 Si -","- C72 H88 O8 Si4 -","4","1","HA0062","Doyle, M. J.; Kirby, A. J.; Percy, J. M.; Raithby, P. R.","Bond length and reactivity. The effect of β-silicon. Structure of the 4-phenylbenzoate ester of 2-trimethylsilylethanol","Acta Crystallographica Section C","1992","48","5","866","868","10.1107/S0108270191012271","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000900","7.9566","0.0014","13.11","0.003","20.844","0.005","96.32","0.02","90.73","0.02","90.24","0.02","2160.8","0.8","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H24 N2 O6 Si -","- C21 H24 N2 O6 Si -","- C84 H96 N8 O24 Si4 -","4","2","HA0063","Jones, P. G.; Kirby, A. J.; Parker, J. K.","Bond length and reactivity. The effect of β-silicon. Structure of the 3,5-dinitrobenzoate ester of <i>trans</i>-2-(dimethylphenylsilyl)cyclohexanol","Acta Crystallographica Section C","1992","48","5","868","871","10.1107/S0108270191012283","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000901","6.57","0.002","19.031","0.004","7.949","0.002","90","","90","","90","","993.9","0.4","","","","","","","","","","","","3","P n a 21","P 2c -2n","","","","","- C10 H18 O2 -","- C10 H18 O2 -","- C40 H72 O8 -","4","1","GE0281","Giuseppetti, G.; Tadini, C.; Bettinetti, G. P.","Structures of sobrerol enantiomers and racemates. II. (±)-<i>trans</i>-5-Hydroxy-α,α,4-trimethyl-3-cyclohexene-1-methanol (racemic <i>trans</i>-sobrerol)","Acta Crystallographica Section C","1992","48","5","876","878","10.1107/S0108270191011150","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000902","8.484","0.002","6.859","0.002","14.95","0.005","90","","90","","90","","870","0.4","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C6 H7 Na O8 -","- C6 H10 Na O9 -","- C24 H40 Na4 O36 -","4","0.5","AB0248","Kalsbeek, N.","Structures of a partially deuterated sodium trihydrogen dimalonate and sodium hydrogen malonate (a reinvestigation) at 120 K","Acta Crystallographica Section C","1992","48","5","878","883","10.1107/S0108270191012489","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2000903","6.671","0.002","7.39","0.003","9.359","0.004","90","","100.49","0.03","90","","453.7","0.3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C3 H3 Na O4 -","- C3 H3 Na O4 -","- C12 H12 Na4 O16 -","4","1","AB0248","Kalsbeek, N.","Structures of a partially deuterated sodium trihydrogen dimalonate and sodium hydrogen malonate (a reinvestigation) at 120 K","Acta Crystallographica Section C","1992","48","5","878","883","10.1107/S0108270191012489","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000904","11.153","0.004","14.833","0.003","19.332","0.005","90","","90","","90","","3198.1","1.6","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C28 H36 I2 N2 O4 S2 -","- C28 H36 I2 N2 O4 S2 -","- C112 H144 I8 N8 O16 S8 -","4","1","AL0477","Anderson, M.; Gallagher, T.; Mahon, M. F.; Molloy, K. C.; Shaw, R.","Structure of (<i>Z</i>,<i>Z</i>)-3,11-diiodo-<i>N</i>,<i>N</i>-ditosyl-1,9-diazacyclohexadeca-3,11-diene","Acta Crystallographica Section C","1992","48","5","883","885","10.1107/S0108270191011782","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000905","26.085","0.007","7.211","0.002","13.653","0.006","90","","90","","90","","2568.1","1.5","","","","","","","","","","","","3","P b c n","","","","","","- C15 H18 O3 -","- C15 H18 O3 -","- C120 H144 O24 -","8","1","PA0239","Rodier, N.; Zhang, Y. M.; Mayrargue, J.","Spiro[(2,3-époxycyclohexane)-1:4'-(2',3'-dihydro-8'-méthoxybenzo-4<i>H</i>-pyranne)]","Acta Crystallographica Section C","1992","48","5","885","887","10.1107/S0108270191011605","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000906","14.696","0.003","14.696","0.003","15.853","0.003","90","","90","","90","","3423.8","1.2","","","","","","","","","","","","4","I 41/a","I 4bw -1bw","","","","","- C20 H16 Br2 N2 -","- C20 H16 Br2 N2 -","- C160 H128 Br16 N16 -","8","","AS0544","Mori, Y.; Matsuyama, Y.; Yamada, S.; Maeda, K.","Structures of 2,2'-polymethylene-1,1'-biisoquinolinium dibromides","Acta Crystallographica Section C","1992","48","5","894","897","10.1107/S0108270191011885","","","0.71068","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000907","9.934","0.002","13.285","0.003","7.969","0.001","95.32","0.01","92.64","0.02","114.7","0.02","947.2","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H20 Br2 N2 O -","- C21 H20 Br2 N2 O -","- C42 H40 Br4 N4 O2 -","2","1","AS0544","Mori, Y.; Matsuyama, Y.; Yamada, S.; Maeda, K.","Structures of 2,2'-polymethylene-1,1'-biisoquinolinium dibromides","Acta Crystallographica Section C","1992","48","5","894","897","10.1107/S0108270191011885","","","0.71068","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000908","9.714","0.003","10.087","0.005","15.758","0.008","90","","91.67","0.04","90","","1543.4","1.2","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C19 H18 N2 O -","- C19 H18 N2 O -","- C76 H72 N8 O4 -","4","1","AL0503","Wallis, J. D.","The first structure of a benzo[<i>b</i>][1,4]diazocine","Acta Crystallographica Section C","1992","48","5","897","899","10.1107/S0108270191012337","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000909","11.814","0.005","7.803","0.001","10.871","0.004","90","","91.41","0.04","90","","1001.8","0.6","","","","","","","","","","","","2","P 1 21 1","","","","","","- C34 H18 -","- C34 H18 -","- C68 H36 -","2","1","AS0534","Izuoka, A.; Wakui, K.; Fukuda, T.; Sato, N.; Sugawara, T.","Refined molecular structure of tetrabenzo[<i>de</i>,<i>hi</i>,<i>op</i>,<i>st</i>]pentacene","Acta Crystallographica Section C","1992","48","5","900","902","10.1107/S0108270191011800","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000910","9.799","0.001","11.853","0.001","17.316","0.002","90","","90","","90","","2011.2","0.4","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C21 H22 N2 O4 S -","- C21 H22 N2 O4 S -","- C84 H88 N8 O16 S4 -","4","1","LI0088","Begum, N. S.; Venkatesan, K.","Studies on nonlinear optical materials: structure of diphenylmethyl (<i>Z</i>)-1-(1-methylthio-2-nitrovinyl)tetrahydropyrrole-2-carboxylate","Acta Crystallographica Section C","1992","48","5","902","905","10.1107/S0108270191011836","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000911","5.074","0.003","8.611","0.003","17.476","0.004","90","","94.57","0.04","90","","761.1","0.6","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H8 N2 O3 -","- C7 H8 N2 O3 -","- C28 H32 N8 O12 -","4","1","BR0006","Tari, L. W.; Secco, A. S.","Structure of 1-acetylthymine","Acta Crystallographica Section C","1992","48","5","905","907","10.1107/S0108270191012556","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000912","13.664","0.007","16.783","0.008","16.702","0.008","90","","111.68","0.04","90","","3559","3","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- C43 H36 P2 Pt -","- C43 H35 P2 Pt -","- C172 H140 P8 Pt4 -","4","1","ST0542","Abboud, K. A.; Lu, Z.; Jones, W. M.","Structure of [(1,2-η^2^)-1,3,5,7-cycloheptatetraene]bis(triphenylphosphine)platinum(0)","Acta Crystallographica Section C","1992","48","5","909","912","10.1107/S0108270191011289","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000913","11.191","0.003","11.512","0.003","13.134","0.003","65.35","0.02","77.58","0.02","66.31","0.02","1406","0.7","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C39 H86 B2 Cl4 F8 P4 Pt2 -","- C39.6 H87.2 B2 Cl5.2 F8 P4 Pt2 -","- C39.6 H87.2 B2 Cl5.2 F8 P4 Pt2 -","1","0.5","LI0109","Litster, S. A.; Mole, L.; Redhouse, A. D.; Spencer, J. L.","Structure of di-μ-chloro-bis[1,3-bis(di-<i>tert</i>-butylphosphino)propaneplatinum(II)] tetrafluoroborate 0.8-dichloromethane solvate","Acta Crystallographica Section C","1992","48","5","913","915","10.1107/S0108270191012611","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","278247","2022-09-28","15:09:31",""
"2000914","13.192","0.005","13.192","0.005","52.83","0.02","90","","90","","120","","7962","5","","","","","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","","","- C54 H81 Au Cl O4 P3 -","- C54 H81 Au Cl O4 P3 -","- C324 H486 Au6 Cl6 O24 P18 -","6","0.333333","ST0543","Muir, J. A.; Cuadrado, S. I.; Muir, M. M.","Structure of tris(dicyclohexylphenylphosphine)gold(I) perchlorate","Acta Crystallographica Section C","1992","48","5","915","917","10.1107/S0108270191011551","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","203906","2020-10-21","18:00:00",""
"2000915","9.023","0.001","13.881","0.002","7.341","0.001","90","","97.8","0.2","90","","910.9","0.5","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C3 H6 Cl4 Cu N2 O -","- C3 H6 Cl4 Cu N2 O -","- C12 H24 Cl16 Cu4 N8 O4 -","4","1","GE0278","Valle, G.; Ettorre, R.","Structure of 2-chloroimidazolium aquatrichlorocuprate(II)","Acta Crystallographica Section C","1992","48","5","919","921","10.1107/S0108270191011757","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000916","12.123","0.002","13.851","0.003","15.028","0.003","59.99","0.02","61.53","0.02","69.15","0.02","1897.9","0.8","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H44 Fe Ge N4 O4 -","- C40 H44 Fe Ge N4 O4 -","- C80 H88 Fe2 Ge2 N8 O8 -","2","1","PA0240","Habbou, A.; Lecomte, C.; Barbe, J. M.","Structure of tetracarbonyl[(2,3,7,8,12,13,17,18-octaethylporphinato)germanio(IV)]iron","Acta Crystallographica Section C","1992","48","5","921","923","10.1107/S0108270191012635","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2000917","12.714","0.005","14.726","0.002","7.453","0.004","90","","90","","90","","1395.4","0.9","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C12 H17 Cl N O2 P -","- C12 H17 Cl N O2 P -","- C48 H68 Cl4 N4 O8 P4 -","4","1","CR0375","Robinson, P. D.; Hua, D. H.; Roche, D.","Structure of (2<i>R</i>,4<i>R</i>,5<i>R</i>)-2-chloro-3-isopropyl-4-methyl-5-phenyl-1,3,2-oxazaphospholidine 2-oxide","Acta Crystallographica Section C","1992","48","5","923","925","10.1107/S0108270191010727","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000918","10.063","0.001","8.206","0.001","14.856","0.001","90","","104.84","0.01","90","","1185.8","0.2","","","","","","","","","","","","6","P 1 21 1","","","","","","- C21 H28 Cl2 N O5 P -","- C21 H28 Cl2 N O5 P -","- C42 H56 Cl4 N2 O10 P2 -","2","1","AB0249","Bruins Slot, H. J.; Leusen, F. J. J.; van der Haest, A. D.; van Bolhuis, F.","Structures of a pair of diastereomeric salts of ephedrine and dichloro-substituted cyclic phosphoric acid","Acta Crystallographica Section C","1992","48","5","925","929","10.1107/S0108270191011721","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000919","6.502","0.001","11.393","0.001","32.739","0.001","90","","90","","90","","2425.2","0.4","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H30 Cl2 N O6 P -","- C21 H30 Cl2 N O6 P -","- C84 H120 Cl8 N4 O24 P4 -","4","1","AB0249","Bruins Slot, H. J.; Leusen, F. J. J.; van der Haest, A. D.; van Bolhuis, F.","Structures of a pair of diastereomeric salts of ephedrine and dichloro-substituted cyclic phosphoric acid","Acta Crystallographica Section C","1992","48","5","925","929","10.1107/S0108270191011721","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000920","8.742","0.001","10.982","0.001","17.302","0.002","90","","90","","90","","1661.1","0.3","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 N O9 -","- C14 H19 N O9 -","- C56 H76 N4 O36 -","4","1","LI0112","Ondráček, J.; Novotný, J.; Kefurt, K.; Havlíček, J.","Structure of 2,3,4,5-tetra-<i>O</i>-acetyl-6-amino-6-deoxy-<small>D</small>-mannonolactam","Acta Crystallographica Section C","1992","48","5","929","930","10.1107/S010827019101171X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000921","25.259","0.002","4.876","0.002","28.326","0.002","90","","96.215","0.002","90","","3468.2","1.5","","","","","","","","","","","","5","I 1 2/a 1","-I 2ya","","","","","- C20 H18 Br N O4 -","- C20 H18 Br N O4 -","- C160 H144 Br8 N8 O32 -","8","1","AB0225","Atkinson, A. M.; Rogers, D.","Structure of 4-bromo-13α-methyl-13aα<i>H</i>-tetrahydropseudocoptisin","Acta Crystallographica Section C","1992","48","5","931","932","10.1107/S0108270191011666","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000922","7.366","0.003","12.006","0.004","20.601","0.005","90","","90","","90","","1821.9","1.1","","","","","","","","","","","","4","P b c n","","","","","","- C21 H13 Br2 N3 -","- C21 H13 Br2 N3 -","- C84 H52 Br8 N12 -","4","0.5","HA0084","Constable, E. C.; Khan, F. K.; Marquez, V. E.; Raithby, P. R.","6,6''-Dibromo-4'-phenyl-2,2':6',2''-terpyridine","Acta Crystallographica Section C","1992","48","5","932","934","10.1107/S0108270191012015","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000923","10.186","0.001","5.546","0.001","33.232","0.002","90","","98.48","0.04","90","","1856.8","0.4","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H26 O3 -","- C21 H26 O3 -","- C84 H104 O12 -","4","1","AL0492","Brito, I.; Cataldo, F.; Astudillo, L.; Rivera, P.","Structure of octabenzone","Acta Crystallographica Section C","1992","48","5","934","936","10.1107/S0108270191011496","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:52",""
"2000924","7.0784","0.0008","12.1106","0.0008","22.721","0.002","90","","90","","90","","1947.7","0.3","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C23 H20 O5 -","- C23 H20 O5 -","- C92 H80 O20 -","4","1","ST0538","Prince, P.; Evans, K. L.; Fronczek, F. R.; Gandour, R. D.","Methyl 8-[(2,6-dimethoxyphenyl)ethynyl]-7-methoxy-2-naphthoate","Acta Crystallographica Section C","1992","48","5","936","938","10.1107/S0108270191011277","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000925","12.771","0.007","7.873","0.005","11.571","0.004","90","","112.47","0.03","90","","1075.1","1","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H9 N O -","- C14 H9 N O -","- C56 H36 N4 O4 -","4","1","AL0513","Preut, H.; Kolev, T.; Juchnovski, I.; Bleckmann, P.","Structure of 2-cyanobenzophenone","Acta Crystallographica Section C","1992","48","5","938","940","10.1107/S0108270191012544","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000926","16.288","0.0006","7.5741","0.0003","22.6836","0.0008","90","","96.606","0.004","90","","2779.83","0.18","","","","","","","","","","","","5","I 1 2/a 1","","","","","","- C18 H28 N10 Ni O16 -","- C18 H28 N10 Ni O16 -","- C72 H112 N40 Ni4 O64 -","4","0.5","AL0511","Clegg, W.; Bharadwaj, P. K.; Mandal, S.","Structure of [Ni(OH~2~)~2~(NH~2~CH~2~CH~2~CH~2~NH~2~)~2~][picrate]~2~","Acta Crystallographica Section C","1992","48","5","942","943","10.1107/S0108270191012672","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000927","10.131","0.001","10.131","0.001","14.913","0.003","90","","90","","120","","1325.6","0.3","","","","","","","","","","","","4","P 32","","","","","","- C20 H23 N O4 -","- C20 H23 N O4 -","- C60 H69 N3 O12 -","3","1","KA0008","Ribár, B.; Radivojević, P.; Gašić, O.; Kanyó, I.; Golič, L.","Structure of isocorypalmine","Acta Crystallographica Section C","1992","48","5","944","945","10.1107/S0108270191011575","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000928","7.536","0.005","9.926","0.008","23.397","0.016","90","","90","","90","","1750","2","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C20 H23 N O4 -","- C20 H23 N O4 -","- C80 H92 N4 O16 -","4","1","KA0010","Ribár, B.; Lazar, D.; Gašić, O.; Kanyó, I.; Engel, P.","Structure of isocorydine","Acta Crystallographica Section C","1992","48","5","945","947","10.1107/S0108270191011587","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000929","9.232","0.003","14.561","0.001","12.446","0.003","90","","91.07","0.01","90","","1672.8","0.7","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H21 N2 O2 P -","- C18 H21 N2 O2 P -","- C72 H84 N8 O8 P4 -","4","1","AB0242","Liu, X. L.; Sun, M.; Miao, F. M.; Feng, K. S.; Chen, R. Y.","Structure of 3,3-diethyl-1,2-diphenyl-1,4,2-diazaphospholidine-5-one 2-oxide","Acta Crystallographica Section C","1992","48","5","947","949","10.1107/S0108270191011678","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000930","16.159","0.007","17.958","0.002","16.159","0.007","90","","96.41","0.02","90","","4660","3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C30 H14 N4 S2 -","- C30 H14 N4 S2 -","- C240 H112 N32 S16 -","8","2","AB0246","Thorup, N.; Hjorth, M.; Larsen, J.; Bechgaard, K.","Structure of a dibenzo[<i>d</i>,<i>d</i>']benzo[1,2-<i>b</i>:4,3-<i>b</i>']dithiophene (DBBDT) complex with 7,7,8,8-tetracyano-<i>p</i>-quinodimethane (TCNQ)","Acta Crystallographica Section C","1992","48","5","949","951","10.1107/S0108270191012453","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000931","12.2","0.007","16.795","0.002","16.655","0.001","90","","104.18","0.03","90","","3309","2","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C19 H21 N3 O -","- C19 H21 N3 O -","- C152 H168 N24 O8 -","8","2","LI0101","Delboni, L. F.; Oliva, G.","Structure of (3<i>R</i>,6<i>S</i>,12b<i>R</i>)-6-cyanomethyl-3-ethyl-2-oxo-1,2,3,4,7,7a,12a,12b-octahydro-6<i>H</i>-indolo[2,3-<i>a</i>]quinolizine","Acta Crystallographica Section C","1992","48","5","953","955","10.1107/S0108270191011617","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000932","9.009","0.005","7.882","0.002","15.072","0.007","90","","98.61","0.06","90","","1058.2","0.8","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C11 H11 N3 O2 -","- C11 H11 N3 O2 -","- C44 H44 N12 O8 -","4","1","KA0007","Martin-Ramos, J. D.; Reinoso, M. D.; Navarrete, A.","Structure of (<i>E</i>)-4-hydroxyiminomethyl-1-(<i>p</i>-methoxyphenyl)imidazole","Acta Crystallographica Section C","1992","48","5","957","959","10.1107/S0108270191012064","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000933","8.486","0.002","12.387","0.003","26.244","0.005","90","","90","","90","","2758.7","1.1","","","","","","","","","","","","3","P b c 21","","","","","","- C18 H13 P -","- C18 H13 P -","- C144 H104 P8 -","8","2","CD0078","Alyea, E. C.; Ferguson, G.; Gallagher, J. F.","Structure of 5-phenyldibenzophosphole","Acta Crystallographica Section C","1992","48","5","959","961","10.1107/S0108270191014105","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","194537","2020-10-21","18:00:00",""
"2000934","13.768","0.002","9.947","0.002","9.825","0.003","110.98","0.03","105.54","0.02","94.45","0.03","1187.7","0.6","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 Cl N3 -","- C12 H12 Cl N3 -","- C48 H48 Cl4 N12 -","4","2","PA0238","Bocelli, G.; Cantoni, A.","<i>N</i>-(4-Chlorobenzylidene)-2-(4-imidazolyl)ethylamine","Acta Crystallographica Section C","1992","48","5","961","963","10.1107/S0108270191012623","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000935","18.234","0.002","11.984","0.001","7.468","0.001","90","","113.95","0.02","90","","1491.4","0.4","297","","","","","","","","","","","4","C 1 2/c 1","","","","2-methyl-4,6-diphenyl-1,2,3-triazinium iodide","","- C16 H14 I N3 -","- C16 H17 I N3 -","- C64 H68 I4 N12 -","4","0.5","AS1000","Yamaguchi, K.; Itoh, T.; Okada, M.; Ohsawa, A.","2-Methyl-4,6-diphenyl-1,2,3-triazinium iodide","Acta Crystallographica Section C","1992","48","5","964","965","10.1107/S0108270192002269","","","1.5405","CuKα~1~","","","0.048","","","0.047","","","","","1.398","1.398","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000936","9.437","0.001","9.437","0.001","10.69","0.001","90","","90","","120","","824.47","0.15","295","","","","","","","","","","","4","P 32 2 1","P 32 2""","","","","","- C8 H16 N2 O4 -","- C8 H16 N2 O4 -","- C24 H48 N6 O12 -","3","0.5","AB1002","Rychlewska, U.","Unusual conformation of (<i>R</i>,<i>R</i>)-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethyltartramide (I) and its <i>O</i>,<i>O</i>'-dibenzoyl derivative (II)","Acta Crystallographica Section C","1992","48","5","965","969","10.1107/S0108270192000921","","","1.54178","CuKα","","","0.035","","","0.05","","","","","4","4","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000937","9.578","0.001","13.692","0.001","8.508","0.001","90","","102.783","0.009","90","","1088.1","0.19","295","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H24 N2 O6 -","- C22 H24 N2 O6 -","- C44 H48 N4 O12 -","2","1","AB1002","Rychlewska, U.","Unusual conformation of (<i>R</i>,<i>R</i>)-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethyltartramide (I) and its <i>O</i>,<i>O</i>'-dibenzoyl derivative (II)","Acta Crystallographica Section C","1992","48","5","965","969","10.1107/S0108270192000921","","","1.54178","CuKα","","","0.036","","","0.05","","","","","3.4","3.4","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000938","16.495","0.007","10.841","0.006","9.118","0.004","90","","104.03","0.03","90","","1581.9","1.3","130","","","","","","","","","","","5","C 1 c 1","C -2yc","","","","","- C10 H22 Cu N4 O9 -","- C10 H22 Cu N4 O9 -","- C40 H88 Cu4 N16 O36 -","4","1","AB1000","Noll, B. C.; Marusak, R. A.","Structure of aqua[<i>N</i>,<i>N</i>'-ethylenebis(<i>N</i>-carbamoylmethylglycinato)]copper(II) dihydrate","Acta Crystallographica Section C","1992","48","5","969","972","10.1107/S0108270192001781","","","0.71069","MoKα","","","0.0293","","","0.0352","","","","","1.65","1.65","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000939","13.672","0.003","13.672","0.003","12.908","0.005","90","","90","","120","","2089.6","1","","","","","","","","","","","","5","P -3 m 1","-P 3 2""","","","","","- H13.5 K5.5 O30 Sb W6 -","- K10 O33 Sb W6 -","- K20 O66 Sb2 W12 -","2","0.166667","AS0506","Naruke, H.; Yamase, T.","Structure of a photoluminescent polyoxotungstoantimonate","Acta Crystallographica Section C","1992","48","4","597","599","10.1107/S0108270191010478","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000940","7.376","0.002","12.452","0.002","12.173","0.001","90","","90.04","0.01","90","","1118","0.4","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Ba H8 O12 Re2 -","- Ba H8 O12 Re2 -","- Ba4 H32 O48 Re8 -","4","1","AB0240","Macíček, J.; Todorov, T.","Structure of a barium perrhenate tetrahydrate","Acta Crystallographica Section C","1992","48","4","599","603","10.1107/S0108270191011125","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2000941","10.4775","0.0006","6.0856","0.0011","15.4206","0.0011","90","","102.919","0.009","90","","958.4","0.2","","","","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","","- D O8 Rb3 Se2 -","- D O8 Rb3 Se2 -","- D4 O32 Rb12 Se8 -","4","0.5","AB0220","Ichikawa, M.; Gustafsson, T.; Olovsson, I.","Structure of Rb~3~D(SeO~4~)~2~ at 25, 110 and 297 K","Acta Crystallographica Section C","1992","48","4","603","607","10.1107/S0108270191011708","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205826","2020-10-21","18:00:00",""
"2000942","10.4019","0.0007","6.049","0.0011","15.3206","0.0014","90","","102.827","0.008","90","","939.9","0.2","","","","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","","- D O8 Rb3 Se2 -","- D O8 Rb3 Se2 -","- D4 O32 Rb12 Se8 -","4","0.5","AB0220","Ichikawa, M.; Gustafsson, T.; Olovsson, I.","Structure of Rb~3~D(SeO~4~)~2~ at 25, 110 and 297 K","Acta Crystallographica Section C","1992","48","4","603","607","10.1107/S0108270191011708","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205826","2020-10-21","18:00:00",""
"2000943","10.3827","0.0007","6.039","0.0011","15.2935","0.0013","90","","102.816","0.008","90","","935","0.2","","","","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","","- D O8 Rb3 Se2 -","- D O8 Rb3 Se2 -","- D4 O32 Rb12 Se8 -","4","0.5","AB0220","Ichikawa, M.; Gustafsson, T.; Olovsson, I.","Structure of Rb~3~D(SeO~4~)~2~ at 25, 110 and 297 K","Acta Crystallographica Section C","1992","48","4","603","607","10.1107/S0108270191011708","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205826","2020-10-21","18:00:00",""
"2000944","9.829","0.001","9.829","0.001","9.829","0.001","90","","90","","90","","949.6","0.4","","","","","","","","","","","","3","P a -3","-P 2ac 2ab 3","","","","","- Li7 N4 Nb -","- Li7 N4 Nb -","- Li56 N32 Nb8 -","8","0.333333","CR0379","Vennos, D. A.; DiSalvo, F. J.","Structure of lithium niobium nitride","Acta Crystallographica Section C","1992","48","4","610","612","10.1107/S0108270191011654","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000945","11.668","0.0008","10.589","0.001","15.097","0.003","90","","99.754","0.009","90","","1838.3","0.4","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C21 H22 In P -","- C21 H9 In P -","- C84 H36 In4 P4 -","4","1","AB0237","Schumann, H.; Ghodsi, T.; Esser, L.","A monomeric cyclopentadienyl indium complex. Structure of [η^5^-(diphenylphosphino)tetramethylcyclopentadienyl]indium(I)","Acta Crystallographica Section C","1992","48","4","618","620","10.1107/S0108270191010442","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000946","7.44","0.001","14.678","0.003","16.903","0.003","90","","90.845","0.001","90","","1845.7","0.6","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H26 Cl2 Cu N4 O8 -","- C10 H26 Cl2 Cu N4 O8 -","- C40 H104 Cl8 Cu4 N16 O32 -","4","1","AS0518","Hsieh, Y.-L.; Lu, T.-H.; Liou, Y.-L.; Chung, C.-S.","Structure of perchlorato[(2<i>S</i>,6<i>R</i>,9<i>S</i>,13<i>R</i>)-2,6,9,13-tetraazatetradecane]copper(II) perchlorate","Acta Crystallographica Section C","1992","48","4","620","623","10.1107/S0108270191011174","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2000947","10.698","0.002","25.533","0.004","7.315","0.002","90","","101.83","0.01","90","","1955.7","0.7","","","","","","","","","","","","5","C 1 c 1","C -2yc","","","","","- C16 H13 Cl4 Fe N4 -","- C16 H12 Cl4 Fe N4 -","- C64 H48 Cl16 Fe4 N16 -","4","1","GE0274","Barbaro, P.; Bianchini, C.; Fochi, M.; Masi, D.; Mealli, C.","Adduct of two 1,8-naphthyridine molecules (one protonated) with tetrachloroferrate (III)","Acta Crystallographica Section C","1992","48","4","625","627","10.1107/S0108270191011149","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000948","11.31","0.003","18.146","0.011","18.926","0.004","90","","90","","90","","3884","3","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C12 H31 B9 O Ru -","- C12 H31 B9 O Ru -","- C96 H248 B72 O8 Ru8 -","8","2","MU0284","Macgregor, S. A.; Welch, A. J.; Yellowlees, L. J.","5-(η-<i>p</i>-Cymene)-6-ethoxy-5-ruthena-<i>nido</i>-decaborane(12)","Acta Crystallographica Section C","1992","48","4","629","633","10.1107/S0108270191010934","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","190560","2020-10-21","18:00:00",""
"2000949","12.434","0.002","11.913","0.003","18.822","0.004","90","","115.31","0.01","90","","2520.4","0.9","","","","","","","","","","","","5","P 1 c 1","P -2yc","","","","","- C18 H38 N2 S4 Sn -","- C18 H38 N2 S4 Sn -","- C72 H152 N8 S16 Sn4 -","4","2","MU0247","Vrábel, V.; Lokaj, J.; Kellö, E.; Garaj, J.; Batsanov, A. C.; Struchkov, Yu. T.","Structure of di(<i>n</i>-butyl)bis(<i>N</i>,<i>N</i>-diethyldithiocarbamato)tin(IV) at 153 K","Acta Crystallographica Section C","1992","48","4","633","635","10.1107/S0108270191010454","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000950","10.271","0.004","11.401","0.003","19.426","0.004","74.86","0.02","88.51","0.03","83.51","0.03","2181.7","1.1","","","","","","","","","","","","8","P -1","-P 1","2","","","","- C38.95 H45.9 B9 Cl1.9 O P2 Rh S -","- C38.95 H45.9 B9 Cl1.9 O P2 Rh S -","- C77.9 H91.8 B18 Cl3.8 O2 P4 Rh2 S2 -","2","1","CD0064","Murphy, M.; Spalding, T. R.; Ferguson, G.; Gallagher, J. F.","[8,8-(PPh~3~)~2~-9-(OEt)-8,7-RhSB~9~H~9~].0.95(CH~2~Cl~2~)","Acta Crystallographica Section C","1992","48","4","638","641","10.1107/S0108270191011861","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","278247","2022-09-28","15:09:31",""
"2000951","10.244","0.002","9.844","0.001","15.532","0.003","90","","92.1","0.01","90","","1565.2","0.5","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H52 O2 Zn2 -","- C32 H52 O2 Zn2 -","- C64 H104 O4 Zn4 -","2","0.5","CR0347","Parvez, M.; BergStresser, G. L.; Richey, Jnr, H. G.","Dimeric ethyl(2,6-di-<i>tert</i>-butylphenoxy)zinc","Acta Crystallographica Section C","1992","48","4","641","644","10.1107/S0108270191011381","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2000952","6.618","0.002","9.0321","0.001","11.75","0.002","101.68","0.01","99","0.02","103.52","0.02","653.3","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H12 Fe2 O3 -","- C14 H12 Fe2 O3 -","- C28 H24 Fe4 O6 -","2","1","ST0504","Altbach, M. I.; Fronczek, F. R.; Butler, L. G.","Structure of a new polymorph of <i>cis</i>-[(μ-CH~2~)(μ-CO){Fe(η^5^-C~5~H~5~)CO}~2~]","Acta Crystallographica Section C","1992","48","4","644","650","10.1107/S010827019101123X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000953","7.296","0.001","10.11","0.003","12.814","0.004","90.84","0.02","101.17","0.02","92.52","0.02","926.1","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H26 Cl4 N2 Zn -","- C10 H26 Cl4 N2 Zn -","- C20 H52 Cl8 N4 Zn2 -","2","1","MU0179","Guo, N.; Lin, Y.-H.; Zeng, G.-F.; Xi, S.-Q.","Structure of 1,10-diaminodecane tetrachlorozincate","Acta Crystallographica Section C","1992","48","4","650","652","10.1107/S0108270191008922","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000954","9.101","0.002","20.681","0.003","11.101","0.001","90","","93.55","0.02","90","","2085.4","0.6","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H36 Cu2 N4 O8 -","- C52 H36 Cu2 N4 O8 -","- C104 H72 Cu4 N8 O16 -","2","0.5","HE0022","Liu, S.-X.; Yu, Y.-P.","Structure of a copper complex of an α-hydroxylated acid: [Cu(C~14~H~8~O~3~)(C~12~H~8~N~2~)]~2~.2H~2~O","Acta Crystallographica Section C","1992","48","4","652","655","10.1107/S0108270191007564","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2000955","9.185","0.004","11.179","0.002","8.396","0.002","103.82","0.02","105.49","0.03","99.38","0.03","782.7","0.5","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C11 H16 Cl2 O Pt S Te -","- C11 H15 Cl2 O Pt S Te -","- C22 H30 Cl4 O2 Pt2 S2 Te2 -","2","1","BR0005","Singh, A. K.; Srivastava, V.; Dhingra, S. K.; Drake, J. E.; Bailey, J. H. E.","<i>cis</i>-Dichloro[2-(4-ethoxyphenyltelluro)ethyl methyl sulfide-<i>S</i>,<i>Te</i>]platinum(II) <i>cis</i>-PtCl~2~[Te(C~6~H~4~OC~2~H~5~)CH~2~CH~2~(CH~3~)S]","Acta Crystallographica Section C","1992","48","4","655","657","10.1107/S010827019101096X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000956","22.924","0.001","7.5051","0.0004","15.274","0.01","90","","129.071","0.003","90","","2040.2","1.3","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C10 H8 Br N O3 -","- C10 H8 Br N O3 -","- C80 H64 Br8 N8 O24 -","8","1","AL0485","De, A.","Structure of a potential anticonvulsant: 5'-bromospiro[1,3-dioxolane-2,3'-indolin]-2'-one","Acta Crystallographica Section C","1992","48","4","660","662","10.1107/S0108270191010831","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000957","8.134","0.002","8.877","0.003","16.681","0.004","90","","90.77","0.02","90","","1204.4","0.6","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 O2 -","- C16 H14 O2 -","- C64 H56 O8 -","4","1","HA0065","Kohnke, F. H.; Mathias, J. P.; Stoddart, J. F.; Slawin, A. M. Z.; Williams, D. J.","<i>rel</i>-(1<i>R</i>,4<i>S</i>,5<i>R</i>,8<i>S</i>)-1,4:5,8-Diepoxy-1,4,5,8-tetrahydro-9,10-dimethylphenanthrene","Acta Crystallographica Section C","1992","48","4","663","665","10.1107/S010827019100940X","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","206335","2020-10-21","18:00:00",""
"2000958","11.7413","0.0005","13.0279","0.0005","16.2332","0.0009","99.456","0.004","94.217","0.004","101.893","0.004","2381.9","0.2","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C49 H64 Cl2 F2 O6 -","- C24.5 H31 Cl2 F O3 -","- C98 H124 Cl8 F4 O12 -","4","2","CR0324","Ammon, H. L.; Prasad, S. M.; Kumar, N.","Structure of RG-12561 dichloromethane solvate and a diastereomer","Acta Crystallographica Section C","1992","48","4","669","675","10.1107/S0108270191010077","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000959","6.054","0.002","12.931","0.002","14.838","0.003","67.7","0.02","85.75","0.02","82.85","0.02","1065.9","0.5","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H31 F O3 -","- C24 H31 F O3 -","- C48 H62 F2 O6 -","2","1","CR0324","Ammon, H. L.; Prasad, S. M.; Kumar, N.","Structure of RG-12561 dichloromethane solvate and a diastereomer","Acta Crystallographica Section C","1992","48","4","669","675","10.1107/S0108270191010077","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000960","12.369","0.002","5.564","0.001","23.044","0.004","90","","100.49","0.02","90","","1559.4","0.5","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C15 H17 Br N2 O3 -","- C15 H17 Br N2 O3 -","- C60 H68 Br4 N8 O12 -","4","1","AL0472","Kwiatkowski, W.; Karolak-Wojciechowska, J.","Structure and conformation of <i>N</i>-(morpholinomethyl)-<i>m</i>-bromophenylsuccinimide","Acta Crystallographica Section C","1992","48","4","678","680","10.1107/S0108270191010569","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000961","9.089","0.002","17.737","0.002","14.265","0.002","90","","125.65","0.02","90","","1868.7","0.7","","","","","","","","","","","","3","P 1 c 1","P -2yc","","","","","- C13 H8 O2 -","- C13 H8 O2 -","- C104 H64 O16 -","8","4","AS0524","Mochida, T.; Matsumiya, S.; Izuoka, A.; Sato, N.; Sugawara, T.; Sugawara, Y.","Structure of 3-hydroxyphenalenone","Acta Crystallographica Section C","1992","48","4","680","683","10.1107/S010827019101048X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000962","7.743","0.002","12.43","0.005","12.776","0.005","90","","90.52","0.03","90","","1229.6","0.8","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C13 H12 N2 O S -","- C13 H12 N2 O S -","- C52 H48 N8 O4 S4 -","4","1","BR0004","Tari, L. W.; McKinnon, D. M.; Secco, A. S.","Structure of 5-(1-methyl-2,1-benzisothiazol-3-ylideneamino)-2,4-pentadienal","Acta Crystallographica Section C","1992","48","4","683","686","10.1107/S0108270191010570","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000963","9.19","0.006","19.485","0.012","9.57","0.006","90","","103.66","0.05","90","","1665.2","1.9","","","","","","","","","","","","4","C 1 c 1","C -2yc","","","","","- C19 H21 O2 P -","- C21 H21 O2 P -","- C84 H84 O8 P4 -","4","1","AB0234","Steel, P. J.; Battiste, M. A.; Campbell, C. R.","Structures of three 1-[(diphenylphosphinoyl)methyl]cyclohexanols","Acta Crystallographica Section C","1992","48","4","690","693","10.1107/S0108270191010430","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000964","9.24","0.004","19.529","0.008","9.736","0.006","90","","103.88","0.04","90","","1705.5","1.5","","","","","","","","","","","","4","C 1 c 1","C -2yc","","","","","- C19 H21 O3 P -","- C19 O4 P -","- C76 O16 P4 -","4","1","AB0234","Steel, P. J.; Battiste, M. A.; Campbell, C. R.","Structures of three 1-[(diphenylphosphinoyl)methyl]cyclohexanols","Acta Crystallographica Section C","1992","48","4","690","693","10.1107/S0108270191010430","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000965","5.836","0.003","11.837","0.008","13.242","0.007","75.09","0.05","81.25","0.04","83.86","0.05","871.5","0.9","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H25 O4 P -","- C20 O4 P -","- C40 O8 P2 -","2","1","AB0234","Steel, P. J.; Battiste, M. A.; Campbell, C. R.","Structures of three 1-[(diphenylphosphinoyl)methyl]cyclohexanols","Acta Crystallographica Section C","1992","48","4","690","693","10.1107/S0108270191010430","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000966","8.991","0.009","6.247","0.007","13.611","0.015","90","","92.53","0.06","90","","763.7","1.4","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H21 Na2 O14 P -","- C6 H21 Na2 O14 P -","- C12 H42 Na4 O28 P2 -","2","1","MU0275","Lis, T.; Weichsel, A.","Structure of disodium β-<small>D</small>-fructopyranose 1-phosphate pentahydrate","Acta Crystallographica Section C","1992","48","4","693","696","10.1107/S0108270191010922","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000967","25.442","0.008","10.051","0.003","27.062","0.01","90","","94.5","0.1","90","","6899","4","","","","","","","","","","","","3","C 1 c 1","C -2yc","","","","","- C73 H108 O12 -","- C73 H108 O12 -","- C292 H432 O48 -","4","1","GE0280","Millini, R.; Del Piero, G.; Bracci, M.","Structure of 1,3,4,5-neopentanetetrayl tetrakis[3-(3,5-di-<i>tert</i>-butyl-4-hydroxyphenyl)propionate]","Acta Crystallographica Section C","1992","48","4","696","699","10.1107/S0108270191010557","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000968","11.998","0.003","12.678","0.004","12.181","0.006","90","","115.96","0.03","90","","1665.9","1.1","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C8 H20 P2 S5 -","- C8 H20 P2 S5 -","- C32 H80 P8 S20 -","4","1","CR0349","Gallacher, A. C.; Pinkerton, A. A.","Bis(diethylthiophosphoryl) trisulfide","Acta Crystallographica Section C","1992","48","4","701","703","10.1107/S010827019101082X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000969","6.3863","0.0008","14.346","0.002","17.247","0.002","90","","90","","90","","1580.1","0.3","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C13 H25 N3 O4 -","- C13 H25 N3 O4 -","- C52 H100 N12 O16 -","4","1","GE0277","Puliti, R.; Mattia, C. A.; Lilley, T. H.","Structure of <i>N</i>-acetyl-<small>L</small>-leucyl-<small>L</small>-prolinamide monohydrate","Acta Crystallographica Section C","1992","48","4","709","712","10.1107/S0108270191011162","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000970","29.027","0.007","7.26","0.02","5.917","0.003","90","","101.38","0.03","90","","1222","3","","","","","","","","","","","","4","C 1 c 1","C -2yc","","","","","- C15 H11 Br O -","- C15 H11 Br O -","- C60 H44 Br4 O4 -","4","1","CR0360","Li, Z.; Pa, F.; Su, G.","Structure of 4-bromochalcone","Acta Crystallographica Section C","1992","48","4","712","714","10.1107/S0108270191011137","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000971","12.9884","0.0005","4.6517","0.0001","20.787","0.0011","90","","102.436","0.003","90","","1226.44","0.09","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C5 H8 N2 O2 -","- C5 H10 N2 O2 -","- C40 H80 N16 O16 -","8","1","AL0499","Llamas-Saiz, A. L.; Foces-Foces, C.; Elguero, J.; Meutermans, W.","Structure of 3,5-pyrazoledimethanol: an X-ray and ^13^C solid-state NMR study","Acta Crystallographica Section C","1992","48","4","714","717","10.1107/S0108270191011228","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000972","5.638","0.003","7.828","0.002","20.045","0.003","90","","95.05","0.02","90","","881.2","0.5","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H10 O3 S -","- C8 H10 O3 S -","- C32 H40 O12 S4 -","4","1","AL0512","Chaloner, P. A.; Harrison, R. M.; Hitchcock, P. B.; Pedersen, R. T.","Structure of 4-methoxyphenyl methyl sulfone and a redetermination of the structure of methyl phenyl sulfone","Acta Crystallographica Section C","1992","48","4","717","720","10.1107/S0108270191012520","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000973","8.172","0.002","9.095","0.002","10.844","0.013","90","","111.66","0.05","90","","749.1","1","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 O2 S -","- C7 H8 O2 S -","- C28 H32 O8 S4 -","4","1","AL0512","Chaloner, P. A.; Harrison, R. M.; Hitchcock, P. B.; Pedersen, R. T.","Structure of 4-methoxyphenyl methyl sulfone and a redetermination of the structure of methyl phenyl sulfone","Acta Crystallographica Section C","1992","48","4","717","720","10.1107/S0108270191012520","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2000974","7.199","0.001","12.157","0.002","33.888","0.002","90","","90","","90","","2965.8","0.7","","","","","","","","","","","","3","P 21 21 21","P 2 2ab","","","","","- C32 H54 O4 -","- C30 H48 O3 -","- C120 H192 O12 -","4","1","PA0243","Simon, A.; Delage, C.; Saux, M.; Chulia, A. J.; Najid, A.; Rigaud, M.","Structure of ursolic acid ethanol solvate","Acta Crystallographica Section C","1992","48","4","726","728","10.1107/S0108270191012581","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000975","4.3725","0.0001","11.679","0.0003","5.411","0.0001","90","","90","","90","","276.32","0.011","","","","","","","","","","","","4","C m c m","-C 2c 2","","","","","- Cu K0.95 O2 Sr0.05 -","- Cu K O2 Sr -","- Cu4 K4 O8 Sr4 -","4","0.25","HA0076","Abrahams, I.; Pienkowski, M. C.; Bruce, P. G.; Edwards, P. P.","Structure of potassium strontium cuprate, K~0.95~Sr~0.05~CuO~2~","Acta Crystallographica Section C","1992","48","4","731","733","10.1107/S0108270191011629","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000976","11.304","0.002","5.316","0.002","6.64","0.002","90","","90","","90","","399","0.2","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Nb O5 P -","- Nb O5 P -","- Nb4 O20 P4 -","4","0.5","ST0536","Serra, D. L.; Hwu, S.-J.","Structure of orthorhombic NbPO~5~","Acta Crystallographica Section C","1992","48","4","733","735","10.1107/S0108270191011265","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2000977","11.666","0.001","18.885","0.003","19.492","0.002","90","","97.07","0.01","90","","4261.7","0.9","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C44.5 H43 Cl F6 Ir P3 -","- C45 H42 Cl3 F6 Ir P3 -","- C180 H168 Cl12 F24 Ir4 P12 -","4","1","AL0495","Chaloner, P. A.; Hitchcock, P. B.; Reisinger, M.","Structure of an iridium bis(phosphine)diene complex, a catalyst for homogeneous hydrogenation","Acta Crystallographica Section C","1992","48","4","735","737","10.1107/S0108270191010521","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000978","6.892","0.001","19.692","0.002","6.439","0.001","90","","90","","90","","873.9","0.2","","","","","","","","","","","","5","I m a 2","","","","","","- C6 H8 N Na O5 -","- C6 H8 N Na O5 -","- C24 H32 N4 Na4 O20 -","4","0.5","AS0531","Minemoto, H.; Sonoda, N.; Miki, K.","Structure of sodium <i>p</i>-nitrophenolate dihydrate","Acta Crystallographica Section C","1992","48","4","737","738","10.1107/S0108270191010764","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000979","14.389","0.009","13.782","0.01","8.615","0.007","90","","123.01","0.06","90","","1433","2","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C24 H54 P2 Pd -","- C24 H54 P2 Pd -","- C48 H108 P4 Pd2 -","2","0.5","AS0519","Tanaka, M.","Structure of bis(tri-<i>tert</i>-butylphosphine)palladium(0)","Acta Crystallographica Section C","1992","48","4","739","740","10.1107/S0108270191010491","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000980","8.599","0.002","12.07","0.003","14.583","0.003","90","","94.64","0.02","90","","1508.6","0.6","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C13 H22 Cl2 Pt -","- C13 H22 Cl2 Pt -","- C52 H88 Cl8 Pt4 -","4","1","ST0537","Rheingold, A. L.; Jacobson, K. A.","Dichloro(3-isopropyl-1,2,4,5,5-pentamethylcyclopenta-1,3-diene)platinum(II)","Acta Crystallographica Section C","1992","48","4","740","741","10.1107/S0108270191010582","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000981","7.007","0.001","8.468","0.002","9.537","0.004","90","","109.4","0.4","90","","533.8","1.3","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C10 H11 Cl2 Co -","- C10 H11 Cl2 Co -","- C20 H22 Cl4 Co2 -","2","0.5","BX0559","Sens, I.; Ruhlandt-Senge, K.; Müller, U.","Cobaltocenium-hydrogendichlorid, [CoCp~2~]HCl~2~","Acta Crystallographica Section C","1992","48","4","742","743","10.1107/S0108270191011472","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","205956","2020-10-21","18:00:00",""
"2000982","17.757","0.003","6.1899","0.0006","15.637","0.005","90","","115.45","0.02","90","","1551.9","0.6","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C2 H20 Br2 N4 O7 Pt S2 -","- C2 H20 Br2 N4 O7 Pt S2 -","- C8 H80 Br8 N16 O28 Pt4 S8 -","4","1","DU0315","Khodadad, P.; Rodier, N.","Bis(méthanesulfonate) de tétraammine-<i>trans</i>-dibromoplatine(IV) monohydrate","Acta Crystallographica Section C","1992","48","4","743","745","10.1107/S0108270191011393","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2000983","11.0716","0.0004","11.6305","0.0004","22.6463","0.0009","90","","90","","90","","2916.12","0.19","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H29 Cl5 N2 Pt Sn -","- C26 H29 Cl5 N2 Pt Sn -","- C104 H116 Cl20 N8 Pt4 Sn4 -","4","1","GE0285","Smeets, W. J. J.; Spek, A. L.; van Beek, J. A. M.; van Koten, G.","Structure of <i>a</i>-chloro-<i>b</i>-dichloromethylstannio-[<i>dc</i>,<i>ef</i>-bis(8-dimethylamino-1-naphthyl)]platinum(IV)","Acta Crystallographica Section C","1992","48","4","745","747","10.1107/S0108270191011812","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2000984","15.796","0.004","7.332","0.002","14.498","0.004","90","","113.3","0.02","90","","1542.2","0.8","","","","","","","","","","","","3","C 1 2 1","C 2y","","","","","- C20 H14 N2 -","- C20 H14 N2 -","- C80 H56 N8 -","4","1","AL0501","Preut, H.; Bleckmann, P.; Kolev, T.; Juchnovski, I.","Structure of <i>N</i>-[(4-cyanophenyl)(phenyl)methylene]aniline","Acta Crystallographica Section C","1992","48","4","754","756","10.1107/S0108270191011290","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000985","10.2612","0.0008","8.167","0.0008","15.2974","0.0012","90","","108.885","0.006","90","","1212.96","0.18","","","","","","","","","","","","5","P 1 21 1","","","","","","- C10 H11 N O6 S -","- C10 H11 N O6 S -","- C40 H44 N4 O24 S4 -","4","2","ST0535","Sun, G.; Fronczek, F. R.; Gandour, R. D.","(<i>R</i>)-(1-Methyloxiranyl)methyl 4-nitrobenzenesulfonate","Acta Crystallographica Section C","1992","48","4","758","760","10.1107/S0108270191010995","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000986","8.892","0.002","5.108","0.002","18.573","0.003","90","","98.22","0.02","90","","834.9","0.4","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 N O3 -","- C10 H7 N O3 -","- C40 H28 N4 O12 -","4","1","LI0085","Zukerman-Schpector, J.; Castellano, E. E.; Pinto, A. D. C.; da Silva, J. F. M.; Barcellos, M. T. F. C.","Structure of 1-acetylindole-2,3-dione","Acta Crystallographica Section C","1992","48","4","760","762","10.1107/S0108270191006947","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2000987","12.521","0.001","29.271","0.003","6.779","0.001","90","","90","","90","","2484.5","0.5","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C29 H42 O4 -","- C29 H42 O4 -","- C116 H168 O16 -","4","1","AS0539","Nakai, H.","Structure of a glycyrrhetinic acid derivative","Acta Crystallographica Section C","1992","48","4","762","763","10.1107/S0108270191011034","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","192203","2020-10-21","18:00:00",""
"2000988","12.8584","0.0013","5.0051","0.0002","19.381","0.002","90","","109.141","0.009","90","","1178.36","0.19","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 O4 -","- C15 H10 O4 -","- C60 H40 O16 -","4","1","ST0544","Huang, E. T.; Evans, K. L.; Fronczek, F. R.; Gandour, R. D.","2-[(2,6-Dihydroxyphenyl)ethynyl]benzoic acid","Acta Crystallographica Section C","1992","48","4","763","765","10.1107/S0108270191010594","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2000989","5.9476","0.0004","8.1253","0.001","12.0198","0.0012","90","","100.938","0.007","90","","570.32","0.1","","","","","","","","","","","","3","P 1 21 1","","","","","","- C15 H10 O4 -","- C15 H10 O4 -","- C30 H20 O8 -","2","1","ST0545","Huang, E. T.; Evans, K. L.; Fronczek, F. R.; Gandour, R. D.","3-(2,6-Dihydroxyphenyl)-1<i>H</i>-2-benzopyran-1-one","Acta Crystallographica Section C","1992","48","4","765","767","10.1107/S0108270191010600","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000990","8.588","0.001","24.28","0.003","13.992","0.002","90","","90","","90","","2917.6","0.6","","","","","","","","","","","","4","P b c a","","","","","","- C16 H11 I Te -","- C16 H11 I Te -","- C128 H88 I8 Te8 -","8","1","LI0110","Zukerman-Schpector, J.; Dabdoub, M. J.; Dabdoub, V. B.; Pereira, M. A.","Structure of 3-iodo-2,5-diphenyltellurophene, C~16~H~11~ITe","Acta Crystallographica Section C","1992","48","4","767","768","10.1107/S0108270191011484","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000991","15.8556","0.0004","15.8556","0.0004","15.8556","0.0004","90","","90","","90","","3986.1","0.17","","","","","","","","","","","","3","P a -3","-P 2ac 2ab 3","","","","","- Al2 O6 Sr3 -","- Al2 O6 Sr3 -","- Al48 O144 Sr72 -","24","1","ST0526","Chakoumakos, B. C.; Lager, G. A.; Fernandez-Baca, J. A.","Refinement of the structures of Sr~3~Al~2~O~6~ and the hydrogarnet Sr~3~Al~2~(O~4~D~4~)~3~ by Rietveld analysis of neutron powder diffraction data","Acta Crystallographica Section C","1992","48","3","414","419","10.1107/S0108270191010211","","neutron","1.4","Neutron","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2000992","13.0319","0.0001","13.0319","0.0001","13.0319","0.0001","90","","90","","90","","2213.21","0.03","","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 D12 O12 Sr3 -","- Al2 D12 O12 Sr3 -","- Al16 D96 O96 Sr24 -","8","0.0833333","ST0526","Chakoumakos, B. C.; Lager, G. A.; Fernandez-Baca, J. A.","Refinement of the structures of Sr~3~Al~2~O~6~ and the hydrogarnet Sr~3~Al~2~(O~4~D~4~)~3~ by Rietveld analysis of neutron powder diffraction data","Acta Crystallographica Section C","1992","48","3","414","419","10.1107/S0108270191010211","","neutron","1.4","Neutron","","","","","","","","","","","","","","","","","has coordinates","205968","2020-10-21","18:00:00",""
"2000993","15.7575","0.0019","5.7373","0.0015","11.339","0.0019","90","","111.193","0.01","90","","955.8","0.3","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- Br H2 Na O5 -","- Br H2 Na O5 -","- Br8 H16 Na8 O40 -","8","1","CR0334","Blackburn, A. C.; Gallucci, J. C.; Gerkin, R. E.; Reppart, W. J.","Structure of sodium perbromate monohydrate","Acta Crystallographica Section C","1992","48","3","419","424","10.1107/S0108270191010818","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2000994","5.184","0.003","5.341","0.005","12.124","0.009","84.69","0.07","86.72","0.06","86.36","0.07","333.1","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H12 O14 P2 Zn -","- C6 H12 O14 P2 Zn -","- C6 H12 O14 P2 Zn -","1","0.5","MU0276","Lis, T.","Structure of zinc(II), magnesium(II) and manganese(II) bis(phosphoenolpyruvate) dihydrate","Acta Crystallographica Section C","1992","48","3","424","427","10.1107/S0108270191008958","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000995","5.172","0.003","5.333","0.003","12.184","0.006","85.3","0.04","86.9","0.04","86.56","0.04","333.9","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H12 Mg O14 P2 -","- C6 H12 Mg O14 P2 -","- C6 H12 Mg O14 P2 -","1","0.5","MU0276","Lis, T.","Structure of zinc(II), magnesium(II) and manganese(II) bis(phosphoenolpyruvate) dihydrate","Acta Crystallographica Section C","1992","48","3","424","427","10.1107/S0108270191008958","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000996","5.277","0.003","5.443","0.003","12.09","0.006","83.74","0.04","86.35","0.04","85.96","0.04","343.8","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H12 Mn O14 P2 -","- C6 H12 Mn O14 P2 -","- C6 H12 Mn O14 P2 -","1","0.5","MU0276","Lis, T.","Structure of zinc(II), magnesium(II) and manganese(II) bis(phosphoenolpyruvate) dihydrate","Acta Crystallographica Section C","1992","48","3","424","427","10.1107/S0108270191008958","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2000997","9.769","0.001","9.08","0.001","12.474","0.002","90","","100.98","0.08","90","","1086.2","0.4","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C3 H18 Co N5 O6 S -","- C3 H17.5 Co N5 O6 S -","- C12 H70 Co4 N20 O24 S4 -","4","2","MU0224","Prelesnik, B.; Andjelković, K.; Juranić, N.","Structure of [(<i>S</i>)-alaninato]tetraamminecobalt(III) sulfate","Acta Crystallographica Section C","1992","48","3","427","429","10.1107/S0108270191008946","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2000998","15.794","0.002","12.02","0.003","17.119","0.002","90","","98.21","0.01","90","","3216.6","1","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C24 H43 B9 P3 Rh S -","- C24 H43 B9 P3 Rh S -","- C96 H172 B36 P12 Rh4 S4 -","4","1","MU0280","Ferguson, G.; Lough, A. J.; Coughlan, S.; Spalding, T. R.","Structure of <i>nido</i>-[8,8,8-(PMe~2~Ph)~3~-8,7-RhSB~9~H~10~]","Acta Crystallographica Section C","1992","48","3","440","443","10.1107/S0108270191009721","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","190560","2020-10-21","18:00:00",""
"2000999","9.52","0.002","9.549","0.003","7.86","0.001","105.88","0.02","110.29","0.01","100.89","0.02","611.9","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H7 Na O8 -","- C14 H7 Na O8 -","- C28 H14 Na2 O16 -","2","1","ST0534","Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E.","Structure of the sodium salt of 1,4,5,8-naphthalenetetracarboxylic acid 4,5-anhydride hydrate","Acta Crystallographica Section C","1992","48","3","460","465","10.1107/S0108270191010983","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001000","12.791","0.002","13.097","0.002","7.439","0.0009","90","","90","","90","","1246.2","0.3","","","","","","","","","","","","5","P n a 21","P 2c -2n","","","","","- C9 H18 I N O2 -","- C8 H14 I N O2 -","- C32 H56 I4 N4 O8 -","4","1","AB0199","Frydenvang, K.; Jensen, B.","Structures of muscarone iodide and muscarone picrate","Acta Crystallographica Section C","1992","48","3","469","474","10.1107/S0108270191006169","","","0.71073","Mo","","","","","","","","","","","","","","","","warnings","has coordinates","249442","2020-10-21","18:00:00",""
"2001001","6.584","0.003","23.127","0.006","11.962","0.003","91.02","0.02","104.76","0.03","90.37","0.03","1760.9","1.1","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H20 N4 O9 -","- C15 H20 N4 O9 -","- C60 H80 N16 O36 -","4","2","AB0199","Frydenvang, K.; Jensen, B.","Structures of muscarone iodide and muscarone picrate","Acta Crystallographica Section C","1992","48","3","469","474","10.1107/S0108270191006169","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001002","10.591","0.001","11.133","0.001","13.657","0.002","90","","90","","90","","1610.3","0.3","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C19 H26 O4 -","- C20 H23 O5 -","- C80 H92 O20 -","4","1","AL0474","Dastidar, P.; Shankar, V. N.; Madyastha, K. M.; Guru Row, T. N.","Structure of 9α,19-dihydroxy-4-androstene-3,17-dione","Acta Crystallographica Section C","1992","48","3","486","488","10.1107/S0108270191009319","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001003","8.331","0.003","21.731","0.006","8.804","0.003","90","","95.61","0.02","90","","1586.3","0.9","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","","","","","- C20 H22 -","- C20 H22 -","- C80 H88 -","4","1","MU0272","Polborn, K.; Knorr, R.; Böhrer, P.","Front strain in the structure of 2-benzylidene-1,1,3,3-tetramethylindan, a sterically congested styrene","Acta Crystallographica Section C","1992","48","3","490","492","10.1107/S0108270191008466","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001004","8.646","0.001","10.132","0.001","11.765","0.002","69.82","0.01","86.38","0.01","84.97","0.01","963","0.2","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H21 N4 O7 P -","- C15 N4 O7 P -","- C30 N8 O14 P2 -","2","1","BX0557","Engelhardt, U.; Simon, A.","<i>N</i>-Methyl- und <i>N</i>-Ethoxycarbonyl-substituierter Phosphor-Hydrazin-Heterocyclus mit Twist-Konformation","Acta Crystallographica Section C","1992","48","3","495","498","10.1107/S0108270191009940","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001005","6.918","0.001","12.27","0.001","9.283","0.001","90","","104.13","0.02","90","","764.14","0.17","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C18 H16 O4 S2 -","- C18 O4 S2 -","- C36 O8 S4 -","2","0.5","AL0473","Olivé, J. L.; Saaedan, A.; El Amoudi, M. S.; Geneste, P.; Rambaud, J.; Declercq, J.-P.","Structure of the head-to-tail <i>cis</i>-<i>anti</i>-<i>cis</i> photodimer of 2-methylbenzo[<i>b</i>]thiophene 1,1-dioxide","Acta Crystallographica Section C","1992","48","3","501","503","10.1107/S0108270191009198","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001006","25.184","0.003","7.797","0.001","15.174","0.003","90","","121.05","0.01","90","","2552.6","0.7","","","","","","","","","","","","3","C 1 2 1","C 2y","","","","","- C26 H46 O6 -","- C26 H46 O6 -","- C104 H184 O24 -","4","1","AS0515","Miki, K.; Masui, A.; Kasai, N.; Goonewardena, W.; Shibakami, M.; Takemoto, K.; Miyata, M.","Structures of 1:1 addition compounds of methyl cholate with methanol and with 2-propanol","Acta Crystallographica Section C","1992","48","3","503","507","10.1107/S0108270191009307","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001007","25.835","0.002","8.137","0.001","15.553","0.002","90","","121.08","0.01","90","","2800.2","0.6","","","","","","","","","","","","3","C 1 2 1","C 2y","","","","","- C28 H50 O6 -","- C28 H50 O6 -","- C112 H200 O24 -","4","1","AS0515","Miki, K.; Masui, A.; Kasai, N.; Goonewardena, W.; Shibakami, M.; Takemoto, K.; Miyata, M.","Structures of 1:1 addition compounds of methyl cholate with methanol and with 2-propanol","Acta Crystallographica Section C","1992","48","3","503","507","10.1107/S0108270191009307","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001008","10.512","0.002","11.203","0.002","14.469","0.002","111.49","0.01","105.74","0.01","95.82","0.01","1487.2","0.5","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H35 Cl N4 O4 -","- C30 H35 Cl N4 O4 -","- C60 H70 Cl2 N8 O8 -","2","1","AS0520","Kuroda, R.; Shinomiya, M.","Structures of new DNA photocleaving agents: 3,6-bis(dimethylamino)-10-[6-(4-nitrobenzoyloxy)hexyl]acridinium chloride (1) and 9-{[6-(4-nitrobenzoyloxy)hexyl]amino}acridinium chloride monohydrate (II)","Acta Crystallographica Section C","1992","48","3","512","515","10.1107/S0108270191009563","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates,has disorder","278247","2022-09-28","15:09:31",""
"2001009","9.481","0.0008","14.495","0.002","9.255","0.001","95.48","0.01","98.17","0.01","101.78","0.01","1222.2","0.2","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 Cl N3 O5 -","- C26 H28 Cl N3 O5 -","- C52 H56 Cl2 N6 O10 -","2","1","AS0520","Kuroda, R.; Shinomiya, M.","Structures of new DNA photocleaving agents: 3,6-bis(dimethylamino)-10-[6-(4-nitrobenzoyloxy)hexyl]acridinium chloride (1) and 9-{[6-(4-nitrobenzoyloxy)hexyl]amino}acridinium chloride monohydrate (II)","Acta Crystallographica Section C","1992","48","3","512","515","10.1107/S0108270191009563","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001010","6.607","0.002","14.988","0.002","16.803","0.003","78.27","0.01","88.55","0.02","87.78","0.02","1627.7","0.6","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H16 F6 P S16 -","- C20 F6 P S16 -","- C40 F12 P2 S32 -","2","1","CR0328","Bu, X.; Cisarova, I.; Coppens, P.; Lederle, B.; Naughton, M. J.","Structure and conductivity of a new phase of 3,4;3',4'-bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalene hexafluorophosphate: γ-(BEDT-TTF)~2~PF~6~","Acta Crystallographica Section C","1992","48","3","516","519","10.1107/S0108270191009320","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001011","11.596","0.002","14.757","0.003","8.126","0.001","90","","110.48","0.02","90","","1302.6","0.4","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H17 N O -","- C17 H17 N O -","- C68 H68 N4 O4 -","4","1","AL0446","Arriortua, M. I.; Urtiaga, M. K.; Domínguez, E.; Igartua, A.; Iriondo, C.; Solans, X.","(<i>E</i>)-3-Dimethylamino-1,2-diphenyl-2-propen-1-one: structure of an enaminone","Acta Crystallographica Section C","1992","48","3","528","530","10.1107/S0108270191009708","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001012","6.749","0.001","9.699","0.002","19.204","0.001","90","","90","","90","","1257.1","0.3","","","","","","","","","","","","4","P m n n","-P 2n 2","58","","","","- C32 H24 N4 O2 -","- C32 H24 N4 O2 -","- C64 H48 N8 O4 -","2","0.25","AB0239","Thorup, N.; Hjorth, M.; Christensen, J. B.; Bechgaard, K.","Structure of a charge-transfer complex of 3,8-diethyl-5,10-dimethyl-1,6-dioxapyrene (DEDMDOP) with 7,7,8,8-tetracyano-<i>p</i>-quinodimethane (TCNQ)","Acta Crystallographica Section C","1992","48","3","530","533","10.1107/S0108270191010284","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206034","2020-10-21","18:00:00",""
"2001013","7.162","0.001","7.162","0.001","37.235","0.007","90","","90","","120","","1654.1","0.5","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","","","","","- B6 Ba O12 Sr -","- B6 Ba2 O12 Sr -","- B36 Ba12 O72 Sr6 -","6","0.166667","LI0063","Huang, Q.; Huang, L.; Dai, G.; Liang, J.","Structure of Sr~<i>x~</i>Ba~3{-~<i>x</i>}(B~3~O~6~)~2~ in a solid solution","Acta Crystallographica Section C","1992","48","3","539","541","10.1107/S0108270191009228","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001014","10.703","0.002","10.653","0.001","10.852","0.002","90","","118.46","0.01","90","","1087.8","0.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C3 H12 Cl4 Co N2 -","- C3 H12 Cl4 Co N2 -","- C12 H48 Cl16 Co4 N8 -","4","1","MU0180","Guo, N.; Lin, Y.-H.; Zeng, G.-F.; Xi, S.-Q.","Structure of 1,3-propanediammonium tetrachlorocobaltate(II)","Acta Crystallographica Section C","1992","48","3","542","543","10.1107/S010827019100896X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001015","8.887","0.002","20.495","0.004","20.78","0.004","90","","90","","90","","3784.8","1.3","","","","","","","","","","","","7","P 21 n b","P -2bc 2a","33","","","","- C43 H37 Cl2 N P2 Ru S -","- C43 H37 Cl2 N P2 Ru S -","- C172 H148 Cl8 N4 P8 Ru4 S4 -","4","1","HE0034","Simpson, S. J.","(η^5^-Cyclopentadienyl)(thiocyanato-<i>N</i>)bis(triphenylphosphine)ruthenium dichloromethane solvate","Acta Crystallographica Section C","1992","48","3","544","545","10.1107/S010827019101106X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206033","2020-10-21","18:00:00",""
"2001016","13.004","0.002","10.968","0.002","11.23","0.001","114.42","0.01","87.57","0.01","112.54","0.01","1334.1","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C31 H28 O3 P Rh -","- C31 H28 O3 P Rh -","- C62 H56 O6 P2 Rh2 -","2","1","AB0211","Roodt, A.; Leipoldt, J. G.; Swarts, J. C.; Steyn, G. J. J.","Structure of (3-benzylacetylacetonato-κ^2^<i>O</i>,<i>O</i>')carbonyl(triphenylphosphine)rhodium(I)","Acta Crystallographica Section C","1992","48","3","547","549","10.1107/S0108270191009654","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001017","11.625","0.003","14.269","0.003","15.963","0.002","90.95","0.01","100.23","0.01","101.95","0.02","2546","1","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C49 H42 Fe N2 O4 P2 Ru -","- C49 H42 Fe N2 O4 P2 Ru -","- C98 H84 Fe2 N4 O8 P4 Ru2 -","2","1","MU0278","Numan, M.; Goubitz, K.; Schenk, H.; Kraakman, M. J. A.","Structure of 1,1,2,2-tetracarbonyl{<i>N</i>-[(2-pyridyl)methylidene]isopropylamine-μ-<i>N</i>^1^,2-σ-<i>N</i>^2^,1-η^2^-<i>CH</i>=<i>N</i>^1^}-1,2-bis(triphenylphosphine)ironruthenium(<i>Fe</i>-<i>Ru</i>)","Acta Crystallographica Section C","1992","48","3","549","551","10.1107/S0108270191009976","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001018","13.119","0.001","22.204","0.003","9.868","0.001","90","","90","","90","","2874.5","0.5","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C30 H38 O9 -","- C30 H38 O9 -","- C120 H152 O36 -","4","1","AS0528","Kubota, M.; Ohba, S.; Kosemura, S.; Matsunaga, K.; Yamamura, S.","Structure of citreohybridone A","Acta Crystallographica Section C","1992","48","3","552","554","10.1107/S0108270191009770","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001019","8.758","0.005","16.795","0.006","5.646","0.004","90","","90","","90","","830.5","0.8","","","","","","","","","","","","3","P n a 21","P 2c -2n","","","","","- C9 H7 N3 -","- C9 H7 N3 -","- C36 H28 N12 -","4","1","CR0366","Robinson, P. D.; Bausch, M. J.; Jirka, G. P.","Structure of 2-(4-aminophenyl)-1,3-propanedinitrile","Acta Crystallographica Section C","1992","48","3","554","556","10.1107/S0108270191010880","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001020","14.206","0.001","4.99","0.001","10.964","0.003","90","","111.68","0.01","90","","722.2","0.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H2 F10 N2 O2 -","- C14 H2 F10 N2 O2 -","- C28 H4 F20 N4 O4 -","2","0.5","AS0521","Yamaguchi, K.; Matsumura, G.; Haga, N.; Shudo, K.","Structure of <i>N</i>,<i>N</i>-bis(2,3,4,5,6-pentafluorophenyl)oxamide","Acta Crystallographica Section C","1992","48","3","558","559","10.1107/S0108270191009757","","","1.5405","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001021","7.594","0.001","24.316","0.004","6.298","0.004","90","","96.47","0.01","90","","1155.6","0.8","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H7 F4 N3 O -","- C12 H7 F4 N3 O -","- C48 H28 F16 N12 O4 -","4","1","AS0522","Yamaguchi, K.; Matsumura, G.; Haga, N.; Shudo, K.","Structure of <i>N</i>-(2,3,5,6-tetrafluoropyridyl)-<i>N</i>'-phenylurea","Acta Crystallographica Section C","1992","48","3","559","561","10.1107/S0108270191009769","","","1.5405","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001022","9.131","0.002","11.629","0.009","25.203","0.007","90","","90","","90","","2676","2","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C27 H36 O6 -","- C27 H30 O6 -","- C108 H120 O24 -","4","1","AB0226","Berg, J.-E.; Wahlberg, I.","Structure of a benzoyl derivative of an epidioxy-containing tobacco cembranoid","Acta Crystallographica Section C","1992","48","3","564","566","10.1107/S0108270191010363","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates,has disorder","199614","2020-10-21","18:00:00",""
"2001023","9.808","0.002","8.019","0.004","13.755","0.003","90","","105.73","0.02","90","","1041.3","0.6","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H36 O4 -","- C20 H36 O4 -","- C40 H72 O8 -","2","1","AB0228","Berg, J.-E.; Wahlberg, I.","Structure of a 7,8-epoxycembranoid isolated from tobacco","Acta Crystallographica Section C","1992","48","3","566","568","10.1107/S0108270191010326","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001024","12.207","0.001","14.715","0.001","11.572","0.001","90","","90","","90","","2078.6","0.3","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C24 H29 F O4 -","- C24 H29 F O4 -","- C96 H116 F4 O16 -","4","1","CR0365","Wawrzak, Z.; Griffin, J. F.; Strong, P. D.; Duax, W. L.","Structure of 6-fluoro-1β,2β-methylene-3,20-dioxo-9β,10α-pregna-4,6-dien-17α-yl acetate","Acta Crystallographica Section C","1992","48","3","570","572","10.1107/S0108270191010715","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001025","9.976","0.004","6.96","0.004","11.906","0.004","90","","93.67","0.03","90","","825","0.6","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H18 O6 -","- C20 H18 O6 -","- C40 H36 O12 -","2","1","ST0541","Baures, P. W.; Miski, M.; Eggleston, D. S.","Structure of sesamin","Acta Crystallographica Section C","1992","48","3","574","576","10.1107/S010827019101034X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001026","9.636","0.005","13.906","0.004","9.293","0.004","108.25","0.02","109.91","0.02","88.17","0.03","1108","0.8","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C14 H12 O2 -","- C14 H12 O2 -","- C56 H48 O8 -","4","2","MU0277","Guo, S.; Su, G.; Pan, F.; He, Y.","Structure of 4-methoxybenzophenone","Acta Crystallographica Section C","1992","48","3","576","578","10.1107/S0108270191010351","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001027","7.03","0.003","13.55","0.01","15.4","0.01","90","","114.77","0.03","90","","1332","1.5","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C15 H9 Cl N2 O3 -","- C15 H9 Cl N2 O3 -","- C60 H36 Cl4 N8 O12 -","4","1","ST0539","Muir, M. M.; Cox, O.; Bernard, L.; Muir, J. A.","Structure of a styrylbenzoxazole derivative","Acta Crystallographica Section C","1992","48","3","583","585","10.1107/S0108270191011009","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001028","10.122","0.001","7.826","0.001","13.715","0.001","90","","92.99","0.01","90","","1084.95","0.19","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H29 F N O5 P -","- C21 H29 F N O5 P -","- C42 H58 F2 N2 O10 P2 -","2","1","AB0244","Bruins Slot, H. J.; Leusen, F. J. J.; van der Haest, A. D.; van Bolhuis, F.","Structures of a pair of diastereomeric salts of ephedrine and fluoro-substituted cyclic phosphoric acid","Acta Crystallographica Section C","1992","48","3","587","590","10.1107/S0108270191011204","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001029","9.679","0.001","8.115","0.001","13.797","0.001","90","","98.14","0.02","90","","1072.8","0.2","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H29 F N O5 P -","- C21 H29 F N O5 P -","- C42 H58 F2 N2 O10 P2 -","2","1","AB0244","Bruins Slot, H. J.; Leusen, F. J. J.; van der Haest, A. D.; van Bolhuis, F.","Structures of a pair of diastereomeric salts of ephedrine and fluoro-substituted cyclic phosphoric acid","Acta Crystallographica Section C","1992","48","3","587","590","10.1107/S0108270191011204","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001030","5.8653","0.0002","11.1843","0.0007","15.9975","0.0012","90","","93.308","0.004","90","","1047.68","0.11","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","1-(2,3-Dideoxy-3-fluoro-β-D-erythro-pento-furanosyl)-5-fluorouracil","","- C9 H10 F2 N2 O4 -","- C9 H10 F2 N2 O4 -","- C36 H40 F8 N8 O16 -","4","2","GE0282","Everaert, D. H.; Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.; Van Aerschot, A.; Herdewijn, P.","Structure of a nucleoside analogue 2',3'-dideoxy-3',5-difluorouridine","Acta Crystallographica Section C","1992","48","3","590","592","10.1107/S0108270191011022","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates,has disorder","205898","2020-10-21","18:00:00",""
"2001031","11.419","0.005","20.749","0.008","8.946","0.003","90","","101.85","0.03","90","","2074.4","1.4","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","cis-2-(tert-Butyl)-4-(p-chlorophenylthio)-3-(phenylacetyl)-1,3-oxazolidin-5- one","","- C21 H22 Cl N O3 S -","- C21 H22 Cl N O3 S -","- C84 H88 Cl4 N4 O12 S4 -","4","1","HL0011","Beckwith, A. L. J.; Chai, C. L. L.; Willis, A. C.","<i>cis</i>-2-(<i>tert</i>-Butyl)-4-(<i>p</i>-chlorophenylthio)-3-phenylacetyl-1,3-oxazolidin-5-one","Acta Crystallographica Section C","1992","48","3","593","594","10.1107/S0108270191014051","","","0.71069","MolybdenumKα","","0.134","0.044","","0.066","0.046","","","","1.255","1.371","1.371","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001032","5.615","0.001","5.615","0.001","18.667","0.003","90","","90","","120","","509.69","0.15","","","","","","","","","","","","4","R -3 m","-R 3 2""","","","","","- K2 Mn O6 Se2 -","- K2 Mn O6 Se2 -","- K6 Mn3 O18 Se6 -","3","","BX0571","Wildner, M.","Structure of K~2~Mn(SeO~3~)~2~, a further buetschliite-type selenite","Acta Crystallographica Section C","1992","48","3","595","","10.1107/S0108270191012350","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001033","8.853","0.001","8.853","0.001","8.853","0.001","90","","90","","90","","693.86","0.14","","","","","","","","","","","","5","P 21 3","P 2ac 2ab 3","","","","","- C3 Fe N O4 Tl -","- C3 Fe N O4 Tl -","- C12 Fe4 N4 O16 Tl4 -","4","0.333333","AL0488","Clarkson, L. M.; Clegg, W.; Hockless, D. C. R.; Norman, N. C.","Structure of a thallium(I) transition-metal carbonyl salt Tl[Fe(CO)~3~(NO)]","Acta Crystallographica Section C","1992","48","2","236","239","10.1107/S0108270191010405","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001034","6.408","0.001","10.752","0.001","11.134","0.002","90","","100.44","0.01","90","","754.42","0.19","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C2 H20 Al N O14 S2 -","- C2 H16 Al N2 O14 S2 -","- C4 H32 Al2 N4 O28 S4 -","2","0.5","GE0269","Galešić, N.; Jordanovska, V. B.","Structures of dimethylammonium metal(III) sulfate hexahydrates (metal = Al, Cr)","Acta Crystallographica Section C","1992","48","2","256","258","10.1107/S0108270191009435","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001035","6.391","0.008","10.748","0.003","11.4","0.01","90","","100.87","0.06","90","","769","1.2","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C2 H20 Cr N O14 S2 -","- C2 H16 Cr N2 O14 S2 -","- C4 H32 Cr2 N4 O28 S4 -","2","0.5","GE0269","Galešić, N.; Jordanovska, V. B.","Structures of dimethylammonium metal(III) sulfate hexahydrates (metal = Al, Cr)","Acta Crystallographica Section C","1992","48","2","256","258","10.1107/S0108270191009435","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001036","8.174","0.002","14.171","0.003","12.553","0.002","90","","96.25","0.01","90","","1445.4","0.5","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C6 H20 Cl4 Cu N2 -","- C6 H20 Cl4 Cu N2 -","- C24 H80 Cl16 Cu4 N8 -","4","1","ST0513","Williams, I. D.; Brown, P. W.; Taylor, N. J.","Structures of trimethylammonium tetrachlorometallates","Acta Crystallographica Section C","1992","48","2","259","263","10.1107/S0108270191010193","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001037","10.66","0.001","9.629","0.001","14.991","0.002","90","","90","","90","","1538.8","0.3","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C6 H20 Cl4 N2 Zn -","- C9 H3 Cl4 N2 Zn -","- C36 H12 Cl16 N8 Zn4 -","4","0.5","ST0513","Williams, I. D.; Brown, P. W.; Taylor, N. J.","Structures of trimethylammonium tetrachlorometallates","Acta Crystallographica Section C","1992","48","2","259","263","10.1107/S0108270191010193","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001038","8.541","0.001","11.44","0.002","13.311","0.002","90","","90.02","0.01","90","","1300.6","0.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H16 Cl4 Co N2 -","- C4 H16 Cl4 Co N2 -","- C16 H64 Cl16 Co4 N8 -","4","1","ST0514","Williams, I. D.; Brown, P. W.; Taylor, N. J.","235 K structural phase transition in dimethylammonium tetrachlorocobaltate(II)","Acta Crystallographica Section C","1992","48","2","263","266","10.1107/S010827019101020X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001039","7.803","0.002","11.285","0.003","14.523","0.004","90","","96.11","0.02","90","","1271.6","0.6","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H16 Cl4 Co N2 -","- C4 H16 Cl4 Co N2 -","- C16 H64 Cl16 Co4 N8 -","4","1","ST0514","Williams, I. D.; Brown, P. W.; Taylor, N. J.","235 K structural phase transition in dimethylammonium tetrachlorocobaltate(II)","Acta Crystallographica Section C","1992","48","2","263","266","10.1107/S010827019101020X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001040","6.619","0.003","11.708","0.004","13.995","0.005","90","","100.15","0.03","90","","1067.6","0.7","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H6 Cr O3 S -","- C12 H5 Cr O3 -","- C48 H20 Cr4 O12 -","4","1","HE0015","Kumar Das, P.; Mukhopadhyay, A.; Ray, S.; Bhattacharya (née Mazumdar), S.; Datta, S.; De, A.","Disorder in the structure of (η^6^-benzo[<i>b</i>]thiophene)tricarbonylchromium(0)","Acta Crystallographica Section C","1992","48","2","266","268","10.1107/S0108270191009253","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001041","9.548","0.002","15.814","0.003","10.66","0.002","90","","91.89","0.02","90","","1608.7","0.5","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H18 Cu N6 O2 S2 -","- C10 H18 Cu N6 O2 S2 -","- C40 H72 Cu4 N24 O8 S8 -","4","1","AS0493","Lu, T.-H.; Wang, C.-C.; Liou, Y.-L.; Chung, C.-S.","Structure of (4,7-diazadecanediamide-<i>N</i>,<i>N</i>',<i>O</i>)diisothiocyanatocopper(II)","Acta Crystallographica Section C","1992","48","2","269","271","10.1107/S0108270191009629","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001042","14.769","0.003","13.558","0.001","9.056","0.002","90","","105.281","0.003","90","","1749.2","0.5","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H25 Cl3 Co N5 O5 -","- C8 H25 Cl3 Co N5 O5 -","- C32 H100 Cl12 Co4 N20 O20 -","4","1","AL0478","Gatehouse, B. M.; Martin, R. L.; McLachlan, G.; Platts, S. N.; Spiccia, L.","Structure of <i>N</i>,<i>N</i>-bis(2-aminoethyl)diethylenetriamine(chloro)cobalt(III) chloride perchlorate hydrate","Acta Crystallographica Section C","1992","48","2","271","274","10.1107/S0108270191009423","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001043","40.8","0.01","10.882","0.005","10.966","0.005","90","","90","","90","","4869","3","","","","","","","","","","","","6","P n a 21","P 2c -2n","","","","","- C6 H18 Cl2 Co N2 O2 -","- C6 H18 Cl2 Co N2 O2 -","- C96 H288 Cl32 Co16 N32 O32 -","16","4","MU0274","Jin, S.; Nieuwenhuyzen, M.; Robinson, W. T.; Wilkins, C. J.","Structures of dichlorobis(trimethylamine oxide)cobalt(II), diiodobis(trimethylamine oxide)cobalt(II), dichlorobis(trimethylamine oxide)zinc and dibromobis(trimethylamine oxide)zinc","Acta Crystallographica Section C","1992","48","2","274","279","10.1107/S0108270191010223","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","189124","2020-10-21","18:00:00",""
"2001044","11.742","0.004","11.291","0.003","10.404","0.003","90","","90","","90","","1379.4","0.7","","","","","","","","","","","","6","P b c n","-P 2n 2ab","","","","","- C6 H18 Co I2 N2 O2 -","- C6 H18 Co I2 N2 O2 -","- C24 H72 Co4 I8 N8 O8 -","4","0.5","MU0274","Jin, S.; Nieuwenhuyzen, M.; Robinson, W. T.; Wilkins, C. J.","Structures of dichlorobis(trimethylamine oxide)cobalt(II), diiodobis(trimethylamine oxide)cobalt(II), dichlorobis(trimethylamine oxide)zinc and dibromobis(trimethylamine oxide)zinc","Acta Crystallographica Section C","1992","48","2","274","279","10.1107/S0108270191010223","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001045","9.756","0.003","10.383","0.003","6.558","0.002","90","","109.13","0.02","90","","627.6","0.3","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C6 H18 Cl2 N2 O2 Zn -","- C6 H18 Cl2 N2 O2 Zn -","- C12 H36 Cl4 N4 O4 Zn2 -","2","1","MU0274","Jin, S.; Nieuwenhuyzen, M.; Robinson, W. T.; Wilkins, C. J.","Structures of dichlorobis(trimethylamine oxide)cobalt(II), diiodobis(trimethylamine oxide)cobalt(II), dichlorobis(trimethylamine oxide)zinc and dibromobis(trimethylamine oxide)zinc","Acta Crystallographica Section C","1992","48","2","274","279","10.1107/S0108270191010223","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001046","11.27","0.003","11.053","0.003","10.206","0.003","90","","90","","90","","1271.3","0.6","","","","","","","","","","","","6","P b c n","-P 2n 2ab","","","","","- C6 H18 Br2 N2 O2 Zn -","- C6 H18 Br2 N2 O2 Zn -","- C24 H72 Br8 N8 O8 Zn4 -","4","0.5","MU0274","Jin, S.; Nieuwenhuyzen, M.; Robinson, W. T.; Wilkins, C. J.","Structures of dichlorobis(trimethylamine oxide)cobalt(II), diiodobis(trimethylamine oxide)cobalt(II), dichlorobis(trimethylamine oxide)zinc and dibromobis(trimethylamine oxide)zinc","Acta Crystallographica Section C","1992","48","2","274","279","10.1107/S0108270191010223","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001047","15.694","0.007","7.042","0.005","22.95","0.011","90","","103.64","0.04","90","","2465","2","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C22 H26 N2 O8 Sn -","- C22 H26 N2 O8 Sn -","- C88 H104 N8 O32 Sn4 -","4","0.5","MU0263","Harston, P.; Howie, R. A.; Wardell, J. L.; Doidge-Harrison, S. M. S. V.; Cox, P. J.","Structure of dibutyltin bis(<i>p</i>-nitrobenzoate)","Acta Crystallographica Section C","1992","48","2","279","281","10.1107/S0108270191009964","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001048","9.29","0.003","11.16","0.004","31.529","0.009","90","","90","","90","","3268.8","1.8","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C13 H23 N2 O5 P -","- C13 H23 N2 O5 P -","- C104 H184 N16 O40 P8 -","8","1","MU0248","Weichsel, A.; Lis, T.","Structure of triethylammonium phenylcarbamoyl phosphate","Acta Crystallographica Section C","1992","48","2","303","305","10.1107/S0108270191008636","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001049","12.094","0.001","14.689","0.001","7.0228","0.0004","96.991","0.006","101.856","0.004","101.361","0.007","1179.83","0.15","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C5 H6 N2 O2 -","- C5 H6 N2 O2 -","- C40 H48 N16 O16 -","8","4","HE0025","Peters, D. A.; Beddoes, R. L.; Joule, J. A.","Structures of 3-methoxypyrazine 1-oxide (1<i>a</i>) and 3-methoxy-5-methylpyrazine 1-oxide (1<i>b</i>)","Acta Crystallographica Section C","1992","48","2","307","311","10.1107/S0108270191008624","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001050","8.0056","0.0005","12.714","0.0006","6.6861","0.0009","90","","90","","90","","680.53","0.11","","","","","","","","","","","","4","P n a 21","P 2c -2n","","","","","- C6 H8 N2 O2 -","- C6 H8 N2 O2 -","- C24 H32 N8 O8 -","4","1","HE0025","Peters, D. A.; Beddoes, R. L.; Joule, J. A.","Structures of 3-methoxypyrazine 1-oxide (1<i>a</i>) and 3-methoxy-5-methylpyrazine 1-oxide (1<i>b</i>)","Acta Crystallographica Section C","1992","48","2","307","311","10.1107/S0108270191008624","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001051","9.14","0.004","25.926","0.015","14.481","0.009","90","","93.55","0.04","90","","3425","3","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 S2 -","- C21 H25.5 S2 -","- C168 H204 S16 -","8","2","CR0299","Rosenfeld, S.; Cheer, C. J.","Structure of 2,8-dithia[9](9,10)anthracenophane","Acta Crystallographica Section C","1992","48","2","311","315","10.1107/S010827019100882X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001052","9.712","0.003","15.072","0.003","10.713","0.003","90","","107.65","0.03","90","","1494.3","0.7","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H13 N3 O S -","- C17 H13 N3 O S -","- C68 H52 N12 O4 S4 -","4","1","MU0155","Akkurt, M.; Güldeste, A.; Soylu, H.; Altural, B.; Saripinar, E.","Structure of 1-amino-5-benzoyl-4-phenyl-1<i>H</i>-pyrimidine-2-thione","Acta Crystallographica Section C","1992","48","2","315","317","10.1107/S0108270191008910","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001053","14.972","0.003","5.141","0.001","19.853","0.003","90","","94.15","0.02","90","","1524.1","0.5","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H13 N O4 -","- C20 H13 N O4 -","- C80 H52 N4 O16 -","4","1","HE0026","Black, S. N.; Davey, R. J.; O'Mahoney, C. A.; Williams, D. J.","Structure of 1-amino-4-hydroxy-2-phenoxy-9,10-anthracenedione","Acta Crystallographica Section C","1992","48","2","321","323","10.1107/S0108270191009381","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001054","7.586","0.002","11.429","0.004","19.592","0.008","90","","93.52","0.03","90","","1695.4","1","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C17 H17 Cl N4 O2 -","- C17 H17 Cl N4 O2 -","- C68 H68 Cl4 N16 O8 -","4","1","HE0027","Black, S. N.; Davey, R. J.; Slawin, A. M. Z.; Williams, D. J.","Structure of 1-butyl-5-[(4-chlorophenyl)azo]-1,2,5,6-tetrahydro-4-methyl-2,6-dioxo-3-pyridinecarbonitrile","Acta Crystallographica Section C","1992","48","2","323","325","10.1107/S0108270191009393","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001055","9.78","0.004","5.841","0.003","26.112","0.01","90","","93.02","0.03","90","","1489.6","1.1","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H12 Cl2 N2 -","- C17 H12 Cl2 N2 -","- C68 H48 Cl8 N8 -","4","1","AB0232","Steel, P. J.; Katritzky, A. R.; Greenhill, J. V.; Hitchings, G. J.; Zhao, X.","Structures of two 4,5-dihydro-3<i>H</i>-pyrroles (1-pyrrolines)","Acta Crystallographica Section C","1992","48","2","325","328","10.1107/S0108270191008909","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001056","12.061","0.004","7.666","0.003","17.206","0.006","90","","105.51","0.03","90","","1532.9","1","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 N O -","- C20 N O -","- C80 N4 O4 -","4","1","AB0232","Steel, P. J.; Katritzky, A. R.; Greenhill, J. V.; Hitchings, G. J.; Zhao, X.","Structures of two 4,5-dihydro-3<i>H</i>-pyrroles (1-pyrrolines)","Acta Crystallographica Section C","1992","48","2","325","328","10.1107/S0108270191008909","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001057","11.363","0.002","16.676","0.002","20.307","0.002","90","","90","","90","","3848","0.9","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C32 H21 Cl15 N2 O3 -","- C32 H21 Cl15 N2 O3 -","- C128 H84 Cl60 N8 O12 -","4","1","GE0273","Kanters, J. A.; ter Horst, E. H.; Kroon, J.; Grech, E.","Complexes of the `proton sponge' 1,8-bis(dimethylamino)naphthalene (DMAN). III. Structure of [DMANH]^+^.[pentachlorophenolate]^{-^}.[pentachlorophenol]~2~ at 100 K","Acta Crystallographica Section C","1992","48","2","328","332","10.1107/S0108270191009459","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001058","13.219","0.001","7.072","0.001","6.527","0.002","90","","97.23","0.01","90","","605.3","0.2","","","","","","","","","","","","3","P 1 c 1","P -2yc","","","","","- C15 H14 O3 -","- C15 H14 O3 -","- C30 H28 O6 -","2","1","HA0070","Gulbis, J. M.; Mackay, M. F.; Banwell, M. G.; Lambert, J. N.","Structures of colchicine analogues. V. 2-Methoxy-5-(4-methoxyphenyl)cyclohepta-2,4,6-trien-1-one","Acta Crystallographica Section C","1992","48","2","332","334","10.1107/S0108270191009411","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001059","8.365","0.008","22.654","0.002","13.436","0.005","90","","107.7","0.05","90","","2426","3","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","","","","","- C4 H2 Cl10 N8 O2 P6 -","- C4 H2 Cl10 N8 O2 P6 -","- C16 H8 Cl40 N32 O8 P24 -","4","1","GE0272","van Bolhuis, F.; Meetsma, A.; van de Grampel, J. C.; Brandt, K.","Structure of 2,2'-(2,4-pyrimidinediyldioxy)bis(2,4,4,6,6-pentachloro-1,3,5,2λ^5^,4λ^5^,6λ^5^-triazatriphosphorine) at 130 K","Acta Crystallographica Section C","1992","48","2","337","339","10.1107/S0108270191009447","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001060","6.907","0.006","10.26","0.005","10.619","0.002","104.64","0.04","91.61","0.07","104.88","0.05","700.2","0.8","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C15 H23 N5 -","- C15 H29 N5 -","- C30 H58 N10 -","2","1","MU0281","Gessmann, R.; Petratos, K.; Hamodrakas, S. J.; Tsitsa, P.; Antoniadou-Vyza, E.","Structure of 2-amino-6-dimethylamino-4-(tricyclo[3.3.1.1^3,7^]dec-1-yl)-1,3,5-triazine","Acta Crystallographica Section C","1992","48","2","347","350","10.1107/S0108270191010235","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001061","9.348","0.001","16.604","0.002","21.992","0.003","90","","90","","90","","3413.5","0.7","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C36 H54 O6 -","- C36 H48 O6 -","- C144 H192 O24 -","4","0.5","AS0508","Suzuki, K.; Minami, H.; Yamagata, Y.; Fujii, S.; Tomita, K.; Asfari, Z.; Vicens, J.","Structure of <i>p</i>-<i>tert</i>-butylhexahomotrioxacalix[3]arene","Acta Crystallographica Section C","1992","48","2","350","352","10.1107/S0108270191010399","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001062","14.47","0.03","19.749","0.002","17.5","0.02","90","","110.6","0.1","90","","4681","12","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C49 H56 Fe N6 O4 -","- C49 H56 Fe N6 O4 -","- C196 H224 Fe4 N24 O16 -","4","1","MU0257","Goubitz, K.; Schenk, H.","6-(2,6-Dimethylphenylimino)-1,1,1-tris[(2,6-dimethylphenyl)isocyano]-10-methoxycarbonyl-8-oxo-2,5-bis(2-propyl)-9-oxa-2,5-diaza-1-ferratricyclo[5.2.1.0^4,10^]dec-2-ene","Acta Crystallographica Section C","1992","48","2","359","361","10.1107/S0108270191009472","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001063","10.034","0.002","16.278","0.002","13.129","0.002","90","","112.04","0.01","90","","1987.7","0.6","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C36 H30 Cl4 O6 P2 Pd2 -","- C36 H30 Cl4 O6 P2 Pd2 -","- C72 H60 Cl8 O12 P4 Pd4 -","2","0.5","AL0489","Grigsby, W. J.; Nicholson, B. K.","Structure of <i>trans</i>-di-μ-chloro-dichlorobis(triphenylphosphite)dipalladium","Acta Crystallographica Section C","1992","48","2","362","364","10.1107/S0108270191009885","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001064","13.65","0.001","20.784","0.009","7.773","0.002","90","","90","","90","","2205.2","1.1","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C17 H20 Cl3 Mn N2 O9 -","- C17 H20 Cl3 Mn N2 O9 -","- C68 H80 Cl12 Mn4 N8 O36 -","4","1","AL0491","McAuliffe, C. A.; Pritchard, R. G.; Garcia-Deibe, A.; Sousa, A.; Bermejo, M. R.","Diaqua-<i>N</i>,<i>N</i>'-trimethylenebis(5'-chlorosalicylideneaminato)manganese(III) perchlorate monohydrate: a Schiff-base complex linked into infinite spirals by hydrogen and π bonds","Acta Crystallographica Section C","1992","48","2","364","366","10.1107/S0108270191009903","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001065","7.15","0.004","9.314","0.005","10.523","0.007","93.55","0.05","97.15","0.05","109.06","0.04","653.3","0.7","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H24 Cu N6 O4 S2 -","- C26 H24 Cu N6 O4 S2 -","- C26 H24 Cu N6 O4 S2 -","1","0.5","MU0282","Kožíšek, J.; Köhler, H.; Freude, B.","Bis(4-methylbenzenecyanamidosulfonato)dipyridinecopper(II)","Acta Crystallographica Section C","1992","48","2","368","369","10.1107/S0108270191009484","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001066","11.537","0.002","8.552","0.002","13.916","0.004","90","","92.39","0.02","90","","1371.8","0.6","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H42 O7 Si -","- C25 H48 O7 Si -","- C50 H96 O14 Si2 -","2","1","ST0530","Abboud, K. A.; Enholm, E. J.; Trivellas, A.","Structure of a densely oxygenated carbocycle","Acta Crystallographica Section C","1992","48","2","370","372","10.1107/S0108270191008879","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001067","13.354","0.0003","8.1671","0.0002","10.4791","0.0003","90","","91.331","0.007","90","","1142.58","0.05","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H29 Br N O5 P -","- C21 H28 Br N O5 P -","- C42 H56 Br2 N2 O10 P2 -","2","1","AB0223","Bruins Slot, H. J.; Leusen, F. J. J.; van der Haest, A. D.; Smits, J. M. M.","Structures of a pair of diastereomeric salts of ephedrine and bromo-substituted cyclic phosphoric acid","Acta Crystallographica Section C","1992","48","2","372","376","10.1107/S010827019100906X","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001068","20.9469","0.0009","7.7456","0.0003","15.7571","0.0005","90","","102.013","0.005","90","","2500.54","0.17","","","","","","","","","","","","6","C 1 2 1","C 2y","","","","","- C21 H33 Br N O7 P -","- C21 H33 Br N O7 P -","- C84 H132 Br4 N4 O28 P4 -","4","1","AB0223","Bruins Slot, H. J.; Leusen, F. J. J.; van der Haest, A. D.; Smits, J. M. M.","Structures of a pair of diastereomeric salts of ephedrine and bromo-substituted cyclic phosphoric acid","Acta Crystallographica Section C","1992","48","2","372","376","10.1107/S010827019100906X","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","194538","2020-10-21","18:00:00",""
"2001069","7.402","0.001","12.466","0.002","14.619","0.002","90","","97.25","0.01","90","","1338.2","0.3","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C17 H14 O4 -","- C17 H14 O4 -","- C68 H56 O16 -","4","1","HA0073","Wallet, J. C.; Gaydou, E. M.; Tinant, B.; Declercq, J.-P.; Baldy, A.","5-Methoxy-2-(2-methoxyphenyl)-4<i>H</i>-1-benzopyran-4-one (2,5'-dimethoxyflavone)","Acta Crystallographica Section C","1992","48","2","376","377","10.1107/S0108270191008557","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001070","8.702","0.004","12.063","0.002","9.711","0.004","90","","115.1","0.02","90","","923.1","0.6","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C10 H8 N2 O3 -","- C10 H8 N2 O3 -","- C40 H32 N8 O12 -","4","1","ST0533","Grossie, D. A.; Turnbull, K.","5-Hydroxy-5-methylsydno[3,4-<i>a</i>]indole","Acta Crystallographica Section C","1992","48","2","377","379","10.1107/S0108270191009125","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001071","7.389","0.006","8.862","0.004","16.055","0.01","97.57","0.02","100.21","0.03","77.01","0.02","1003.5","1.1","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H27 N3 O9 P2 -","- C15 H27 N3 O9 P2 -","- C30 H54 N6 O18 P4 -","2","1","CR0331","Rubin, J. R.; Swaminathan, P.; Sundaralingam, M.","Structure of the anti-malarial drug primaquine diphosphate","Acta Crystallographica Section C","1992","48","2","379","382","10.1107/S0108270191008831","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001072","8.3291","0.0005","8.3291","0.0005","17.1142","0.0014","90","","90","","120","","1028.21","0.12","","","","","","","","","","","","4","P 31","P 31","","","","","- C17 H10 Cl N3 -","- C17 H10 Cl N3 -","- C51 H30 Cl3 N9 -","3","1","CR0358","Szkaradzinska, M. B.; Roszak, A. W.; Trudell, M. L.; Cook, J. M.; Codding, P. W.","Structure of 2-chloro-7,12-dihydropyrido[3,2-<i>b</i>:5,4-<i>b</i>']diindole","Acta Crystallographica Section C","1992","48","2","382","384","10.1107/S0108270191009733","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001073","10.235","0.002","10.833","0.001","10.129","0.003","90","","90","","90","","1123.1","0.4","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C10 H15 N3 O5 -","- C10 H15 N3 O5 -","- C40 H60 N12 O20 -","4","1","AS0513","Yamaguchi, K.; Matsumura, G.; Shimizu, M.; Tanaka, H.; Miyasaka, T.","Structure of 1-(β-<small>D</small>-arabinofuranosyl)-6-methylcytosine","Acta Crystallographica Section C","1992","48","2","384","385","10.1107/S0108270191008739","","","1.5405","Cu","","","","","","","","","","","","","","","","","has coordinates","190731","2020-10-21","18:00:00",""
"2001074","5.029","0.002","7.479","0.002","17.073","0.005","97.98","0.02","95.54","0.03","103.62","0.03","612.4","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H12 F3 N O2 -","- C13 H12 F3 N O2 -","- C26 H24 F6 N2 O4 -","2","1","MU0271","Chinnakali, K.; Sivakumar, K.; Natarajan, S.; Mathews, I. I.","Structure of 7-ethylamino-6-methyl-4-trifluoromethylcoumarin","Acta Crystallographica Section C","1992","48","2","386","387","10.1107/S0108270191008478","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001075","21.078","0.001","7.036","0.002","19.603","0.001","90","","109.05","0.01","90","","2748","0.8","","","","","","","","","","","","5","C 1 2 1","C 2y","","","1-(3-Deoxy-3-phenylseleno-2,5-di-O-pivaloyl-β-D-xylofuranosyl)uracil","","- C25 H23 N2 O7 Se -","- C25 H32 N2 O7 Se -","- C100 H128 N8 O28 Se4 -","4","1","AS0514","Yamaguchi, K.; Matsumura, G.; Haraguchi, K.; Itoh, Y.; Tanaka, H.; Miyasaka, T.","Structure of 1-(3-deoxy-3-phenylseleno-2,5-di-<i>O</i>-pivaloyl-β-<small>D</small>-xylofuranosyl)uracil","Acta Crystallographica Section C","1992","48","2","387","389","10.1107/S0108270191009101","","","1.5405","Cu","","","","","","","","","","","","","","","","","has coordinates","199618","2020-10-21","18:00:00",""
"2001076","6.72","0.003","11.618","0.006","30.452","0.012","90","","90","","90","","2377.5","1.9","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C32 H22 O4 -","- C32 H22 O4 -","- C128 H88 O16 -","4","1","CR0337","Bryant, Jnr, G. L.; Nye, S. A.","Structure of terphenyldiol dibenzoate","Acta Crystallographica Section C","1992","48","2","389","391","10.1107/S0108270191008247","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001077","5.049","0.001","13.677","0.002","8.664","0.001","90","","94.92","0.01","90","","596.09","0.16","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C2 H7 N O5 Se -","- C2 H7 N O5 Se -","- C8 H28 N4 O20 Se4 -","4","1","LI0090","Ondráček, J.; Walzelová, M.; Mička, Z.; Novotný, J.","Structure of glycine-selenious acid (1/1)","Acta Crystallographica Section C","1992","48","2","391","392","10.1107/S0108270191008235","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001078","20.611","0.007","9.452","0.005","7.856","0.004","98.52","0.03","96.05","0.02","93","0.3","1501.6","1.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H11 N O4 S2 -","- C15 H11 N O4 S2 -","- C60 H44 N4 O16 S8 -","4","2","AL0486","van Veggel, F. C. J. M.; Harkema, S.","Structure of 2-[(4-cyanophenyl)methylene]-1,3-dithiole-4,5-dicarboxylic acid, dimethyl ester","Acta Crystallographica Section C","1992","48","2","393","395","10.1107/S0108270191009083","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001079","11.319","0.003","6.5115","0.0015","18.105","0.005","90","","105.66","0.02","90","","1284.9","0.6","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 O5 -","- C14 H14 O5 -","- C56 H56 O20 -","4","1","CR0352","Hynes, R. C.","Structure of methyl 2-(2,5-dihydro-2-oxo-3-phenyl-5-furyl)lactate","Acta Crystallographica Section C","1992","48","2","395","396","10.1107/S0108270191008399","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001080","7.139","0.006","15.823","0.002","12.472","0.005","90","","103.12","0.09","90","","1372","1","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C18 H16 O -","- C20 H18 O -","- C80 H72 O4 -","4","1","CR0362","Ariel, S.; Chen, J.; Scheffer, J. R.; Trotter, J.","Structure of 4,4-diphenylcyclohex-2-en-1-one (monoclinic form)","Acta Crystallographica Section C","1992","48","2","400","402","10.1107/S0108270191009745","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001081","7.139","0.006","15.823","0.002","12.472","0.005","90","","103.12","0.09","90","","1372","1","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C18 H16 O -","- C18 H16 O -","- C72 H64 O4 -","4","1","CR0362","Ariel, S.; Chen, J.; Scheffer, J. R.; Trotter, J.","Structure of 4,4-diphenylcyclohex-2-en-1-one (monoclinic form)","Acta Crystallographica Section C","1992","48","2","400","402","10.1107/S0108270191009745","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001082","6.922","0.002","16.733","0.002","10.07","0.003","90","","96.88","0.02","90","","1158","0.5","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H38 O6 S -","- C22 H38 O6 S -","- C44 H76 O12 S2 -","2","1","HA0072","Feneau-Dupont, J.; Declercq, J.-P.; Huart, C.","Structure of [(1<i>S</i>)-1-[(1'<i>S</i>)-3'-oxocyclohexyl]-3,3-dimethoxy-1-propyl] [(1<i>S</i>,2<i>S</i>,3<i>R</i>)-1,3,7,7-tetramethyl-2-hydroxy-3-bicyclo[2.2.1]heptyl] sulfone","Acta Crystallographica Section C","1992","48","2","402","404","10.1107/S0108270191008545","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001083","12.947","0.003","13.814","0.004","16.186","0.005","90","","108.61","0.03","90","","2743.5","1.4","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C24 H45 N3 O4 Si -","- C24 H45 N3 O4 Si -","- C96 H180 N12 O16 Si4 -","4","1","HA0075","Tinant, B.; Declercq, J.-P.; Henderson, P.","<i>N</i>-{2-[(1-Cyanocyclohexyl)(<i>tert</i>-butyldimethylsilyloxy)amino]propionyl}-2,5-bis(methoxymethyl)pyrrolidine and <i>N</i>-(2-anilinopropionyl)-2,5-bis(methoxymethyl)pyrrolidine","Acta Crystallographica Section C","1992","48","2","404","406","10.1107/S0108270191009460","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001084","9.579","0.002","9.601","0.001","18.826","0.002","90","","103.25","0.02","90","","1685.3","0.5","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C17 H26 N2 O3 -","- C17 H26 N2 O3 -","- C68 H104 N8 O12 -","4","1","HA0075","Tinant, B.; Declercq, J.-P.; Henderson, P.","<i>N</i>-{2-[(1-Cyanocyclohexyl)(<i>tert</i>-butyldimethylsilyloxy)amino]propionyl}-2,5-bis(methoxymethyl)pyrrolidine and <i>N</i>-(2-anilinopropionyl)-2,5-bis(methoxymethyl)pyrrolidine","Acta Crystallographica Section C","1992","48","2","404","406","10.1107/S0108270191009460","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001085","6.791","0.005","9.107","0.006","10.683","0.007","99.84","0.05","99.19","0.06","110.56","0.06","592","0.8","","","","","","","","","","","","5","P -1","-P 1","2","","","","- Cs3 H4 N27 Nd2 O2 -","- Cs3 H4 N27 Nd2 O2 -","- Cs3 H4 N27 Nd2 O2 -","1","0.5","MU0250","Starynowicz, P.","Structure of tricaesium diaquanonaazidedineodymate(III)","Acta Crystallographica Section C","1992","48","1","4","5","10.1107/S0108270191008430","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001086","5.4709","0.0009","5.683","0.0006","8.0734","0.0012","90","","88.964","0.007","90","","250.97","0.06","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- F6 Mn Na3 -","- F6 Mn Na3 -","- F12 Mn2 Na6 -","2","0.5","AL0476","Englich, U.; Massa, W.; Tressaud, A.","Structure of trisodium hexafluoromanganate(III)","Acta Crystallographica Section C","1992","48","1","6","8","10.1107/S0108270191009071","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001087","7.052","0.002","7.052","0.002","11.15","0.003","90","","90","","90","","554.5","0.3","","","","","","","","","","","","4","I 4/m m m","","","","","","- Ba2 Cu2 O12 Si4 -","- Ba2 Cu2 O12 Si4 -","- Ba4 Cu4 O24 Si8 -","2","0.0625","AB0183","Janczak, J.; Kubiak, R.","Structure of the cyclic barium copper silicate Ba~2~Cu~2~[Si~4~O~12~] at 300 K","Acta Crystallographica Section C","1992","48","1","8","10","10.1107/S0108270191002354","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001088","11.55","0.01","7.877","0.002","16.866","0.005","90","","90","","90","","1534.5","1.5","","","","","","","","","","","","6","P c a 21","P 2c -2ac","","","","","- C9 H16 Cu N4 O6 S -","- C9 H16 Cu N4 O6 S -","- C36 H64 Cu4 N16 O24 S4 -","4","1","LI0094","Haanstra, W. G.; Driessen, W. L.; Reedijk, J.","Structure of [1-(3,5-dimethyl-1-pyrazolyl)-3-thiapentane-<i>N</i>,<i>S</i>]bis(nitrato-<i>O</i>,<i>O</i>)copper(II)","Acta Crystallographica Section C","1992","48","1","14","16","10.1107/S0108270191009204","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001089","17.95","0.005","17.95","","10.907","0.002","90","","90","","90","","3514.3","1.2","","","","","","","","","","","","6","I -4 2 d","I -4 2bw","","","","","- C20 H49 Cl6 N8 O0.5 Zn3 -","- C20 H48 Cl6 N8 O Zn3 -","- C80 H192 Cl24 N32 O4 Zn12 -","4","0.25","MU0269","Alcock, N. W.; Berry, A.; Moore, P.","Structure of a complex of 1,4,8,11-tetraazacyclotetradecane (cyclam) with zinc(II) chloride","Acta Crystallographica Section C","1992","48","1","16","19","10.1107/S0108270191008454","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001090","10.404","0.004","16.454","0.005","13.539","0.005","90","","103.99","0.03","90","","2249","1.4","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C51 H41 Cu2 N5 O8 -","- C54 Cu2 N6 O10 -","- C108 Cu4 N12 O20 -","2","0.5","HE0010","Liu, S.-X.","Structure of a new type of copper carboxylate complex: [Cu(C~14~H~8~O~3~)(C~10~H~8~N~2~)]~2~.C~3~H~7~N.H~2~O","Acta Crystallographica Section C","1992","48","1","22","24","10.1107/S0108270191005383","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001091","12.884","0.006","12.012","0.006","14.442","0.007","90","","101.45","0.03","90","","2190.6","1.8","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 Fe O2 -","- C14 H14 Fe O2 -","- C112 H112 Fe8 O16 -","8","2","CR0317","Geib, S. J.; Rao, S. J.; Petter, R. C.","Structure of 1,1':2,2'-bis(oxybismethylene)ferrocene","Acta Crystallographica Section C","1992","48","1","25","27","10.1107/S0108270191004250","","","0.71073","","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001092","8.586","0.006","8.79","0.008","8.77","0.006","68.23","0.06","62.42","0.05","86.08","0.07","540.5","0.8","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H20 Cl2 Cu N4 O4 -","- C24 H20 Cl2 Cu N4 O4 -","- C24 H20 Cl2 Cu N4 O4 -","1","0.5","MU0249","Kožíšek, J.; Baran, P.; Valigura, D.","Structure of dichlorobis(1,10-phenanthroline <i>N</i>-oxide)copper(II) dihydrate","Acta Crystallographica Section C","1992","48","1","31","33","10.1107/S0108270191009642","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001093","15.011","0.003","11.316","0.004","16.155","0.002","90","","106.55","0.01","90","","2630.5","1.1","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 I2 N O2 Os P -","- C23 H24 I3 N O2 Os P -","- C92 H96 I12 N4 O8 Os4 P4 -","4","1","AS0511","Lu, K. L.; Lin, Y. C.; Cheng, M. C.; Wang, Y.","Structure of an aminodicarbonyldiiodo(triphenylphosphine)osmium complex","Acta Crystallographica Section C","1992","48","1","33","35","10.1107/S0108270191009149","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001094","14.027","0.002","21.127","0.003","12.229","0.002","90","","100.56","0.01","90","","3562.7","0.9","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H30 F6 O2 P2 Pt -","- C39 F6 O2 P2 Pt -","- C156 F24 O8 P8 Pt4 -","4","1","CD0038","Hynes, R. C.; Willis, C. J.; Payne, N. C.","A <i>gem</i>-diolato complex of platinum: structure of [{P(C~6~H~5~)~3~}~2~Pt{O~2~C(CF~3~)~2~}]","Acta Crystallographica Section C","1992","48","1","42","45","10.1107/S0108270191009265","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001095","13.482","0.001","15.926","0.004","9.827","0.002","90","","90","","90","","2110","0.7","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C20 H28 Cl2 N P Pt -","- C20 H31 Cl2 N P Pt -","- C80 H124 Cl8 N4 P4 Pt4 -","4","1","CD0057","Payne, N. C.; Tobin, G. R.","A chiral aminophosphine complex of platinum: structure of <i>cis</i>-dichloro[(1<i>S</i>)-<i>N</i>,<i>N</i>-dimethyl-1-{2-[(<i>S</i>)-<i>tert</i>-butylphenylphosphino]phenyl}ethylamine-<i>N</i>,<i>P</i>]platinum(II)","Acta Crystallographica Section C","1992","48","1","45","48","10.1107/S0108270191009216","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001096","18.402","0.017","16.861","0.019","16.328","0.016","90","","117.04","0.07","90","","4512","8","","","","","","","","","","","","5","C 1 2/c 1","","","","","","- C18 H32 N2 O4 Sn -","- C18 H31 N2 O4 Sn -","- C144 H248 N16 O32 Sn8 -","8","1","MU0200","Kellö, E.; Vrábel, V.; Rattay, V.; Sivý, J.; Kožíšek, J.","Structure of tri-<i>n</i>-butyltin(IV) 1-uracilacetate","Acta Crystallographica Section C","1992","48","1","51","53","10.1107/S0108270191008934","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001097","8.759","0.003","13.037","0.003","15.366","0.004","90","","90","","90","","1754.7","0.9","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C15 H20 B9 Co -","- C15 H20 B9 Co -","- C60 H80 B36 Co4 -","4","1","MU0270","Lewis, Z. G.; Welch, A. J.","Synthesis and structure of 3-fluorenyl-3-cobalta-1,2-dicarba-<i>closo</i>-nonaborane(11), 3-(η^5^-C~13~H~9~)-3,1,2-<i>closo</i>-CoC~2~B~9~H~11~","Acta Crystallographica Section C","1992","48","1","53","57","10.1107/S0108270191009058","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001098","18.097","0.004","9.714","0.002","13.845","0.001","90","","92.46","0.01","90","","2431.6","0.8","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C8 H17 Cd Cl2 N O2 -","- C8 H17 Cd Cl2 N O2 -","- C64 H136 Cd8 Cl16 N8 O16 -","8","1","AS0497","Chen, X.-M.; Mak, T. C. W.; Huang, W.-Y.; Lü, L.","Metal-betaine interactions. XI. Structure of <i>catena</i>-[μ-dichloro-(triethylammonioacetato)cadmium(II)]","Acta Crystallographica Section C","1992","48","1","57","59","10.1107/S0108270191008363","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001099","11.689","0.002","22.934","0.004","11.592","0.002","90","","100.16","0.03","90","","3058.8","1","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H17 N O3 -","- C18 H17 N O3 -","- C144 H136 N8 O24 -","8","1","CR0281","Chandrakantha, T. N.; Puttaraja; Nethaji, M.","Structure of ethyl 5-methoxy-3-phenyl-2-indolecarboxylate","Acta Crystallographica Section C","1992","48","1","60","62","10.1107/S0108270191002913","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2001100","12.795","0.002","13.178","0.002","11.092","0.002","90","","90","","90","","1870.2","0.5","","","","","","","","","","","","3","I b a m","-I 2 2c","","","","","- C10 H14 O3 -","- C10 H13 O3 -","- C80 H104 O24 -","8","0.5","CR0251","Thompson, H. W.; Lalancette, R. A.; Vanderhoff, P. A.","9-Oxobicyclo[3.3.1]nonane-1-carboxylic acid: structure and hydrogen-bonding pattern","Acta Crystallographica Section C","1992","48","1","66","70","10.1107/S010827019100330X","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001101","8.264","0.001","6.988","0.001","18.288","0.001","90","","96.27","0.01","90","","1049.8","0.2","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 O4 -","- C10 H16 O4 -","- C40 H64 O16 -","4","1","AN0328","Mackay, M. F.; Banwell, M. G.; Reum, M. E.; Richards, S. L.","Structures of three 2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxolan-4-ols","Acta Crystallographica Section C","1992","48","1","70","73","10.1107/S0108270191004456","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001102","12.792","0.001","8.937","0.001","13.089","0.001","90","","91.37","0.01","90","","1495.9","0.2","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 O5 -","- C16 H18 O5 -","- C64 H72 O20 -","4","1","AN0328","Mackay, M. F.; Banwell, M. G.; Reum, M. E.; Richards, S. L.","Structures of three 2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxolan-4-ols","Acta Crystallographica Section C","1992","48","1","70","73","10.1107/S0108270191004456","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001103","10.773","0.001","25.953","0.001","10.818","0.001","90","","90","","90","","3024.6","0.4","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","","","","","- C16 H18 O5 -","- C16 H18 O5 -","- C128 H144 O40 -","8","1","AN0328","Mackay, M. F.; Banwell, M. G.; Reum, M. E.; Richards, S. L.","Structures of three 2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxolan-4-ols","Acta Crystallographica Section C","1992","48","1","70","73","10.1107/S0108270191004456","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001104","8.229","0.002","10.654","0.003","10.668","0.002","92.93","0.02","93.01","0.02","107.5","0.2","888.6","1.1","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C10 H9 N3 -","- C10 H9 N3 -","- C40 H36 N12 -","4","2","CR0297","Pyrka, G. J.; Pinkerton, A. A.","Structure of the high-temperature-melting polymorph of 2,2'-dipyridylamine","Acta Crystallographica Section C","1992","48","1","91","94","10.1107/S0108270191007163","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001105","13.32","0.004","31.654","0.015","6.991","0.003","90","","90","","90","","2948","2","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C18 H16 N2 O2 -","- C18 H16 N2 O2 -","- C144 H128 N16 O16 -","8","1","AS0499","Mori, Y.; Hayakawa, A.; Maeda, K.","Structure of photostable 1-(hydroxyalkyl)-2(1<i>H</i>)-pyrazinones","Acta Crystallographica Section C","1992","48","1","123","126","10.1107/S0108270191007904","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001106","9.939","0.002","10.043","0.002","9.603","0.003","114.19","0.02","96.89","0.02","106.4","0.02","807.8","0.4","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C19 H18 N2 O2 -","- C19 H18 N2 O2 -","- C38 H36 N4 O4 -","2","1","AS0499","Mori, Y.; Hayakawa, A.; Maeda, K.","Structure of photostable 1-(hydroxyalkyl)-2(1<i>H</i>)-pyrazinones","Acta Crystallographica Section C","1992","48","1","123","126","10.1107/S0108270191007904","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001107","9.095","0.001","7.087","0.001","14.149","0.002","90","","107.87","0.03","90","","868","0.2","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C18 H31 I -","- C18 H30 I -","- C36 H60 I2 -","2","1","HA0064","Kojić-Prodić, B.; Luić, M.; Nigović, B.; Duddeck, H.; Rosenbaum, D.","Structure of 3,5-di-<i>tert</i>-butyl-10-iodoprotoadamantane","Acta Crystallographica Section C","1992","48","1","131","133","10.1107/S0108270191007758","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001108","6.8553","0.001","15.399","0.002","8.5628","0.0009","90","","95.763","0.01","90","","899.4","0.2","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 Cl N O -","- C9 H10 Cl N O -","- C36 H40 Cl4 N4 O4 -","4","1","AB0222","Jerslev, B.; Larsen, S.","(<i>E</i>)-4-Chloro-2,6-dimethylbenzaldehyde oxime at 110 K","Acta Crystallographica Section C","1992","48","1","136","138","10.1107/S0108270191007850","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001109","10.16","0.002","12.23","0.002","12.796","0.001","105.735","0.006","99.58","0.02","90.09","0.01","1507.2","0.5","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C17 H24 O -","- C17 H24 O -","- C68 H96 O4 -","4","2","MU0236","De Ridder, D. J. A.; Schenk, H.","Crystal studies of musk compounds. IV. Structure of 4-acetyl-6-<i>tert</i>-butyl-1,1-dimethylindan (musk celestolide)","Acta Crystallographica Section C","1992","48","1","140","142","10.1107/S0108270191008211","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001110","13.978","0.01","9.638","0.008","6.338","0.011","90","","90","","90","","853.9","1.8","","","","","","","","","","","","4","P n a 21","","","","","","- C6 H10 N4 O4 -","- C6 H10 N4 O4 -","- C24 H40 N16 O16 -","4","1","MU0225","Low, J. N.; Howie, R. A.; Hueso-Ureña, F.; Moreno-Carretero, M. N.","Structures of 6-amino-1,3-dimethyl-5-nitrosouracil monohydrate and 6-amino-5-formyl-1,3-dimethyluracil monohydrate","Acta Crystallographica Section C","1992","48","1","145","147","10.1107/S010827019100820X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","191091","2020-10-21","18:00:00",""
"2001111","15.557","0.011","7.562","0.011","16.972","0.013","90","","116.69","0.05","90","","1784","3","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C7 H11 N3 O4 -","- C7 H11 N3 O4 -","- C56 H88 N24 O32 -","8","1","MU0225","Low, J. N.; Howie, R. A.; Hueso-Ureña, F.; Moreno-Carretero, M. N.","Structures of 6-amino-1,3-dimethyl-5-nitrosouracil monohydrate and 6-amino-5-formyl-1,3-dimethyluracil monohydrate","Acta Crystallographica Section C","1992","48","1","145","147","10.1107/S010827019100820X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2001112","18.232","0.003","7.613","0.001","16.842","0.004","90","","96.27","0.02","90","","2323.7","0.7","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C16 H18 Cl2 Cu N8 O11 -","- C16 H20 Cl2 Cu N8 O11 -","- C64 H80 Cl8 Cu4 N32 O44 -","4","0.5","ST0503","Morgan, L. W.; Pennington, W. T.; Petersen, J. D.; Ruminski, R. R.; Bennett, D. W.; Rommel, J. S.","Structure of aquabis(2,2'-bipyrimidine-<i>N</i>,<i>N</i>')copper(II) perchlorate dihydrate","Acta Crystallographica Section C","1992","48","1","163","165","10.1107/S0108270191004602","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001113","10.422","0.001","17.294","0.002","18.581","0.003","90","","94.56","0.01","90","","3338.4","0.7","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H21 F15 Fe N6 P2 -","- C30 H23 F17 Fe N6 P2 -","- C120 H92 F68 Fe4 N24 P8 -","4","1","BR0002","Cho, C. K.; Secco, A. S.","Tris(4-fluoro-2,2'-bipyridyl)iron(II) hexafluorophosphate","Acta Crystallographica Section C","1992","48","1","165","167","10.1107/S0108270191008788","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001114","7.231","0.01","10.633","0.003","15.767","0.003","90","","103.94","0.05","90","","1176.6","1.7","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H24 Cl2 Cu N4 O14 -","- C12 H24 Cl2 Cu N4 O14 -","- C24 H48 Cl4 Cu2 N8 O28 -","2","0.5","MU0207","Delacruz, X.; Martínez-Balbás, A.; Tormo, J.; Verdaguer, N.","Structure of <i>trans</i>-diaquabis[(2-oxopyrrolidin-1-yl)acetamide]copper(II) perchlorate","Acta Crystallographica Section C","1992","48","1","167","169","10.1107/S0108270191008971","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001115","9.764","0.002","10.185","0.002","19.885","0.003","80.03","0.01","87.87","0.01","61.94","0.01","1716.5","0.6","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C34 H49 N O3 P Rh S -","- C34 H49 N O3 P Rh S -","- C68 H98 N2 O6 P2 Rh2 S2 -","2","1","AB0215","Basson, S. S.; Leipoldt, J. G.; Purcell, W.; Lamprecht, G. J.; Preston, H.","Structure of carbonyl(4-methoxy-<i>N</i>-methylbenzothiohydroxamato-κ<i>O</i>,κ<i>S</i>)(tricyclohexylphosphine)rhodium(I) benzene solvate","Acta Crystallographica Section C","1992","48","1","169","171","10.1107/S0108270191008405","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001116","11.99","0.001","6.195","0.001","20.906","0.003","90","","92.857","0.01","90","","1550.9","0.4","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C12 H14 N2 O6 P Rh -","- C12 H14 N2 O6 P Rh -","- C48 H56 N8 O24 P4 Rh4 -","4","1","AB0217","Basson, S. S.; Leipoldt, J. G.; Purcell, W.; Venter, J. A.","Structure of carbonyl(<i>N</i>-hydroxy-<i>N</i>-nitrosobenzenaminato-<i>O</i>,<i>O</i>')(4-methyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane)rhodium(I)","Acta Crystallographica Section C","1992","48","1","171","173","10.1107/S0108270191008223","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001117","11.086","0.002","11.086","0.002","14.367","0.004","90","","90","","120","","1529.1","0.6","","","","","","","","","","","","5","P 31","P 31","","","","","- C21 H30 Cl N2 O -","- C21 H29 Cl N2 O -","- C63 H87 Cl3 N6 O3 -","3","1","LI0074","McKenna, R.; Agbandje, M.; Neidle, S.","Structure of 9-amino-2,7-di-<i>tert</i>-butylacridine","Acta Crystallographica Section C","1992","48","1","188","190","10.1107/S0108270191009113","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001118","10.167","0.004","11.092","0.002","10.278","0.004","90","","115.22","0.02","90","","1048.6","0.6","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C7 H10 S5 -","- C7 H10 S5 -","- C28 H40 S20 -","4","1","MU0255","Pickardt, J.; Kustos, M.; Steudel, R.","Structure of a norbornanepolysulfane: <i>exo</i>-3,4,5,6,7-pentathiatricyclo[7.2.1.0^2,8^]dodecane","Acta Crystallographica Section C","1992","48","1","190","191","10.1107/S0108270191008715","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001119","8.403","0.004","5.405","0.003","33.005","0.016","90","","91.07","0.04","90","","1498.8","1.3","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C18 H18 N2 O2 -","- C18 H19 N2 O2 -","- C72 H76 N8 O8 -","4","1","AS0500","Ishida, T.; Negi, A.; In, Y.; Inoue, M.","Structure of <i>N</i>-(indol-3-ylethyl)-4-hydroxyphenylacetamide","Acta Crystallographica Section C","1992","48","1","193","194","10.1107/S0108270191009599","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001120","16.381","0.003","7.042","0.001","18.157","0.004","90","","113.02","0.03","90","","1927.7","0.8","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C10 H8 N2 O4 -","- C10 H8 N2 O4 -","- C80 H64 N16 O32 -","8","2","CR0340","Kwiatkowski, W.; Karolak-Wojciechowska, J.","Structure of <i>m</i>-nitrophenylsuccinimide","Acta Crystallographica Section C","1992","48","1","204","206","10.1107/S0108270191008843","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001121","7.145","0.008","10.866","0.005","11.006","0.006","90","","107.53","0.06","90","","814.8","1.1","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C9 H7 N3 -","- C9 H10 N3 -","- C36 H40 N12 -","4","1","HE0024","Alvarez-Larena, A.; Piniella, J. F.; Borrell, J. I.; Vidal-Ferran, A.; Victory, P.; Germain, G.","Structure of 2-amino-5-methylisophthalonitrile","Acta Crystallographica Section C","1992","48","1","208","209","10.1107/S010827019100865X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001122","8.331","0.004","24.066","0.008","5.663","0.002","90","","90","","90","","1135.4","0.8","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C14 H13 N O -","- C14 H13 N O -","- C56 H52 N4 O4 -","4","1","MU0212","Su, G.; Guo, S.; Pan, F.; He, Y.","Structure of 4-amino-4'-methylbenzophenone","Acta Crystallographica Section C","1992","48","1","210","211","10.1107/S0108270191008983","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176340","2020-10-21","18:00:00",""
"2001123","13.525","0.007","7.549","0.004","13.646","0.007","90","","90.02","0.04","90","","1393.3","1.3","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C15 H22 O4 -","- C15 H22 O4 -","- C60 H88 O16 -","4","2","ST0527","Baures, P. W.; Sun, K.-L.; Chan, J. A.; Eggleston, D. S.","Structure of hymenoratin","Acta Crystallographica Section C","1992","48","1","211","213","10.1107/S0108270191008867","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001124","5.206","0.002","17.294","0.004","10.972","0.002","90","","98.91","0.01","90","","975.9","0.5","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H25 N O4 -","- C21 H N O4 -","- C42 H2 N2 O8 -","2","1","MU0261","Gikas, M.; Agelis, G.; Matsoukas, J.; Moore, G. J.; Dupont, L.; Englebert, S.","Structure of <i>N</i>-<i>tert</i>-butoxycarbonyl-<small>L</small>-phenylalanine benzyl ester","Acta Crystallographica Section C","1992","48","1","216","217","10.1107/S0108270191007771","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001125","14.662","0.004","10.79","0.002","7.749","0.002","90","","104.55","0.02","90","","1186.6","0.5","293","1","293","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Nitrophenyl)-1-phenylethanone","","- C14 H11 N O3 -","- C14 H11 N O3 -","- C56 H44 N4 O12 -","4","1","AL1007","Preut, H.; Kolev, T.; Bleckmann, P.; Juchnovski, I.","Structure of 2-(4-nitrophenyl)-1-phenylethanone","Acta Crystallographica Section C","1992","48","6","1154","1155","10.1107/S010827019200310X","","","0.71073","MoKα","","","0.044","","","0.048","","","","","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001126","8.9319","0.0006","5.7057","0.0006","12.465","0.002","90","","110.7","0.01","90","","594.24","0.13","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C9 H11 Cl Hg N2 O5 -","- C9 H9 Cl Hg N2 O5 -","- C18 H18 Cl2 Hg2 N4 O10 -","2","1","GR1008","Toma, P. H.; Dalla Riva Toma, J. M.; Bergstrom, D. E.","Structure of 5-chloromercurio-2'-deoxyuridine","Acta Crystallographica Section C","1993","49","12","2047","2049","10.1107/S0108270193007565","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001127","9.285","0.006","5.373","0.002","11.981","0.006","90","","112.09","0.04","90","","553.8","0.5","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","","","","","- C14 H18 -","- C14 H18 -","- C28 H36 -","2","0.5","HU1011","Yufit, D. S.; Struchkov, Yu. T.; Lukin, K. A.; Kozhushkov, S. I.; Zefirov, N. S.","Structure of 1,2-bis(spiro[2.3]hex-4-ene-4-yl)ethane","Acta Crystallographica Section C","1993","49","12","2049","2051","10.1107/S0108270192012800","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001128","4.4204","0.0005","9.136","0.001","11.762","0.002","101.61","0.01","96.2","0.01","92.28","0.01","461.64","0.11","","","","","","","","","","","","2","P -1","-P 1","2","","","","- C3 S8 -","- C3 S8 -","- C6 S16 -","2","1","VS1006","Baumer, V. N.; Starodub, V. A.; Batulin, V. P.; Lakin, E. E.; Kuznetsov, V. P.; Dyachenko, O. A.","Structure of 4,5-(pentasulfane-1,5-diyl)-1,3-dithiole-2-thione","Acta Crystallographica Section C","1993","49","12","2051","2053","10.1107/S0108270193004184","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001129","5.164","0.001","5.164","0.001","10.741","0.002","90","","90","","90","","286.43","0.09","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- F4 Li Y -","- F4 Li Y -","- F16 Li4 Y4 -","4","0.25","HH0619","Garcia, E.; Ryan, R. R.","Structure of the laser host material LiYF~4~","Acta Crystallographica Section C","1993","49","12","2053","2054","10.1107/S0108270193005876","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","203896","2020-10-21","18:00:00",""
"2001130","10.0636","0.0017","10.405","0.002","11.9671","0.0015","96.552","0.015","108.031","0.011","90.498","0.014","1182.5","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C11 H14 N2 O6 -","- C11 H14 N2 O6 -","- C44 H56 N8 O24 -","4","2","CD1029","Hambalek, R. J.; Hynes, R. C.; Just, G.","Structure of (±)-<i>exo</i>-4'-hydroxy-<i>exo</i>-6'-hydroxymethyl-<i>endo</i>-3'-thymin-1-yl-2',7'-dioxabicyclo[3.2.0]heptane","Acta Crystallographica Section C","1993","49","12","2055","2056","10.1107/S0108270193004962","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001131","9.188","0.001","3.717","0.001","13.839","0.001","90","","90","","90","","472.63","0.14","295","","295","","","","","","","","","3","P n m a","-P 2ac 2n","62","","tinzirconiumtrisulfide","","- S3 Sn Zr -","- S3 Sn Zr -","- S12 Sn4 Zr4 -","4","0.5","AB1082","Meetsma, A.; Wiegers, G. A.; de Boer, J. L.","Structure determination of SnZrS~3~","Acta Crystallographica Section C","1993","49","12","2060","2062","10.1107/S0108270193005888","","","0.71073","MoKα","","","0.038","","","0.031","","","","","2.19","2.19","","","","","has coordinates","207947","2020-10-21","18:00:00",""
"2001132","6.6858","0.0008","6.6858","0.0008","24.147","0.003","90","","90","","90","","1079.4","0.4","294","","","","","","","","","","","3","P 41","P 4w","76","","","","- Ca2 O7 P2 -","- Ca2 O7 P2 -","- Ca16 O56 P16 -","8","2","DU1046","Boudin, S.; Grandin, A.; Borel, M. M.; Leclaire, A.; Raveau, B.","Redetermination of the β-Ca~2~P~2~O~7~ structure","Acta Crystallographica Section C","1993","49","12","2062","2064","10.1107/S0108270193005608","","","0.71073","MoKᾱ","","","0.031","","","0.034","","","","","1.001","1.001","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001133","11.485","0.003","6.549","0.002","15.774","0.007","90","","103.72","0.03","90","","1152.6","0.7","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- Cl5 H15 N4 O Pt -","- Cl5 H15 N4 O Pt -","- Cl20 H60 N16 O4 Pt4 -","4","1","PA1046","Balde, L.; Khodadad, P.; Rodier, N.; Julien, R.","Chlorure de triamminetrichloroplatine(IV) chlorure d'ammonium monohydrate","Acta Crystallographica Section C","1993","49","12","2064","2065","10.1107/S0108270193005165","","","0.7107","MoKᾱ","","","0.048","","","0.057","","","","","1.87","1.87","","","","","has coordinates","187340","2020-10-21","18:00:00",""
"2001134","16.563","0.002","8.111","0.001","9.458","0.002","90","","90","","90","","1270.6","0.3","294","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Cl5 H15 Ir N5 Pt -","- Cl5 H15 Ir N5 Pt -","- Cl20 H60 Ir4 N20 Pt4 -","4","0.5","DU1026","Garnier, E.; Bele, M.","Structure of pentaamminechloroiridium(III) tetrachloroplatinate(II)","Acta Crystallographica Section C","1993","49","12","2066","2067","10.1107/S0108270193005037","","","0.71069","MoKα","","","0.0282","","","0.0302","","","","","1.537","1.537","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001135","8.39","0.001","15.585","0.001","13.058","0.001","90","","92.22","0.01","90","","1706.2","0.3","294","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 Cu N8 O6 -","- C12 H12 Cu N8 O10 -","- C48 H48 Cu4 N32 O40 -","4","1","CD1045","Otieno, T.; Rettig, S. J.; Thompson, R. C.; Trotter, J.","Structure of (nitrato-<i>O</i>)(nitrato-<i>O</i>,<i>O</i>')tris(pyridazine-<i>N</i>)copper(II)","Acta Crystallographica Section C","1993","49","12","2067","2070","10.1107/S0108270193004986","","","1.54178","CuKα","","","0.036","","","0.038","","","","","2.83","2.83","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001136","12.756","0.002","14.451","0.002","9.805","0.001","90","","105.69","0.01","90","","1740.1","0.4","297","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 Cu2 N2 O5 -","- C18 H16 Cu2 N2 O5 -","- C72 H64 Cu8 N8 O20 -","4","1","OH1028","Kawata, T.; Ohba, S.; Nishida, Y.; Tokii, T.","Structure of a binuclear copper(II) complex with both μ-alkoxo and μ-formato bridges, [Cu~2~(C~17~H~15~N~2~O~3~)(HCOO)]","Acta Crystallographica Section C","1993","49","12","2070","2072","10.1107/S0108270193004779","","","0.71073","MoKα","","","0.047","","","0.046","","","","","4.65","4.65","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001137","14.297","0.005","13.078","0.003","30.301","0.006","90","","92.8","0.02","90","","5659","3","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H87 B P4 Pt2 -","- C56 H92 B P4 Pt2 -","- C224 H368 B4 P16 Pt8 -","4","1","NA1031","Bachechi, F.; Mura, P.; Zambonelli, L.","Structure of the monohydrido bridged dinuclear platinum(II) dihydrate [(PEt~3~)~2~PhPt(μ-H)PtH(PEt~3~)~2~][BPh~4~]","Acta Crystallographica Section C","1993","49","12","2072","2074","10.1107/S0108270193005220","","","1.54178","CuKα","","","0.059","","","0.066","","","","","7.03","7.03","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001138","21.143","0.011","17.911","0.002","20.415","0.003","90","","107.83","0.02","90","","7360","4","295","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C22 H32 Cl2 P2 W -","- C22 H32 Cl2 P2 W -","- C264 H384 Cl24 P24 W12 -","12","3","HL1028","Clark, G. R.; Nielson, A. J.; Rickard, C. E. F.; Rae, A. D.","The faulted structures of [WCl~2~(PhC~2~Ph)(CH~2~=CH~2~)(PMe~3~)~2~] and [WCl~2~(PhC~2~Ph)~2~(PMe~3~)~2~]","Acta Crystallographica Section C","1993","49","12","2074","2079","10.1107/S0108270193005402","","","0.71069","MoKα","","","0.048","","","0.061","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001139","12.208","0.002","12.27","0.002","21.498","0.006","90","","94.81","0.02","90","","3208.9","1.2","295","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C34 H38 Cl2 P2 W -","- C34 H38 Cl2 P2 W -","- C136 H152 Cl8 P8 W4 -","4","1","HL1028","Clark, G. R.; Nielson, A. J.; Rickard, C. E. F.; Rae, A. D.","The faulted structures of [WCl~2~(PhC~2~Ph)(CH~2~=CH~2~)(PMe~3~)~2~] and [WCl~2~(PhC~2~Ph)~2~(PMe~3~)~2~]","Acta Crystallographica Section C","1993","49","12","2074","2079","10.1107/S0108270193005402","","","0.71069","MoKα_Zr_filter","","","0.028","","","0.033","","","","","1.04","1.04","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001140","9.355","0.002","14.678","0.002","14.685","0.004","101.82","0.02","93.01","0.02","108.36","0.02","1858.3","0.8","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H17 Cl2 O P Pt -","- C18 H17 Cl2 O P Pt -","- C72 H68 Cl8 O4 P4 Pt4 -","4","2","ST1054","Rath, N. P.; Fallis, K. A.; Anderson, G. K.","Structure of <i>trans</i>-aquadichloro(triphenylphosphine)platinum(II)","Acta Crystallographica Section C","1993","49","12","2079","2081","10.1107/S0108270193005189","","","0.71073","MoKα","","","0.0713","","","0.0884","","","","","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001141","11.634","0.002","12.172","0.001","10.056","0.002","114.099","0.009","115.05","0.01","92.81","0.01","1134.4","0.4","296.1","","23","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H56 Cr2 N4 O12 P4 -","- C32 H56 Cr2 N4 O12 P4 -","- C32 H56 Cr2 N4 O12 P4 -","1","0.5","BR1030","Jasinski, J. P.; Pozdniakov, R. Y.; Wong, E. H.","Structure of a dichromium octacarbonyl complex of cyclotetrakis[bis(diisopropylamino)phosphoxane]","Acta Crystallographica Section C","1993","49","12","2081","2083","10.1107/S0108270193004111","","","0.7107","MoKα","","","0.0423","","","0.0518","","","","","2.239","2.239","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001142","7.576","0.003","8.212","0.002","11.242","0.005","86.84","0.03","74.62","0.03","85.38","0.05","671.8","0.4","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H26 N6 O8 Rh2 -","- C24 H26 N6 O8 Rh2 -","- C24 H26 N6 O8 Rh2 -","1","0.5","DU1036","Viossat, B.; Dung, Nguyen-Huy; Daran, J. C.; Lancelot, J. C.","Complexe entre un carboxylate de rhodium(II) et un dérivé de la pyrazine: synthèse et structure de tétrakis(μ-acétato)bis[2-(1-pyrrolyle)pyrazine]dirhodium(II)","Acta Crystallographica Section C","1993","49","12","2084","2086","10.1107/S0108270193005049","","","0.71069","MoKα","","","","","","","","","","","2.1","2.1","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001143","13.003","0.003","13.639","0.004","9.861","0.002","110.26","0.02","100.94","0.02","109.35","0.02","1453.5","0.8","294","","","","","","","","","","","6","P 1","P 1","1","","","","- C30 H66 Cl6 Er2 N6 O42 -","- C30 H66 Cl6 Er2 N6 O48 -","- C30 H66 Cl6 Er2 N6 O48 -","1","1","OH1031","Hu, N.-H.; Wang, Z.-L.; Niu, C.-J.; Ni, J.-Z.","Structure of an erbium complex with <small>L</small>-proline","Acta Crystallographica Section C","1993","49","12","2086","2089","10.1107/S0108270193005311","","","0.71069","MoKα","","","0.024","","","0.028","","","","","1.52","1.52","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001144","13.381","0.012","8.91","0.009","9.178","0.009","90","","101.27","0.09","90","","1073.1","1.8","80","1","80","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","di-μ-chlorobis[trichloro(allyl acetate-O)]dititanium(IV)","","- C10 H16 Cl8 O4 Ti2 -","- C10 H16 Cl8 O4 Ti2 -","- C20 H32 Cl16 O8 Ti4 -","2","0.5","KA1046","Lis, T.; Utko, J.; Sobota, P.","Structure of di-μ-chloro-bis[(allyl acetate-<i>O</i>)trichlorotitanium(IV)] at 80 K","Acta Crystallographica Section C","1993","49","12","2089","2091","10.1107/S0108270193006110","","","0.7093","MoKα","","","0.0258","","","0.028","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001145","12.878","0.005","19.311","0.009","14.387","0.008","90","","112.56","0.04","90","","3304","3","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H60 O24 Pd6 S12 -","- C36 H60 O24 Pd6 S12 -","- C72 H120 O48 Pd12 S24 -","2","0.5","SH1051","Schneider, I.; Hörner, M.; Olendzki, R. N.; Strähle, J.","Structure of <i>cyclo</i>-hexakis[bis-μ-(methoxycarbonylmethylthiolato)-palladium(II)], [Pd(SCH~2~COOCH~3~)~2~]~6~","Acta Crystallographica Section C","1993","49","12","2091","2093","10.1107/S0108270193005657","","","0.71069","MoKα","","","0.033","","","0.043","","","","","1.657","1.657","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001146","17.06","0.002","7.088","0.002","15.332","0.002","90","","91.76","0.01","90","","1853.1","0.6","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H11 K3 N2 O12 -","- C14 H11 K3 N2 O12 -","- C56 H44 K12 N8 O48 -","4","1","OH1023","Nakamura, N.; Kohzuma, T.; Kuma, H.; Suzuki, S.","Structure of a tripotassium pyrroloquinoline quinone salt","Acta Crystallographica Section C","1993","49","12","2093","2095","10.1107/S0108270193005530","","","1.54178","CuKα","","","0.056","","","0.06","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001147","11.782","0.002","12.524","0.002","7.041","0.002","95.49","0.02","98.01","0.02","84.71","0.02","1020.8","0.4","298","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C40 H48 Cu2 O10 -","- C40 H48 Cu2 O10 -","- C40 H48 Cu2 O10 -","1","0.5","AS1036","Fujita, T.; Ohba, S.; Nagamatsu, M.; Tokii, T.; Jury, C. F.; Steward, O. W.; Kato, M.","Dimeric copper(II) 2-methyl-2-phenylpropanoate adducts with water or 2,6-lutidine and a monomeric copper(II) triphenylacetate adduct with 2,6-lutidine","Acta Crystallographica Section C","1993","49","12","2095","2100","10.1107/S0108270193005359","","","0.71073","MoKα","","","0.047","","","0.054","","","","","1.94","1.94","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001148","13.033","0.001","22.608","0.003","16.703","0.001","90","","90.76","0.01","90","","4921.1","0.8","298","2","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H68 Cu2 N2 O8 -","- C27 H31 Cu N O4 -","- C108 H124 Cu4 N4 O16 -","4","1","AS1036","Fujita, T.; Ohba, S.; Nagamatsu, M.; Tokii, T.; Jury, C. F.; Steward, O. W.; Kato, M.","Dimeric copper(II) 2-methyl-2-phenylpropanoate adducts with water or 2,6-lutidine and a monomeric copper(II) triphenylacetate adduct with 2,6-lutidine","Acta Crystallographica Section C","1993","49","12","2095","2100","10.1107/S0108270193005359","","","0.71073","MoKα","","","0.047","","","0.041","","","","","1.57","1.57","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001149","19.928","0.004","10.982","0.002","10.017","0.002","90","","97.98","0.02","90","","2171","0.7","300","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H48 Cu N2 O4 -","- C54 H48 Cu N2 O4 -","- C108 H96 Cu2 N4 O8 -","2","0.5","AS1036","Fujita, T.; Ohba, S.; Nagamatsu, M.; Tokii, T.; Jury, C. F.; Steward, O. W.; Kato, M.","Dimeric copper(II) 2-methyl-2-phenylpropanoate adducts with water or 2,6-lutidine and a monomeric copper(II) triphenylacetate adduct with 2,6-lutidine","Acta Crystallographica Section C","1993","49","12","2095","2100","10.1107/S0108270193005359","","","0.71073","MoKα","","","0.056","","","0.054","","","","","1.61","1.61","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001150","12.76","0.006","5.319","0.004","14.933","0.008","90","","91.05","0.04","90","","1013.3","1.1","295","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C16 H22 Co O14 -","- C16 H22 Co O14 -","- C32 H44 Co2 O28 -","2","0.5","HU1032","Kariuki, B. M.; Jones, W.","Structure of hexaaquacobalt hydrogen phthalate","Acta Crystallographica Section C","1993","49","12","2100","2102","10.1107/S0108270193005918","","","0.71069","MoKα","","","0.056","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001151","16.562","0.001","9.704","0.001","36.591","0.002","90","","92.21","0.01","90","","5876.4","0.8","294","1","293","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","FeBAMP","Bis(2,6-diaminomethylpyridine)Fe(II)Dichloride . 1.67Hydrate","","- C14 H25.33 Cl2 Fe N6 O1.67 -","- C14 H25.3333 Cl2 Fe N6 O1.66667 -","- C168 H304 Cl24 Fe12 N72 O20 -","12","1.5","MU1032","Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W.","Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^","Acta Crystallographica Section C","1993","49","12","2102","2107","10.1107/S010827019300424X","","","0.71073","MolybdenumKα","","0.029","0.029","","0.046","0.049","","","","","0.74","0.74","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001152","16.477","0.002","9.677","0.001","36.534","0.005","90","","91.9","0.01","90","","5822.1","1.2","294","1","293","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","NiBAMP","Bis(2,6-diaminomethylpyridine)Ni(II)Dichloride 1.67Hydrate","","- C14 H25.33 Cl2 N6 Ni O1.67 -","- C14 H25.3333 Cl2 N6 Ni O1.66667 -","- C168 H304 Cl24 N72 Ni12 O20 -","12","1.5","MU1032","Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W.","Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^","Acta Crystallographica Section C","1993","49","12","2102","2107","10.1107/S010827019300424X","","","0.71073","MolybdenumKα","","0.036","0.036","","0.051","0.051","","","","","0.94","0.94","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001153","16.54","0.001","9.709","0.001","36.607","0.002","90","","92.01","0.01","90","","5875","0.8","294","1","293","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","ZnBAMP","Bis(2,6-diaminomethylpyridine)Zn(II)Dichloride . 1.67Hydrate","","- C14 H25.33 Cl2 N6 O1.67 Zn -","- C14 H25.3333 Cl2 N6 O1.66667 Zn -","- C168 H304 Cl24 N72 O20 Zn12 -","12","1.5","MU1032","Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W.","Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^","Acta Crystallographica Section C","1993","49","12","2102","2107","10.1107/S010827019300424X","","","0.71073","MolybdenumKα","","0.036","0.036","","0.091","0.091","","","","","1.73","1.73","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001154","13.01","0.001","9.162","0.001","15.669","0.002","90","","93.251","0.009","90","","1864.7","0.3","294","1","293","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","MnBAMP","Bis(2,6-diaminomethylpyridine)Mn(II)Dichloride Monohydrate","","- C14 H24 Cl2 Mn N6 O -","- C14 H24 Cl2 Mn N6 O -","- C56 H96 Cl8 Mn4 N24 O4 -","4","0.5","MU1032","Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W.","Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^","Acta Crystallographica Section C","1993","49","12","2102","2107","10.1107/S010827019300424X","","","0.71073","MolybdenumKα","","0.034","0.034","","0.064","0.064","","","","","0.6","0.6","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001155","8.758","0.002","26.749","0.005","17.32","0.003","90","","90","","90","","4057.5","1.4","294","1","293","","","","","","","","","6","P c c n","-P 2ab 2ac","56","CoBAMP","Bis(2,6-diaminomethylpyridine)Co(III)Trichloride Hemihydrate","","- C14 H22 Cl3 Co N6 O0.5 -","- C14 H22 Cl3.5 Co N6 O -","- C112 H176 Cl28 Co8 N48 O8 -","8","1","MU1032","Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W.","Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^","Acta Crystallographica Section C","1993","49","12","2102","2107","10.1107/S010827019300424X","","","0.71073","MolybdenumKα","","0.072","0.072","","0.117","0.117","","","","","1.83","1.83","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001156","17.628","0.004","10.168","0.001","6.496","0.001","90","","90","","90","","1164.4","0.3","294","1","293","","","","","","","","","6","P n a 21","P 2c -2n","33","CuBAMP","(2,6-diaminomethylpyridine)Cu(II)Chloride Perchorlate","","- C7 H11 Cl2 Cu N3 O4 -","- C7 H11 Cl2 Cu N3 O4 -","- C28 H44 Cl8 Cu4 N12 O16 -","4","1","MU1032","Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W.","Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^","Acta Crystallographica Section C","1993","49","12","2102","2107","10.1107/S010827019300424X","","","0.71073","MolybdenumKα","","0.032","0.032","","0.049","0.049","","","","","0.86","0.86","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001157","8.737","0.003","10.096","0.004","14.093","0.006","90","","96.05","0.03","90","","1236.2","0.8","240","2","240","0.5","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","trans-tetrachlorobis(hexamethylphosphoric triamide)titanium","","- C12 H36 Cl4 N6 O2 P2 Ti -","- C12 H36 Cl4 N6 O2 P2 Ti -","- C24 H72 Cl8 N12 O4 P4 Ti2 -","2","0.5","MU1061","Clegg, W.; O'Neil, P. A.; Henderson, K. W.; Mulvey, R. E.","Structure of monomeric [TiCl~4~(hexamethylphosphoric triamide)~2~]","Acta Crystallographica Section C","1993","49","12","2108","2109","10.1107/S0108270193006973","","","1.54184","CuKα","","0.0852","0.08","","0.226","","","","","1.12","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001158","10.73","0.002","21.081","0.004","9.868","0.002","90","","111.62","0.02","90","","2075.1","0.8","295","1","295","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 Li2 O8 Zn -","- C16 H20 Li2 O8 Zn -","- C64 H80 Li8 O32 Zn4 -","4","1","MU1063","Clegg, W.; Hunt, P. A.; Straughan, B. P.","Dilithium zinc crotonate, a mixed-metal sheet polymeric structure","Acta Crystallographica Section C","1993","49","12","2109","2112","10.1107/S0108270193006985","","","1.54184","CuKα","","0.0413","0.0378","","0.1064","0.1064","","","","1.046","1.046","1.046","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001159","8.4229","0.0005","12.85","0.003","16.4655","0.0008","90","","94.959","0.005","90","","1775.5","0.4","298","3","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C9 H24 Cl2 Cu N4 O8 -","- C9 H24 Cl2 Cu N4 O12 -","- C36 H96 Cl8 Cu4 N16 O48 -","4","1","AS1041","Lu, T.-H.; Lin, J.-L.; Shu, K.; Yuan, Y.-Z.; Chung, C.-S.","Structure of [(3<i>RS</i>,7<i>SR</i>)-3,7-dimethyl-3,7-diazanonane-1,9-diamine]perchloratocopper(II) perchlorate, [Cu(ClO~4~)(C~9~H~24~N~4~)](ClO~4~)","Acta Crystallographica Section C","1993","49","12","2112","2113","10.1107/S0108270193005736","","","0.7093","MoKα","","","0.032","","","0.032","","","","","0.97","0.97","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001160","9.889","0.003","25.239","0.004","8.402","0.002","90","","92.85","0.02","90","","2094.4","0.9","298","3","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H31 Cl2 N5 Ni O8 -","- C12 H31 Cl2 N5 Ni O8 -","- C48 H124 Cl8 N20 Ni4 O32 -","4","1","AS1043","Tahirov, T. H.; Lu, T.-H.; Liu, Y.-L.; Huang, C.-C.; Yuan, Y.-Z.; Chung, C.-S.","Structure of (2,5,9,13,16-pentaazaheptadecane)perchloratonickel(II) perchlorate, [Ni(ClO~4~)(C~12~H~31~N~5~)](ClO~4~)","Acta Crystallographica Section C","1993","49","12","2114","2115","10.1107/S0108270193005748","","","1.54178","CuKα","","","0.069","","","0.08","","","","","24.27","24.27","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001161","11.351","0.002","9.734","0.002","12.09","0.002","90","","90","","90","","1335.8","0.4","120","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C8 H14 I2 N2 Zn -","- C8 I2 N2 Zn -","- C32 I8 N8 Zn4 -","4","0.5","AL1044","Freer, A. A.; McDermott, G.; Melville, J. C.; Robins, D. J.","Structure of diiodobis(1-pyrroline)zine(II)","Acta Crystallographica Section C","1993","49","12","2115","2117","10.1107/S010827019300544X","","","0.7107","MoKα","","","0.034","","","0.06","","","","","3.2","3.2","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001162","12.362","0.003","10.44","0.003","18.641","0.005","90","","92.29","0.02","90","","2403.9","1.1","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H36 Cl5 N3 Zn -","- C12 H36 Cl5 N3 Zn -","- C48 H144 Cl20 N12 Zn4 -","4","1","OH1035","Ishida, H.; Kashino, S.","Structure of [(CH~3~)~3~CNH~3~]~2~[ZnCl~4~].(CH~3~)~3~CNH~3~Cl","Acta Crystallographica Section C","1993","49","12","2117","2119","10.1107/S0108270193006067","","","0.71073","MoKα","","","0.07","","","0.076","","","","","1.95","1.95","","","","","has coordinates","199682","2020-10-21","18:00:00",""
"2001163","14.251","0.007","10.062","0.009","8.691","0.009","103.91","0.06","90.65","0.07","99.98","0.05","1189.5","1.8","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H37 N2 O7 P S -","- C18 H37 N2 O7 P S -","- C36 H74 N4 O14 P2 S2 -","2","1","OH1022","Izumi, M.; Ichikawa, K.; Suzuki, M.; Tanaka, I.","Structure of bis(triethylammonium) phenylphosphonatosulfate","Acta Crystallographica Section C","1993","49","12","2119","2121","10.1107/S0108270193004688","","","0.71069","MoKα","","","0.0831","","","0.0831","","","","","2.0188","2.0188","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001164","25.767","0.002","13.897","0.002","19.867","0.004","90","","126.91","0.01","90","","5688.3","1.7","293","","","","","","","","","","","3","C 1 c 1","C -2yc","","","","","- C58 H80 O10 -","- C58 H80 O10 -","- C232 H320 O40 -","4","1","PA1034","Guelzim, A.; Khrifi, S.; Baert, F.; Asfari, Z.; Vicens, J.","Structure of diethyl 5,11,17,23-tetra-<i>tert</i>-butyl-26,28-bis(2-methoxyethoxy)calix[4]arene-25,27-bis(oxyacetate)","Acta Crystallographica Section C","1993","49","12","2121","2124","10.1107/S010827019300349X","","","1.5418","CuKα","","","0.062","","","0.062","","","","","2.31","2.31","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001165","20.666","0.002","10.71","0.001","20.302","0.003","90","","118.72","0.008","90","","3940.7","0.8","295","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C24 H19 N O2 S -","- C12 H9.5 N0.5 O S0.5 -","- C96 H76 N4 O8 S4 -","8","2","LI1050","Helliwell, M.; Barnwell, N.; Mitchell, M. B.; Joule, J. A.","Structure of a phenylsulfonylallene","Acta Crystallographica Section C","1993","49","12","2124","2126","10.1107/S0108270193005384","","","1.54178","CuKα","","","0.057","","","0.08","","","","","2.62","2.62","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001166","14.442","0.001","4.561","0.006","18.037","0.002","90","","93.959","0.006","90","","1185.3","1.6","294","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H11 N O2 -","- C16 H11 N O2 -","- C64 H44 N4 O8 -","4","1","HA1045","Glendinning, A.; Hunter, W. N.; Joule, J. A.; Leonard, G. A.","Structure of [2]benzoxepino[4,3-<i>b</i>]indole","Acta Crystallographica Section C","1993","49","12","2126","2128","10.1107/S0108270193004299","","","1.5418","CuKα","","","0.048","","","0.048","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001167","23.513","0.006","5.965","0.002","13.433","0.004","90","","92.05","0.03","90","","1882.8","1","295","2","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 N3 -","- C24 H21 N3 -","- C96 H84 N12 -","4","1","BR1033","Glatzhofer, D. T.; Khan, M. A.","<i>N</i>,<i>N</i>',<i>N</i>''-Triphenyl-1,3,5-triaminobenzene and its σ complex on protonation: a stable <i>N</i>,<i>N</i>',<i>N</i>''-triphenyl-2,4,6-triaminocyclohexadienylium cation","Acta Crystallographica Section C","1993","49","12","2128","2133","10.1107/S0108270193005025","","","0.71069","MoKα","","","0.038","","","0.04","","","","","1.4","1.4","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001168","14.469","0.004","19.264","0.006","9.814","0.003","90","","98.15","0.03","90","","2707.8","1.4","295","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H29 N3 O3 S -","- C31 H29 N3 O3 S -","- C124 H116 N12 O12 S4 -","4","1","BR1033","Glatzhofer, D. T.; Khan, M. A.","<i>N</i>,<i>N</i>',<i>N</i>''-Triphenyl-1,3,5-triaminobenzene and its σ complex on protonation: a stable <i>N</i>,<i>N</i>',<i>N</i>''-triphenyl-2,4,6-triaminocyclohexadienylium cation","Acta Crystallographica Section C","1993","49","12","2128","2133","10.1107/S0108270193005025","","","0.71069","MoKα","","","0.036","","","0.037","","","","","1.3","1.3","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001169","3.986","0.003","11.753","0.004","8.154","0.002","90","","99.2","0.03","90","","377.1","0.3","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Tetrathiooxalsäure-dimetylester","","","- C4 H6 S4 -","- C4 H6 S4 -","- C8 H12 S8 -","2","0.5","SE1030","Sens, I.; Müller, U.","Tetrathiooxalsäure-Dimethylester","Acta Crystallographica Section C","1993","49","12","2133","2134","10.1107/S0108270193007024","","","0.7107","MoKα","","0.061","0.04","","","0.023","","","","","1.5","1.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001170","15.22","0.005","8.229","0.005","15.717","0.005","90","","116.84","0.03","90","","1756.4","1.4","190","","","","","","","","","","","4","P -1","-P 1","2","","","","- C34 H44 O12 S2 -","- C27 H29 O6 S -","- C54 H58 O12 S2 -","2","1","CD1030","Chênevert, R.; Gagnon, R.; Simard, M.","18-Crown-6‒methyl 2-naphthalenesulfonate (1/2) complex","Acta Crystallographica Section C","1993","49","12","2134","2137","10.1107/S0108270193002951","","","1.54178","CuKα","","","0.04","","","0.055","","","","","2.88","2.88","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001171","7.605","0.002","8.401","0.002","11.555","0.002","106.86","0.02","102.57","0.02","102.17","0.02","659.3","0.3","296","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C28 H32 N4 O4 -","2","1","HL1030","Shi, J.; Su, G.; He, Y.","Structures of ethyl 2-cyano-3-(4-dimethylaminophenyl)propenoate (I) and ethyl 2-cyano-3-(4-hydroxy-3-methoxyphenyl)propenoate (II)","Acta Crystallographica Section C","1993","49","12","2137","2139","10.1107/S0108270193004901","","","0.71069","MoKα","","","0.052","","","0.073","","","","","2.25","2.25","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001172","10.644","0.002","9.355","0.002","12.643","0.003","90","","97.18","0.02","90","","1249","0.5","296","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 N O4 -","- C13 H13 N O4 -","- C52 H52 N4 O16 -","4","1","HL1030","Shi, J.; Su, G.; He, Y.","Structures of ethyl 2-cyano-3-(4-dimethylaminophenyl)propenoate (I) and ethyl 2-cyano-3-(4-hydroxy-3-methoxyphenyl)propenoate (II)","Acta Crystallographica Section C","1993","49","12","2137","2139","10.1107/S0108270193004901","","","0.71069","MoKα","","","0.056","","","0.066","","","","","2.08","2.08","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001173","8.594","0.002","14.045","0.006","11.509","0.006","90","","90","","90","","1389.2","1","293","","","","","","","","","","","3","P c a 21","P 2c -2ac","","","","","- C16 H20 O3 -","- C16 H20 O3 -","- C64 H80 O12 -","4","1","HA1049","Soriano-García, M.; Iribe, R. V.; Covarrubias, A.; Olguín, J. S.; Maldonado, L. A.","Structure of 10-hydroxy-4-methoxy-5,9-dimethyltricyclo[7.3.1.0^2,7^]trideca-2,4,6-trien-13-one","Acta Crystallographica Section C","1993","49","12","2140","2141","10.1107/S0108270193005050","","","1.5418","CuKα","","","0.034","","","0.046","","","","","1.3","1.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001174","9.221","0.001","18.157","0.002","10.318","0.001","90","","90","","90","","1727.5","0.3","153","2","153","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","2,4,6-tris(tert.-butyl)anilin","","- C18 H31 N -","- C18 H31 N -","- C72 H124 N4 -","4","0.5","SE1024","Pohl, E.; Herbst-Irmer, R.; Köhler, K.; Roesky, H. W.; Sheldrick, G. M.","Structure of 2,4,6-tri(<i>tert</i>-butyl)aniline at 153 K","Acta Crystallographica Section C","1993","49","12","2141","2143","10.1107/S0108270193005827","","","0.71073","MoKα","","0.0621","0.0522","","0.1662","","","","","1.071","1.086","1.086","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2001175","17.77","0.006","5.379","0.009","36.001","0.006","90","","90","","90","","3441","1","294","","","","","","","","","","","3","P c a 21","P 2c -2ac","","","","","- C22 H19 N3 -","- C22 H19 N3 -","- C176 H152 N24 -","8","2","PA1035","Toupet, L.; Soufiaoui, M.; Carrie, R.","Etude de la phenylhydrazone du 3-benzoyl-1-methylindole","Acta Crystallographica Section C","1993","49","12","2143","2145","10.1107/S0108270193005190","","","0.70926","MoKα","","","0.038","","","0.039","","","","","2.3","2.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001176","17.794","0.005","10.002","0.003","12.502","0.004","90","","92.16","0.03","90","","2223.5","1.2","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H32 Cl N O2 Si3 -","- C13 H32 Cl N O2 Si3 -","- C52 H128 Cl4 N4 O8 Si12 -","4","1","SE1021","Ramm, M.; Schmaucks, G.; Rudert, R.; Schulz, B.","Structure of 1-ethyl-3-(heptamethyltrisiloxan-3-yl)pyrroline hydrochloride, C~13~H~32~NO~2~Si~3~^+^.Cl^{-^}","Acta Crystallographica Section C","1993","49","12","2145","2147","10.1107/S0108270193005621","","","0.71069","MoKα","","","0.062","","","0.072","","","","","2.927","2.927","","","","","has coordinates","190731","2020-10-21","18:00:00",""
"2001177","8.1358","0.0006","8.6407","0.0004","9.6854","0.0005","81.098","0.004","87.352","0.005","72.702","0.005","642.25","0.07","297","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H24 N2 O4 S2 -","- C28 H24 N2 O4 S2 -","- C28 H24 N2 O4 S2 -","1","0.5","CR1052","Davis, D. S.; Stubbs, J. L.; Fronczek, F. R.; Gandour, R. D.","<i>N</i>,<i>N</i>'-(1,2-Ethynylenedi-2,2'-phenylene)bis(4-methylbenzenesulfonamide)","Acta Crystallographica Section C","1993","49","12","2148","2149","10.1107/S0108270193004731","","","1.54184","CuKα","","","0.037","","","0.059","","","","","2.642","2.642","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001178","15.834","0.002","9.558","0.002","8.216","0.001","90","","95.77","0.01","90","","1237.1","0.3","298","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H10 O5 -","- C16 H10 O5 -","- C64 H40 O20 -","4","1","OH1034","Ohsawa, Y.; Ohba, S.","Damnacanthal","Acta Crystallographica Section C","1993","49","12","2149","2151","10.1107/S0108270193005670","","","0.71073","MoKα","","","0.042","","","0.046","","","","","1.82","1.82","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001179","5.707","0.001","10.227","0.002","16.625","0.002","80.48","0.01","87.25","0.01","74.5","0.01","922.2","0.3","296","","296","","","","","","","","","4","P -1","-P 1","2","","(±)(1R,2S,3R,6S,7R,8S,13R)-9-[(phenylacetoxy)ethyl]-10-trifluoromethyl- 11,12-dioxatetracyclo [6.2.1.1.^3,6^0^2,7^]deca-4,9-diene","","- C21 H19 F3 O4 -","- C21 H19 F3 O4 -","- C42 H38 F6 O8 -","2","1","HU1033","Barlow, M. G.; Pritchard, R. G.; Tajammal, S.; Tipping, A. E.","Two diastereoisomers of 1-(10-trifluoromethyl-11,12-dioxatetracyclo[6.2.1.1^3,6^.0^2,7^]dodeca-4,9-dien-9-yl)ethyl phenylacetate, C~21~H~19~F~3~O~4~: members of a series of adducts generated by repeated Diels‒Alder cycloaddition of furan to 5,5,5-trifluoropent-3-yn-2-yl phenylacetate","Acta Crystallographica Section C","1993","49","12","2151","2153","10.1107/S0108270193007668","","","0.7107","MoKα","","","0.0522","","","0.0298","","","","","1.734","1.734","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001180","5.87","0.001","13.845","0.002","22.664","0.002","90","","90","","90","","1841.9","0.4","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(±)(1R,2S,3R,6S,7R,8S,13S)-9-[(phenylacetoxy)ethyl]-10-trifluoromethyl- 11,12-dioxatetracyclo [6.2.1.1.^3,6^0^2,7^]deca-4,9-diene","","- C21 H19 F3 O4 -","- C21 H19 F3 O4 -","- C84 H76 F12 O16 -","4","1","HU1033","Barlow, M. G.; Pritchard, R. G.; Tajammal, S.; Tipping, A. E.","Two diastereoisomers of 1-(10-trifluoromethyl-11,12-dioxatetracyclo[6.2.1.1^3,6^.0^2,7^]dodeca-4,9-dien-9-yl)ethyl phenylacetate, C~21~H~19~F~3~O~4~: members of a series of adducts generated by repeated Diels‒Alder cycloaddition of furan to 5,5,5-trifluoropent-3-yn-2-yl phenylacetate","Acta Crystallographica Section C","1993","49","12","2151","2153","10.1107/S0108270193007668","","","0.7107","MoKα","","","0.0689","","","0.0349","","","","","1.954","1.954","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001181","8.11","0.009","9.07","0.01","15.61","0.02","81.37","0.09","85.29","0.09","68.61","0.09","1057","2","293","","293","","","","","","","","","6","P -1","-P 1","2","","(^+^~-~)-(R^*^{S^*^[S^*^-(S^*^)]})-α,α'-[Iminobis(methylene-6-fluoro- 3,4-dihydro-2H-1-benzopyran-2-methanol] Hydrochloride","","- C22 H27 Cl F2 N O4 -","- C22 H26 Cl F2 N O4 -","- C44 H52 Cl2 F4 N2 O8 -","2","1","NA1052","Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","Structure and absolute configuration of nebivolol: (±)-(<i>R</i>*{<i>S</i>*[<i>S</i>*-(<i>S</i>*)]})-α,α'-[iminobis(methylene)]bis(6-fluoro-3,4-dihydro-2<i>H</i>-1-benzopyran-2-methanol) (nebivolol) hydrochloride (I) and (+)-(<i>S</i>{<i>R</i>[<i>R</i>-(<i>R</i>)]})-nebivolol hydrobromide dihydrate (II)","Acta Crystallographica Section C","1993","49","12","2154","2157","10.1107/S0108270193006687","","","1.54178","CuKα","","0.0935","0.0464","","0.09","0.0699","","","","","1.1","1.1","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001182","4.841","0.004","14.617","0.007","33.46","0.01","90","","90","","90","","2368","2","293","","293","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(+)-(S{R[R-(R)]})-α,α'-[Iminobis(methylene-6-fluoro-3,4-dihydro -2H-1-benzopyran-2-methanol)] Hydrobromide Dihydrate","","- C22 H30 Br F2 N O6 -","- C22 H30 Br F2 N O6 -","- C88 H120 Br4 F8 N4 O24 -","4","1","NA1052","Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","Structure and absolute configuration of nebivolol: (±)-(<i>R</i>*{<i>S</i>*[<i>S</i>*-(<i>S</i>*)]})-α,α'-[iminobis(methylene)]bis(6-fluoro-3,4-dihydro-2<i>H</i>-1-benzopyran-2-methanol) (nebivolol) hydrochloride (I) and (+)-(<i>S</i>{<i>R</i>[<i>R</i>-(<i>R</i>)]})-nebivolol hydrobromide dihydrate (II)","Acta Crystallographica Section C","1993","49","12","2154","2157","10.1107/S0108270193006687","","","1.54178","CuKα","","0.1867","0.0658","","0.1214","0.0833","","","","","1.53","1.53","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001183","7.2214","0.0005","8.0172","0.0007","26.288","0.002","90","","90","","90","","1522","0.2","293","","293","","","","","","","","","5","P 21 c n","P -2n 2a","33","alkynyl pyridinium p-toluenesulfonate salt","1-(3-butynyl)pyridinum p-toluenesulphonate","","- C16 H17 N O3 S -","- C16 H15.5 N O3 S -","- C64 H62 N4 O12 S4 -","4","1","MU1050","Ferguson, G.; Gallagher, J. F.; Maguire, A. R.; Spalding, T. R.; Peters, G.; Morris, J. R.","Structure of 1-(3-butynyl)pyridinium <i>p</i>-toluenesulfonate","Acta Crystallographica Section C","1993","49","12","2160","2162","10.1107/S0108270193006523","","","0.71073","MolybdenumKα","","0.066","0.046","","0.097","0.08","","","","","1.72","1.72","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001184","6.7004","0.0005","7.1548","0.0005","14.7572","0.0014","90","","90","","90","","707.46","0.1","293","","293","","","","","","","","","4","P m c n","-P 2n 2a","62","6-amino-1,3-dimethyluracil","6-amino-1,3-dimethyluracil","","- C6 H9 N3 O2 -","- C6 H9 N3 O2 -","- C24 H36 N12 O8 -","4","0.5","AB1089","Ferguson, G.; Gallagher, J. F.; Low, J. N.; Howie, R. A.; Hueso-Urena, F.; Moreno Carretero, M. N.","Intermolecular N‒H^{···^}O=C hydrogen bonding in the crystal structure of 6-amino-1,3-dimethyluracil","Acta Crystallographica Section C","1993","49","12","2162","2164","10.1107/S0108270193006407","","","0.7093","MoKα","","0.057","0.043","","0.074","0.071","","","","","1.95","1.95","","","","","has coordinates","191032","2020-10-21","18:00:00",""
"2001185","8.431","0.001","20.452","0.003","10.615","0.003","90","","111.42","0.01","90","","1703.9","0.6","298","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C16 H25.44 Br N3 O1.72 -","- C16 H25.44 Br N3 O1.72 -","- C64 H101.76 Br4 N12 O6.88 -","4","1","HA1050","Farrugia, L. J.; Lovatt, P. A.; Peacock, R. D.","Structure of <i>N</i>^1^-(3-phenoxypropyl)-4,7-diaza-1-azoniatricyclo[5.2.1.0^4,10^]decane bromide hydrate","Acta Crystallographica Section C","1993","49","12","2164","2165","10.1107/S0108270193005475","","","0.71069","MoKα","","","0.048","","","0.041","","","","","1.33","1.33","","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2001186","12.424","0.002","14.402","0.002","8.09","0.001","90","","101.06","","90","","1420.7","0.3","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C16 H11 Cl N2 O2 -","- C16 H11 Cl N2 O2 -","- C64 H44 Cl4 N8 O8 -","4","1","AB1072","Özbey, S.; Kendi, E.; Hocaoğlu, N.; Uyar, T.; Mak, T. C. W.","2-(4-Chlorophenylazo)-2-methyl-1,3-indandione","Acta Crystallographica Section C","1993","49","12","2165","2167","10.1107/S0108270193005682","","","0.7107","MoKα","","","0.037","","","0.037","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001187","9.991","0.004","10.012","0.003","11.763","0.002","113.46","0.02","108.65","0.02","96.59","0.03","982.2","0.6","292","","292","","","","","","","","","4","P -1","-P 1","2","","3-cyano-4-(2,4-dimethoxyphenyl)-1,1-diphenyl-2-azabutadiene","","- C24 H20 N2 O2 -","- C24 H20 N2 O2 -","- C48 H40 N4 O4 -","2","1","KA1045","Macíček, J.; Angelova, O.; Dryanska, V.","Structures of 1,1-diphenyl-2-aza-1,3-butadienes. IV. 3-Cyano-4-(2,4-dichlorophenyl)-1,1-diphenyl-2-aza-1,3-butadiene (24CLPD) and 3-cyano-4-(2,4-dimethoxyphenyl)-1,1-diphenyl-2-aza-1,3-butadiene (24MOPD)","Acta Crystallographica Section C","1993","49","12","2169","2173","10.1107/S0108270193006420","","","0.71073","MoKα","","0.408","0.058","","0.065","0.029","","","","2.3","1.573","1.573","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001188","28.0154","0.0006","9.8541","0.0002","21.8502","0.0003","90","","123.375","0.001","90","","5037.34","0.17","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C34 H31 N O -","- C34 H31 N O -","- C272 H248 N8 O8 -","8","1","SH1050","Schollmeyer, D.; Fischer, G.; Pindur, U.","Annellated carbazoles as nucleic acid binding drugs: structure of 6-ethyl-6,11-dihydro-5-(4-phenoxybutyl)-5<i>H</i>-6,11-<i>o</i>-benzenobenzo[<i>b</i>]carbazole","Acta Crystallographica Section C","1993","49","12","2177","2179","10.1107/S0108270193005839","","","1.5418","CuKα","","","0.042","","","0.042","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001189","7.052","0.001","7.616","0.001","22.429","0.003","90","","93.42","0.01","90","","1202.5","0.3","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 N4 O2 -","- C13 H12 N4 O2 -","- C52 H48 N16 O8 -","4","1","AB1075","Ertan, A.; Koziol, J.","Structure of 1,3,9-trimethylalloxazine","Acta Crystallographica Section C","1993","49","12","2179","2181","10.1107/S0108270193005803","","","1.54183","CuKα","","","0.048","","","0.069","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001190","10.6819","0.0009","9.964","0.001","16.2694","0.0009","90","","90","","90","","1731.6","0.2","296","","","","","","","","","","","3","P n a 21","P 2c -2n","","","","","- C20 H22 O3 -","- C23 H13 O3 -","- C92 H52 O12 -","4","1","HL1029","Kagawa, H.; Sagawa, M.; Kakuta, A.","3-(4-<i>tert</i>-Butylphenyl)-3-hydroxy-1-(4-methoxyphenyl)-2-propen-1-one: an SHG active β-diketone","Acta Crystallographica Section C","1993","49","12","2181","2183","10.1107/S0108270193005906","","","1.54178","CuKα","","","0.048","","","0.064","","","","","1.59","1.59","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001191","7.471","0.001","8.588","0.002","5.684","0.001","90","","90","","90","","364.69","0.12","293","","","","","","","","","","","3","P b a m","-P 2 2ab","","","","","- Mn2 Nd O5 -","- Mn2 Nd O5 -","- Mn8 Nd4 O20 -","4","0.5","DU1038","Euzen, P.; Leone, P.; Gueho, C.; Palvadeau, P.","Structure of NdMn~2~O~5~","Acta Crystallographica Section C","1993","49","11","1875","1877","10.1107/S0108270193003221","","","0.71069","MoKα","","","0.02","","","0.021","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001193","18.839","0.002","12.719","0.001","18.743","0.002","90","","109.55","0.02","90","","4232.2","0.9","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- H44 O50 Sr3 V10 -","- H10 O50 Sr3 V10 -","- H40 O200 Sr12 V40 -","4","0.5","MU1037","Nieto, J. M.; Salagre, P.; Medina, F.; Sueiras, J. E.; Solans, X.","Structure of Sr~3~V~10~O~28~.22H~2~O","Acta Crystallographica Section C","1993","49","11","1879","1881","10.1107/S0108270193003361","","","0.71069","MoKα","","","0.031","","","0.033","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001194","9.053","0.001","8.036","0.001","7.834","0.001","90","","90","","90","","569.92","0.12","296","","","","","","","","","","","4","P n a m","-P 2c -2n","","","","","- C2 H4 O6 Pb -","- C2 H4 O6 Pb -","- C8 H16 O24 Pb4 -","4","0.5","AB1074","Virovets, A. V.; Naumov, D. Yu.; Boldyreva, E. V.; Podberezskaya, N. V.","Structure of lead(II) oxalate dihydrate","Acta Crystallographica Section C","1993","49","11","1882","1884","10.1107/S0108270193004652","","","1.54178","CuKα","","","0.027","","","0.028","","","","","1.21","1.21","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001195","10.065","0.002","10.437","0.002","12.974","0.004","68.22","0.02","70.69","0.02","88.31","0.02","1187.6","0.6","293","3","293","3","","","","","","","","5","P -1","-P 1","2","","trans-Dichlorobis(1,2-bis(diphenylphosphino)ethane)osmium(II) Dichloromethane Solvate","","- C53 H50 Cl4 Os P4 -","- C52.928 H49.856 Cl3.856 Os P4 -","- C52.928 H49.856 Cl3.856 Os P4 -","1","0.5","HA1057","Levason, W.; Champness, N. R.; Webster, M.","Structure of <i>trans</i>-dichlorobis[1,2-bis(diphenylphosphino)ethane]osmium(II) dichloromethane solvate","Acta Crystallographica Section C","1993","49","11","1884","1885","10.1107/S0108270193004639","","","0.71069","MoKα","","","0.0231","","","0.0313","","","","","1.27","1.27","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2001196","15.887","0.003","9.858","0.002","17.568","0.003","90","","112.75","0.02","90","","2537.3","0.9","293","","293","","","","","","","","","6","P 1 21/c 1","","","Cobalt(III)sepulchrate cyclo-triphosphate-water(2/7)","(1,3,6,8,10,13,16,19-octaazabicyclo[6.6.6]eicosane)cobalt(III)cyclo-triphosphate -water (2/7)","","- C12 H37 Co N8 O12.5 P3 -","- C12 H34 Co N8 O13 P3 -","- C48 H136 Co4 N32 O52 P12 -","4","1","AL1051","Bacchi, A.; Ferranti, F.; Pelizzi, G.","Structure of two encapsulated cobalt(III) complexes containing <i>cyclo</i>-triphosphate","Acta Crystallographica Section C","1993","49","11","1885","1892","10.1107/S0108270193004263","","","0.7107","MoKα","","","0.0581","","","0.0644","","","","","3.208","3.208","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001197","17.494","0.007","11.548","0.005","22.21","0.01","90","","93.94","0.01","90","","4476","3","293","","293","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","[tris(aminoethylaminomethyl)amine](trisethylendiamine) dicobalt(III)di(cyclo-triphosphate)octahydrate","","- C17.16 H65.24 Co2 N13.72 O26 P6 -","- C19 H70 Co2 N20 O29 P7 -","- C76 H280 Co8 N80 O116 P28 -","4","1","AL1051","Bacchi, A.; Ferranti, F.; Pelizzi, G.","Structure of two encapsulated cobalt(III) complexes containing <i>cyclo</i>-triphosphate","Acta Crystallographica Section C","1993","49","11","1885","1892","10.1107/S0108270193004263","","","0.7107","Mo/Kα","","0.1404","0.0654","","","0.2034","","","","0.992","1.336","1.336","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001198","7.321","0.006","12.79","0.001","22.822","0.003","90","","90","","90","","2137","1.8","290.5","1","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H28 Cr O4 S -","- C22 H28 Cr O4 S -","- C88 H112 Cr4 O16 S4 -","4","1","HL1032","Clark, G. R.; Cambie, R. C.; King, M. D.; Rutledge, P. S.; Woodgate, P. D.","Structure of dicarbonyl[(8,9,11,12,13,14-η)-12,19-dimethoxypodocarpa-8,11,13-triene]thiocarbonylchromium(0)","Acta Crystallographica Section C","1993","49","11","1892","1895","10.1107/S0108270193004172","","","0.71069","MoKα","","","0.0412","","","0.0333","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001199","13.518","0.009","21.496","0.01","20.055","0.01","90","","99.56","0.04","90","","5747","6","299","1","299","1","","","","","","","","5","C 1 c 1","C -2yc","9","","Ethylenediammonium catena-Poly[μ-(2-pyridinecarboxylato-κN,κO:κO')- -tris(pyridinecarboxylato-κN,κO)holmate] Hexahydrate","","- C50 H54 Ho2 N10 O22 -","- C50 H45 Ho2 N10 O22 -","- C200 H180 Ho8 N40 O88 -","4","1","AB1068","Starynowicz, P.","Structure of ethylenediammonium <i>catena</i>-poly[tris(2-pyridinecarboxylato-κ<i>N</i>,κ<i>O</i>)holmate-μ-2-pyridinecarboxylato-κ<i>N</i>,κ<i>O</i>:κ<i>O</i>']hexahydrate","Acta Crystallographica Section C","1993","49","11","1895","1897","10.1107/S0108270193004603","","","0.71069","MoKα","","","0.0308","","","0.0305","","","","","","","","","","","has coordinates","191092","2020-10-21","18:00:00",""
"2001200","8.684","0.002","10.1","0.002","10.109","0.003","71.55","0.02","85.42","0.02","73.97","0.02","808.3","0.4","298","","","","","","","","","","","5","P 1","P 1","1","","","","- C38 H33 Fe O2 P2 -","- C38 H33 Fe O2 P2 -","- C38 H33 Fe O2 P2 -","1","1","HH1031","Shawkataly, O. B.; Khalil, H.; Fun, H.-K.; Chinnakali, K.; Teoh, S.-G.; Ito, Y.; Sawamura, M.","Structure of (<i>R</i>)-1-[(<i>S</i>)-1',2-bis(diphenylphosphino)ferrocenyl]ethyl acetate","Acta Crystallographica Section C","1993","49","11","1898","1900","10.1107/S0108270193003063","","","0.71069","MoKα","","","0.0483","","","0.0384","","","","","0.87","0.87","","","","","has coordinates","278201","2022-09-27","00:27:37",""
"2001201","10.539","0.002","11.902","0.002","9.714","0.002","96.301","0.006","108.962","0.005","75.234","0.004","1113.8","0.4","298","","298","","","","","","","","","5","P -1","-P 1","2","","Tetra-(tetramethylammonium) Octamolybdate Dihydrate","","- C16 H52 Mo8 N4 O28 -","- C16 H52 Mo8 N4 O28 -","- C16 H52 Mo8 N4 O28 -","1","0.5","HH1072","Harrison, W. T. A.; Stucky, G. D.; Gier, T. E.","Tetrakis(tetramethylammonium) octamolybdate dihydrate","Acta Crystallographica Section C","1993","49","11","1900","1902","10.1107/S0108270193004810","","","0.71073","MoKα","","","0.048","","","0.05","","","","","","","","","","","has coordinates","198643","2020-10-21","18:00:00",""
"2001202","11.176","0.002","11.879","0.002","14.026","0.002","96.39","0.01","92.84","0.01","112.8","0.01","1697.2","0.5","295","","","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H32 Cl2 Cu N12 O12 -","- C21 H23 Cl2 Cu N12 O12 -","- C42 H46 Cl4 Cu2 N24 O24 -","2","1","DU1025","Salas, J.-M.; Romero, M.-A.; Enrique, C.; Sirera, R.; Faure, R.","Structure of diaquatris(5,7-dimethyl[1,2,4]triazolo[1,5-<i>a</i>]pyrimidine-<i>N</i>^3^)copper(II) perchlorate dihydrate","Acta Crystallographica Section C","1993","49","11","1902","1905","10.1107/S0108270193004196","","","0.7107","MoKα","","","0.054","","","0.062","","","","","1.6","1.6","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001203","7.539","0.001","8.871","0.001","24.108","0.01","90","","90","","90","","1612.3","0.7","293","","","","","","","","","","","5","P b n m","-P 2c 2ab","","","","","- C17 H18 N2 Ni O3 -","- C17 H18 N2 Ni O3 -","- C68 H72 N8 Ni4 O12 -","4","0.5","HA1026","Elerman, Y.; Kabak, M.; Atakol, O.","An <i>N</i>,<i>N</i>'-bis(salicylidene)-1,3-propanediamine‒nickel complex","Acta Crystallographica Section C","1993","49","11","1905","1906","10.1107/S0108270193004615","","","0.7107","MoKα","","","0.048","","","0.045","","","","","1.11","1.11","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001204","10.452","0.003","11.664","0.004","15.641","0.004","94.37","0.02","89.75","0.02","111.87","0.02","1763.9","0.9","293","","","","","","","","","","","6","P -1","-P 1","2","","Hexacarbonylbis(μ-dicyclohexylphosphanido)cobaltrhenium (Co-Re)","","- C30.5 H46 Co O6.5 P2 Re -","- C31 H48 Co O7 P2 Re -","- C62 H96 Co2 O14 P4 Re2 -","2","1","SE1031","Flörke, U.; Haupt, H.-J.","The first dinuclear cobalt–rhenium cluster compound: hexacarbonylbis(μ-dicyclohexylphosphanido)cobaltrhenium","Acta Crystallographica Section C","1993","49","11","1906","1908","10.1107/S0108270193005013","","","0.71073","MoKα","","","0.038","","","0.034","","","","","1.583","1.583","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001205","9.688","0.002","14.157","0.002","25.52","0.003","90","","94.72","0.01","90","","3488.3","1","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H48 Cu2 N12 S4 -","- C12 H24 Cu N6 S2 -","- C96 H192 Cu8 N48 S16 -","8","2","AS1033","Tahirov, T. H.; Lu, T.-H.; Lan, W.-J.; Chung, C.-S.","Structure of isothiocyanato(1,4,7,11-tetraazacyclotetradecane)copper(II) thiocyanate","Acta Crystallographica Section C","1993","49","11","1908","1910","10.1107/S0108270193004226","","","0.7093","MoKα","","","0.044","","","0.05","","","","","1.38","1.38","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001206","12.532","0.002","13","0.002","12.686","0.004","90","","110.91","0.02","90","","1930.6","0.8","298","3","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H29 Cl3 Co N5 O4 -","- C12 H29 Cl3 Co N5 O4 -","- C48 H116 Cl12 Co4 N20 O16 -","4","1","AS1028","Tahirov, T. H.; Lu, T.-H.; Chen, B.-H.; Lai, C.-Y.; Chung, C.-S.","Structure of <i>meso</i>-chloro(1,4,7,11,14-pentaazacycloheptadecane)cobalt(III) chloride perchlorate","Acta Crystallographica Section C","1993","49","11","1910","1912","10.1107/S0108270193004159","","","0.7093","MoKα","","","0.037","","","0.037","","","","","0.99","0.99","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001207","7.185","0.005","9.552","0.003","16.742","0.003","90","","90","","90","","1149","0.9","298","3","","","","","","","","","","6","P 2 1 1","P 2x","3","","","","- C17 H36 Cl Co N4 O7 -","- C8.5 H18 Cl0.5 Co0.5 N2 O4.5 -","- C17 H36 Cl Co N4 O9 -","2","1","AS1029","Lu, T.-H.; Chen, B.-H.; Chung, C.-S.","Structure of carbonato(<i>C</i>-<i>rac</i>-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane)cobalt(III) perchlorate","Acta Crystallographica Section C","1993","49","11","1912","1914","10.1107/S0108270193004160","","","0.7093","MoKα","","","0.064","","","0.081","","","","","1.04","1.04","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001208","16.012","0.002","8.7156","0.0011","19.13","0.003","90","","90","","90","","2669.7","0.6","296","","","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C16 H40 Ag Cl2 N4 O10 -","- C16 H40 Ag Cl2 N4 O10 -","- C64 H160 Ag4 Cl8 N16 O40 -","4","0.5","HH1059","Po, H. N.; Shen, S.-C.; Doedens, R. J.","Structure of (<i>rac</i>-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane)silver(II) diperchlorate dihydrate","Acta Crystallographica Section C","1993","49","11","1914","1916","10.1107/S0108270193004342","","","0.71073","MoKα","","","0.0535","","","0.0729","","","","","2.51","2.51","","","","","has coordinates","198642","2020-10-21","18:00:00",""
"2001209","7.584","0.002","12.171","0.004","8.293","0.002","90","","106.06","0.02","90","","735.6","0.4","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C5 H7 Cl Hg O2 -","- C2.5 H3.5 Cl0.5 Hg0.5 O -","- C10 H14 Cl2 Hg2 O4 -","4","2","DU1042","Toledano, P.; Bonhomme, C.; Henry, M.; Livage, J.","Structure d'un produit de mercuration de la 2,4-pentanedione, Hg(C~5~H~7~O~2~)Cl","Acta Crystallographica Section C","1993","49","11","1916","1918","10.1107/S0108270193004482","","","0.71069","MoKᾱ","","","0.051","","","0.0601","","","","","3.75","3.75","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001210","7.4764","0.0005","14.938","0.0007","9.7315","0.0003","90","","110.022","0.004","90","","1021.15","0.09","293","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H22 N4 Ni O7 S2 -","- C16 H22 N4 Ni O7 S2 -","- C32 H44 N8 Ni2 O14 S4 -","2","1","SH1041","Bermejo, E.; Castiñeiras, A.; Domínguez, R.; Strähle, J.; Hiller, W.","Aqua[1,8-di(2-pyridyl)-3,6-dithiaoctane-<i>N</i>,<i>N</i>',<i>S</i>,<i>S</i>'](nitrato-<i>O</i>)nickel(II) nitrate","Acta Crystallographica Section C","1993","49","11","1918","1920","10.1107/S010827019300352X","","","0.7093","MoKα","","","0.031","","","0.034","","","","","0.74","0.74","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001211","7.404","0.001","10.006","0.001","10.093","0.001","90.28","0.01","97.68","0.01","91.77","0.01","740.64","0.15","292","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H16 Cu2 F8 O10 -","- C28 H16 Cu2 F8 O10 -","- C28 H16 Cu2 F8 O10 -","1","0.5","CR1050","Karipides, A.; White, C.","Structure of diaquatetrakis(μ-2,6-difluorobenzoato-κ<i>O</i>:κ<i>O</i>')dicopper(II)","Acta Crystallographica Section C","1993","49","11","1920","1923","10.1107/S0108270193004214","","","0.71073","MoKα","","","0.041","","","0.042","","","","","1.15","1.15","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001212","15.96","0.001","12.447","0.001","17.044","0.001","90","","90","","90","","3385.9","0.4","293","","","","","","","","","","","6","P n a 21","P 2c -2n","","","","","- C30 H33 B N6 O3 V -","- C32 H36 B N7 O3 V -","- C128 H144 B4 N28 O12 V4 -","4","1","AL1033","Beddoes, R. L.; Eardley, D. R.; Mabbs, F. E.; Moorcroft, D.; Passand, M. A.","Isostructural mixed ligand complexes of [VO]^2+^ and [InCl]^2+^ with hydrotris(3,5-dimethylpyrazolyl)borato and 1,3-diphenyl-1,3-propanedionato ligands","Acta Crystallographica Section C","1993","49","11","1923","1926","10.1107/S0108270193004949","","","0.71069","MoKα","","","0.074","","","0.084","","","","","1.07","1.07","","","","","has coordinates","194481","2020-10-21","18:00:00",""
"2001213","8.169","0.002","19.599","0.007","10.737","0.003","90","","99.18","0.02","90","","1697","0.9","293","","","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C32 H36 B Cl In N7 O2 -","- C32 H36 B Cl In N7 O2 -","- C64 H72 B2 Cl2 In2 N14 O4 -","2","1","AL1033","Beddoes, R. L.; Eardley, D. R.; Mabbs, F. E.; Moorcroft, D.; Passand, M. A.","Isostructural mixed ligand complexes of [VO]^2+^ and [InCl]^2+^ with hydrotris(3,5-dimethylpyrazolyl)borato and 1,3-diphenyl-1,3-propanedionato ligands","Acta Crystallographica Section C","1993","49","11","1923","1926","10.1107/S0108270193004949","","","0.71069","MoKα","","","0.034","","","0.043","","","","","1.01","1.01","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001214","33.673","0.004","12.275","0.002","23.057","0.003","90","","97.828","0.002","90","","9441","2","298","","","","","","","","","","","6","I 1 2/c 1","-I 2yc","","","","","- C38 H24 Au2 O12 P2 Ru4 -","- C38 H24 Au2 O12 P2 Ru4 -","- C304 H192 Au16 O96 P16 Ru32 -","8","1","AL0555","Adatia, T.","Structure of the heteronuclear cluster [Au~2~Ru~4~(μ~3~-H)(μ-H)(μ-Ph~2~PC=CHPPh~2~)(CO)~12~]","Acta Crystallographica Section C","1993","49","11","1926","1929","10.1107/S0108270193006432","","","0.71069","MoKα","","","0.0603","","","0.0605","","","","","1.723","1.723","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001215","15.156","0.002","17.34","0.003","13.472","0.002","90","","90","","90","","3540.5","0.9","295","","","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C15 H40 Cl Cr3 N6 O18 S3 -","- C15 H43 Cl Cr3 N8 O18 S3 -","- C60 H172 Cl4 Cr12 N32 O72 S12 -","4","0.5","AL1037","Karu, E.; Anson, C. E.; Cannon, R. D.; Jayasooriya, U. A.; Powell, A. K.","Structure of [Cr~3~O(OOCCH~3~)~6~(OH~2~)~3~]Cl.3[SC(NH~2~)~2~].2H~2~O","Acta Crystallographica Section C","1993","49","11","1929","1932","10.1107/S0108270193004548","","","0.71069","MoKα","","","0.0513","","","0.0447","","","","","2.62","2.62","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001216","5.1","0.002","10.051","0.004","16.453","0.007","90","","94.82","0.05","90","","840.4","0.6","293","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H17 Cu N5 O3 -","- C16 H17 Cu N5 O3 -","- C32 H34 Cu2 N10 O6 -","2","1","DU1037","Kettmann, V.; Frešová, E.; Bláhová, M.; Krätsmár-Šmogrovič, J.","Structure of (pyrazole-κ<i>N</i>^2^)[(<i>S</i>)-<i>N</i>-salicylidene-κ<i>O</i>-alaninato(2‒)-κ<i>N</i>,κ<i>O</i>]copper(II)‒pyrazole (1/1)","Acta Crystallographica Section C","1993","49","11","1932","1934","10.1107/S0108270193003476","","","0.71069","MoKα","","","0.041","","","0.059","","","","","1.36","1.36","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001217","9.165","0.002","19.473","0.004","15.482","0.004","90","","97.51","0.02","90","","2739.4","1.1","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H27 O9 Os3 P -","- C20 H26 O9 Os3 P -","- C80 H104 O36 Os12 P4 -","4","1","HA1037","Farrugia, L. J.","Structure of the ethylidene cluster Os~3~(μ-H)~2~(μ-CHCH~3~)(CO)~9~(P^<i>i^</i>Pr~3~)","Acta Crystallographica Section C","1993","49","11","1934","1936","10.1107/S0108270193001933","","","0.71069","MoKα","","","0.032","","","0.035","","","","","1.49","1.49","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001218","10.941","0.005","14.585","0.004","21.201","0.005","90","","90.83","0.03","90","","3383","2","293","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C42 H38 Br14 Mo6 O2 P2 S8 -","- C42 H38 Br14 Mo6 O2 P2 S8 -","- C84 H76 Br28 Mo12 O4 P4 S16 -","2","0.5","DU1039","Jarchow, S.; Fourmigué, M.; Batail, P.","Electrooxidation of the redox tertiary phosphine 4-(diphenylphosphino)-4',5,5'-trimethyltetrathiafulvalene (<i>P</i>~1~) and the structure of (<i>P</i>~1~O^.+^)~2~Mo~6~Br~14~^2{-^}","Acta Crystallographica Section C","1993","49","11","1936","1939","10.1107/S0108270193003671","","","0.71069","MoKα","","","0.045","","","0.051","","","","","1.63","1.63","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001219","9.247","0.002","16.052","0.006","12.683","0.003","90","","90","","90","","1882.6","0.9","300","2","","","","","","","","","","5","P m c n","P 2n -2a","","","","","- C8 H24 Br4 Co N2 -","- C16 Br8 Co N2 -","- C64 Br32 Co4 N8 -","4","0.5","OH1026","Nishihata, Y.; Sawada, A.; Kasatani, H.; Terauchi, H.","Structure of tetramethylammonium tetrabromocobaltate at room temperature","Acta Crystallographica Section C","1993","49","11","1939","1941","10.1107/S0108270193004937","","","0.71069","MoKα","","","0.0605","","","0.0465","","","","","1.323","1.323","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001220","7.453","0.002","17.238","0.004","8.139","0.002","90","","106.4","","90","","1003.1","0.4","293","1.5","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 N4 O10 U -","- C12 H22 N4 O10 U -","- C24 H44 N8 O20 U2 -","2","0.5","AL1002","Cao, Z.; Wang, H.; Gu, J.; Zhu, L.; Yu, K.","Structure of bis({εpsilon}-caprolactam)dinitratodioxouranium(VI)","Acta Crystallographica Section C","1993","49","11","1942","1943","10.1107/S0108270193004536","","","0.71073","graphite-monochromatizedMoKα","","","0.034","","","0.0288","","","","","1.171","1.171","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001221","10.192","0.006","10.695","0.009","19.501","0.009","90","","99.38","0.04","90","","2097","2","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C23 H20 Cl N S Sn -","- C23 H20 Cl N S Sn -","- C92 H80 Cl4 N4 S4 Sn4 -","4","1","KA1027","Kellö, E.; Vrábel, V.; Lyčka, A.; Sivý, J.","Structure of dibenzylchlorotin(IV) thiooxinate","Acta Crystallographica Section C","1993","49","11","1943","1945","10.1107/S0108270193003154","","","0.71069","MoKα","","","0.046","","","0.048","","","","","0.925","0.925","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001222","10.584","0.004","10.264","0.004","18.064","0.006","90","","101.14","0.03","90","","1925.4","1.2","296","","","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H44 Mn2 N4 O8 S2 -","- C19 H22 Mn N2 O4 S -","- C38 H44 Mn2 N4 O8 S2 -","2","1","LI1030","Aurangzeb, N.; McAuliffe, C. A.; Pritchard, R. G.; Watkinson, M.; Bermejo, M. R.; Garcia-Deibe, A.; Sousa, A.","Facile synthesis and structure of the Mn^IV^‒Mn^IV^ dinuclear complex [Mn(salpn)O]~2~(DMSO)~2~ [salpnH~2~ = <i>N</i>,<i>N</i>'-bis(salicylidene)-1,3-diaminopropane]","Acta Crystallographica Section C","1993","49","11","1945","1947","10.1107/S010827019201326X","","","0.71069","MoKα","","","0.063","","","0.079","","","","","2.88","2.88","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001223","8.449","0.001","12.66","0.002","11.25","0.003","90","","94.05","0.02","90","","1200.3","0.4","295","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 Cl N O2 -","- C13 H12 Cl N O2 -","- C52 H48 Cl4 N4 O8 -","4","1","LI1045","Ondráček, J.; Kovářová, Z.; Maixner, J.; Jursık, F.","Structure of <i>o</i>-(salicylideneamino)phenol hydrochloride","Acta Crystallographica Section C","1993","49","11","1948","1949","10.1107/S0108270193004081","","","0.71073","MoKα","","","0.033","","","0.033","","","","","0.67","0.67","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001224","6.806","0.003","34.693","0.004","7.678","0.002","90","","90","","90","","1812.9","1","191","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C28 H16 O -","- C28 H14 O -","- C112 H56 O4 -","4","0.5","ST1052","Fitzgerald, L. J.; Gerkin, R. E.; Wei, G. P.; Rawal, V. H.","Structure of diphenanthro[1,2-<i>b</i>;2',1'-<i>d</i>]furan at 191 K","Acta Crystallographica Section C","1993","49","11","1949","1952","10.1107/S0108270193003609","","","0.71073","MoKα","","","0.047","","","0.049","","","","","1.59","1.59","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001225","6.906","0.003","3.842","0.005","30.958","0.003","90","","92.04","0.02","90","","820.9","1.1","296","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C11 H8 O2 -","- C11 H8 O2 -","- C44 H32 O8 -","4","1","ST1051","Fitzgerald, L. J.; Gerkin, R. E.","Redetermination of the structures of 1-naphthoic acid and 2-naphthoic acid","Acta Crystallographica Section C","1993","49","11","1952","1958","10.1107/S0108270193002641","","","0.71073","MoKα","","","0.046","","","0.055","","","","","1.93","1.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001226","5.619","0.002","4.957","0.003","30.419","0.003","90","","92.38","0.03","90","","846.5","0.6","296","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C11 H8 O2 -","- C11 H9 O2 -","- C44 H36 O8 -","4","1","ST1051","Fitzgerald, L. J.; Gerkin, R. E.","Redetermination of the structures of 1-naphthoic acid and 2-naphthoic acid","Acta Crystallographica Section C","1993","49","11","1952","1958","10.1107/S0108270193002641","","","0.71073","MoKα","","","0.041","","","0.055","","","","","1.99","1.99","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001227","5.116","0.001","10.572","0.002","28.87","0.01","90","","90","","90","","1561.5","0.7","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(+)-6-[(4-chlorophenyl)(1H-1,2,4-triazol-1-yl)methyl]-1-methyl-1H- benzotriazole","","- C16 H13 Cl N6 -","- C16 H13 Cl N6 -","- C64 H52 Cl4 N24 -","4","1","NA1038","Peeters, O. M.; Schuerman, G. S.; Blaton, N. M.; De Ranter, C. J.","Structure and absolute configuration of (+)-6-[(4-chlorophenyl)(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-1-methyl-1<i>H</i>-benzotriazole (vorozole) and its hydrobromide monohydrate","Acta Crystallographica Section C","1993","49","11","1958","1961","10.1107/S0108270193004792","","","1.54184","CuKα","","0.0861","0.05","","0.2802","0.0628","","","","","1.44","1.44","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001228","6.008","0.003","8.401","0.004","35.92","0.02","90","","90","","90","","1813","1.6","293","","293","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(+)-6-[(4-Chlorophenyl)(1H-1,2,4-triazol-1-yl)methyl]-1-methyl-1H- benzotriazole Hydrobromide Monohydrate","","- C16 H16 Br Cl N6 O -","- C16 H16 Br Cl N6 O -","- C64 H64 Br4 Cl4 N24 O4 -","4","1","NA1038","Peeters, O. M.; Schuerman, G. S.; Blaton, N. M.; De Ranter, C. J.","Structure and absolute configuration of (+)-6-[(4-chlorophenyl)(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-1-methyl-1<i>H</i>-benzotriazole (vorozole) and its hydrobromide monohydrate","Acta Crystallographica Section C","1993","49","11","1958","1961","10.1107/S0108270193004792","","","0.71073","MoKα","","0.0617","0.036","","0.0484","0.0451","","","","","1.57","1.57","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001229","7.3416","0.0008","10.3924","0.0008","21.509","0.002","90","","90","","90","","1641.1","0.3","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)-α-[(2-acetyl-5-methylphenyl)amino]-2,6-dichlorobenzeneacetamide","","- C17 H16 Cl2 N2 O2 -","- C17 H16 Cl2 N2 O2 -","- C68 H64 Cl8 N8 O8 -","4","1","NA1041","Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","Structure and absolute configuration of (‒)-α-[(2-acetyl-5-methylphenyl)amino]-2,6-dichlorobenzeneacetamide","Acta Crystallographica Section C","1993","49","11","1961","1963","10.1107/S0108270193004780","","","1.54184","CuKα","","0.0334","0.0333","","0.0775","0.0575","","","","","0.94","0.94","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001230","10.472","0.005","11.279","0.006","16.358","0.008","90","","104.45","0.04","90","","1871","1.7","298","","","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 -","- C28 H22 -","- C112 H88 -","4","1","HH1050","Jedrzejas, M. J.; Kingu, C. S.; Baker, R. J.; Towns, R. L. R.; Masnovi, J.","Structure of <i>syn</i>-7,8-benzo-9,10-(9',10'-phenanthro)tricyclo[4.2.2.2^2,5^]dodeca-3,7,9-triene","Acta Crystallographica Section C","1993","49","11","1963","1965","10.1107/S0108270193004330","","","0.70926","MoKα","","","0.053","","","0.061","","","","","1.735","1.735","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001231","9.094","0.002","9.078","0.002","6.967","0.002","101.25","0.02","106.99","0.02","76.48","0.02","529.8","0.2","23","","23","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C26 H26 N2 O4 -","2","1","CD1036","Jasinski, J. P.; Woudenberg, R. C.","6,7,8,9-Tetrahydro-4-methyl-2<i>H</i>-pyrano[3,2-<i>g</i>]quinolin-2-one","Acta Crystallographica Section C","1993","49","11","1965","1967","10.1107/S0108270193004974","","","0.7107","MoKα","","","0.0612","","","0.0707","","","","","2.749","2.749","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001232","13.146","0.001","8.917","0.001","12.829","0.001","90","","98.89","0.01","90","","1485.8","0.2","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C17 H21 N O2 -","- C19 H29 N O2 -","- C76 H116 N4 O8 -","4","1","KA1024","Kapor, A.; Stájer, G.; Bernáth, G.","Structure of 2-(2-hydroxyethyl)-1-<i>p</i>-tolyl-4,5,6,7-tetrahydro-3(1<i>H</i>)-isoindolone","Acta Crystallographica Section C","1993","49","11","1967","1969","10.1107/S0108270193004238","","","1.5418","CuKα","","","0.044","","","0.046","","","","","2.24","2.24","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001233","10.851","0.002","14.057","0.002","11.35","0.002","90","","114.8","0.01","90","","1571.6","0.5","253","","253","","","","","","","","","4","I 1 a 1","I -2ya","9","","1,3,5-triisopropyl-2-nitrobenzene","","- C15 H23 N O2 -","- C15 H23 N O2 -","- C60 H92 N4 O8 -","4","1","SH1053","De Ridder, D. J. A.; Schenk, H.; Döpp, D.","Structure of 1,3,5-triisopropyl-2-nitrobenzene","Acta Crystallographica Section C","1993","49","11","1970","1971","10.1107/S0108270193004913","","","1.5418","CuKα","","0.074","0.074","","0.096","0.096","","","","0.284","0.284","0.284","","","","","has coordinates","198721","2020-10-21","18:00:00",""
"2001234","10.974","0.002","11.892","0.001","19.952","0.003","90","","90","","90","","2603.8","0.7","293","","293","","","","","","","","","4","P c a b","-P 2bc 2ac","61","","6-tert-butyl-3,3-dimethyl-3H-indol-1-oxide","","- C14 H19 N O -","- C14 H19 N O -","- C112 H152 N8 O8 -","8","1","SH1054","De Ridder, D. J. A.; Schenk, H.; Döpp, D.","Structure of 6-<i>tert</i>-butyl-3,3-dimethyl-3<i>H</i>-indolium-1-oxide","Acta Crystallographica Section C","1993","49","11","1971","1973","10.1107/S0108270193004925","","","1.5418","CopperKα","","0.082","0.082","","0.135","0.135","","","","0.525","0.525","0.525","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001235","9.433","0.003","12.674","0.003","8.276","0.003","90","","101.99","0.03","90","","967.8","0.5","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(3aS,9bR)-3a,4,5,9b-tetrahydronaphtho[1,2-b]furan-2(3H)-one","","- C12 H12 O2 -","- C12 H12 O2 -","- C48 H48 O8 -","4","1","SH1048","De Ridder, D. J. A.; Schenk, H.; Ghosh, S.","Structure of <i>rac</i>-(3a<i>S</i>,9b<i>R</i>)-3a,4,5,9b-tetrahydronaphtho[1,2-<i>b</i>]furan-2(3<i>H</i>)-one","Acta Crystallographica Section C","1993","49","11","1973","1975","10.1107/S0108270193003348","","","0.71069","MolybdenumKα","","0.049","0.049","","0.072","0.072","","","","0.169","0.169","0.169","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001236","10.653","0.001","7.2936","0.0006","10.6398","0.0009","90","","95.26","0.01","90","","823.22","0.12","293","","293","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","N,N'-dimethylpiperazine-2,3-dithione","","- C6 H10 N2 S2 -","- C6 H10 N2 S2 -","- C24 H40 N8 S8 -","4","0.5","SH1061","De Ridder, D. J. A.","Structure of <i>N</i>,<i>N</i>'-dimethylpiperazine-2,3-dithione: space group correction","Acta Crystallographica Section C","1993","49","11","1975","1976","10.1107/S0108270193005086","","","1.5418","CopperKα","","0.039","0.037","","0.073","0.07","","","","1.18","1.167","1.167","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001237","12.575","0.001","8.489","0.001","17.867","0.002","90","","92.76","0.01","90","","1905.1","0.3","293","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","dimethyl 2-[o-(3,5-dimethylpyrazolyl)anilino]-3-methoxymaleate","","- C18 H21 N3 O5 -","- C18 H21 N3 O5 -","- C72 H84 N12 O20 -","4","1","AB1086","Sardone, N.; Oberti, R.","Structure of dimethyl 2-[<i>o</i>-(3,5-dimethyl-1-pyrazolyl)anilino]-3-methoxymaleate","Acta Crystallographica Section C","1993","49","11","1976","1978","10.1107/S0108270193005451","","","0.71069","MoKα","","0.061","0.047","","","","","","","","0.9575","0.9575","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001238","13.454","0.001","7.317","0.001","15.181","0.001","90","","90","","90","","1494.5","0.3","293","","293","","","","","","","","","5","P n m a","-P 2ac 2n","62","","2-(N-acetyl)imino-3-isopropyl-5-methyl-4-phenyl-4-thiazoline","","- C15 H18 N2 O S -","- C15 H18 N2 O S -","- C60 H72 N8 O4 S4 -","4","0.5","AB1085","Declercq, J.-P.; De Kimpe, N.; Boelens, M.","X-ray crystallographic analysis of 2-acetylimino-3-isopropyl-5-methyl-4-phenyl-2,3-dihydro-1,3-thiazole","Acta Crystallographica Section C","1993","49","11","1978","1980","10.1107/S0108270193005669","","","1.54178","CopperKα","","","0.054","","","0.072","","","","","0.75","0.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001239","15.885","0.004","7.804","0.001","10.504","0.001","90","","90","","90","","1302.1","0.4","291","","","","","","","","","","","4","P b c n","-P 2n 2ab","","","Dimethyl 2,2'-Bipyridine-3,3'-dicarboxylate","","- C14 H12 N2 O4 -","- C14 H12 N2 O4 -","- C56 H48 N8 O16 -","4","0.5","AL1057","Rice, C. R.; Robinson, K. J.; Wallis, J. D.","Intramolecular interactions in dimethyl 2,2'-bipyridine-3,3'-dicarboxylate","Acta Crystallographica Section C","1993","49","11","1980","1982","10.1107/S0108270193005931","","","0.71069","MoKα","","","0.033","","","0.035","","","","","0.62","0.62","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001240","12.498","0.004","18.723","0.005","12.68","0.003","90","","100.87","0.02","90","","2913.9","1.4","288","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","","","","","- C33 H28 O8 -","- C33 H28 O8 -","- C132 H112 O32 -","4","1","CD1019","Bormann, L. M.; Baughman, R. G.; Mumba, P.; Meloan, C. E.","Structure of pentaerythritol tetrabenzoate","Acta Crystallographica Section C","1993","49","11","1982","1985","10.1107/S0108270193003579","","","1.54184","CuKα","","","0.052","","","0.033","","","","","2.48","2.48","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001241","8.961","0.001","8.979","0.002","13.92","0.002","91.12","0.02","97.66","0.01","114.75","0.02","1004.5","0.3","294","","","","","","","","","","","2","P -1","-P 1","2","","","","- C14 Cl12 -","- C14 Cl12 -","- C28 Cl24 -","2","1","HH1067","Gano, J. E.; Skrzypczak-Jankun, E.; Kirschbaum, K.; Lenoir, D.; Frank, R.","(<i>Z</i>)-Perchlorostilbene","Acta Crystallographica Section C","1993","49","11","1985","1988","10.1107/S0108270193006201","","","0.71073","MoKα","","","0.04","","","0.055","","","","","1.92","1.92","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001242","26.705","0.004","7.271","0.001","15.403","0.004","90","","118.19","0.02","90","","2636.1","1","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2,4-Trifluoro-3-(trifluoromethyl)-6,8-dimethylphenazine","","- C15 H8 F6 N2 -","- C15 H8 F6 N2 -","- C120 H64 F48 N16 -","8","1","LI1060","Banks, R. E.; Madany, I. M.; Pritchard, R. G.","1,2,4-Trifluoro-6,8-dimethyl-3-trifluoromethylphenazine, C~15~H~8~F~6~N~2~, produced <i>via</i> thermolysis of perfluoro-4-azidotoluene in the presence of 2,4,6-trimethylaniline","Acta Crystallographica Section C","1993","49","11","1988","1990","10.1107/S0108270193005773","","","0.71069","MoKα","","","0.067","","","0.061","","","","","2.483","2.483","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001243","7.5972","0.001","8.9585","0.001","12.672","0.002","73.824","0.011","76.383","0.011","67.823","0.001","758.76","0.18","299","","","","","","","","","","","3","P -1","-P 1","2","","","","- C17 H18 O5 -","- C17 H18 O5 -","- C34 H36 O10 -","2","1","HH1060","Tak, H.; Fronczek, F. R.; Fischer, N. H.","Ceratiolin from <i>Ceratiola ericoides</i>","Acta Crystallographica Section C","1993","49","11","1990","1992","10.1107/S0108270193003981","","","1.54184","CuKα","","","0.042","","","0.06","","","","","2.857","2.857","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001244","19.482","0.002","11.8207","0.0007","11.0553","0.0008","90","","90","","90","","2545.9","0.4","295","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C23 H29 N O11 -","- C23 H29 N O13 -","- C92 H116 N4 O52 -","4","1","AB0308","Czarnocki, Z.; Maurin, J. K.","Enantioselective synthesis of isoquinoline alkaloids from simple sugar. I. Structure of an oxaziridine derivative","Acta Crystallographica Section C","1993","49","11","1992","1994","10.1107/S0108270193004433","","","1.54051","CuKα","","","0.0589","","","0.0828","","","","","3.3","3.3","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001245","7.5137","0.0009","19.178","0.002","27.731","0.006","90","","90","","90","","3996","1.1","298","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C16 H30 Br N3 O4 -","- C16 H30 Br N3 O4 -","- C128 H240 Br8 N24 O32 -","8","1","AL1042","Elding-Pontén, M.","Structure of tetraethylammonium bromide‒succinimide (1/2)","Acta Crystallographica Section C","1993","49","11","1994","1996","10.1107/S010827019300455X","","","0.71069","MoKα","","","0.036","","","0.041","","","","","1.08","1.08","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001246","21.474","0.004","5.523","0.003","20.161","0.002","90","","98.24","0.01","90","","2366.4","1.4","295","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13 H14 Cl N -","- C13 H14 Cl N -","- C104 H112 Cl8 N8 -","8","1","CD1017","Goeta, A. E.; Punte, G.; Rivero, B. E.","Refinement of the molecular structure of benzhydrylamine hydrochloride","Acta Crystallographica Section C","1993","49","11","1996","1998","10.1107/S0108270193004469","","","0.7093","MoKα","","","0.044","","","0.045","","","","","1.91","1.91","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001247","11.865","0.003","11.916","0.001","13.55","0.002","90","","112.97","0.02","90","","1763.8","0.6","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H19 Cl3 N -","- C17 H20 Cl3 N -","- C68 H80 Cl12 N4 -","4","1","CD1018","Castelletto, V.; Punte, G.; Rivero, B. E.; Bruno Blanch, L.","Conformation of 4,4'-dichloro-<i>N</i>,<i>N</i>-diethylbenzhydrylamine","Acta Crystallographica Section C","1993","49","11","1998","2000","10.1107/S010827019300143X","","","0.7093","MoKα","","","0.0475","","","0.0496","","","","","2.41","2.41","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001248","6.882","0.005","17.956","0.003","9.584","0.007","90","","96.06","","90","","1177.7","1.2","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C52 H52 N4 O8 -","4","1","HA1046","He, Y.; Shi, J.; Su, G.","Structure of ethyl 2-cyano-3-(4-methylphenyl)propenoate","Acta Crystallographica Section C","1993","49","11","2000","2002","10.1107/S0108270193004305","","","0.71073","MoKα","","","0.057","","","0.067","","","","","0.823","0.823","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001249","13.317","0.005","7.624","0.001","19.965","0.008","90","","104.15","0.02","90","","1965.5","1.1","293","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C21 H24 O2 S2 -","- C21 H24 O2 S2 -","- C84 H96 O8 S8 -","4","1","SH1046","Albert, B.; Jansen, M.; Güther, R.; Vögtle, F.","2,11-Dithia[3.3]metacyclophane-9-carboxylic acid <i>tert</i>-butyl ester","Acta Crystallographica Section C","1993","49","11","2002","2003","10.1107/S0108270193004561","","","0.71069","MoKα","","","0.0558","","","0.051","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001250","20.841","0.002","12.947","0.002","8.168","0.001","90","","90","","90","","2204","0.5","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C23 H26 N2 O5 -","- C23 H26 N2 O5 -","- C92 H104 N8 O20 -","4","1","CD1011","Valle, G.; Formaggio, F.; Crisma, M.; Toniolo, C.; Kamphuis, J.","Structure of (<i>Z</i>)-<small>L</small>-Pro-<small>D</small>-(αMe)Phe-OH","Acta Crystallographica Section C","1993","49","11","2003","2005","10.1107/S0108270193004457","","","0.7107","MoKα","","","0.046","","","0.053","","","","","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001251","17.03","0.005","15.03","0.004","8.874","0.004","90","","92.87","","90","","2268.5","1.4","293","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C26 H20 N2 O2 Se2 -","- C26 H20 N2 O2 Se2 -","- C104 H80 N8 O8 Se8 -","4","1","PA1036","Warin, V.; Guelzim, A.; Baert, F.; Galet, V.; Houssin, R.; Lesieur, D.","Structure of bis(2-amino-5-benzoylphenyl) diselenide","Acta Crystallographica Section C","1993","49","11","2005","2007","10.1107/S0108270193003506","","","0.7107","MoKα","","","0.04","","","0.04","","","","","1.93","1.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001252","27.961","0.001","8.154","0.004","9.34","0.002","90","","90","","90","","2129.5","1.1","294","1","","","","","","","","","","4","P c a 21","P 2c -2ac","","trans-β-ionyl-1-naphthylurethane","4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-buten-2-yl naphthalenecarbamoate","","- C24 H28 N O2 -","- C24 H28 N O2 -","- C96 H112 N4 O8 -","4","1","HA1043","Beddoes, R. L.; Gorman, A. A.; Unett, D. J.","Structure of the naphthylurethane of <i>trans</i>-β-ionol, a severely nonplanar 1,3-diene","Acta Crystallographica Section C","1993","49","11","2007","2009","10.1107/S0108270193004627","","","0.71069","MoKα","","","0.083","","","0.081","","","","","2.05","2.05","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001253","19.214","0.008","12.727","0.005","10.451","0.004","90","","98.65","0.04","90","","2526.6","1.8","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(2,5-diphenylfuryl)-3-(2,5-diphenylthienyl)sulfoxyde","","- C32 H22 O2 S2 -","- C32 H22 O2 S2 -","- C128 H88 O8 S8 -","4","1","PA1041","Ginderow, D.; Mornon, J.-P.; Erdelmeier, I.; Dansette, P.; Mansuy, D.","Structure du 2,5-diphényl-3-furyl 2,5-diphényl-3-thiényl sulfoxyde","Acta Crystallographica Section C","1993","49","11","2009","2012","10.1107/S0108270193005487","","","","CuKα","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001254","6.541","0.003","29.591","0.012","5.72","0.002","90","","108.33","0.04","90","","1051","0.8","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Chloro-N-(2,5-dihydro-5-oxo-2-furanyl)benzamide","","- C11 H8 Cl N O3 -","- C11 H8 Cl N O3 -","- C44 H32 Cl4 N4 O12 -","4","1","PA1058","Ginderow, D.; Valla, A.; Giraud, M.; Michaïlidis, A.; Labia, R.; Morand, A.","Structure du 4-chloro-<i>N</i>-(2,5-dihydro-5-oxo-2-furyl)benzamide, C~11~H~8~CINO~3~","Acta Crystallographica Section C","1993","49","11","2012","2013","10.1107/S0108270193005955","","","1.5418","CuKα","","","0.067","","","0.073","","","","","1.353","1.353","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001255","14.767","0.001","8.243","0.002","15.13","0.001","90","","105.36","0.01","90","","1775.9","0.5","294","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C20 H14 Cl2 O4 -","- C20 H14 Cl2 O4 -","- C80 H56 Cl8 O16 -","4","1","BR1036","Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J.","Crystal structure and photochemistry of dimethyl 9,10-dichloro-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate","Acta Crystallographica Section C","1993","49","11","2014","2018","10.1107/S0108270193004445","","","1.5418","CuKα","","","0.046","","","0.064","","","","","1.62","1.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001256","10.42","0.003","17.652","0.001","9.697","0.002","90","","90","","90","","1783.6","0.6","294","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C20 H14 Cl2 O4 -","- C20 H14 Cl2 O4 -","- C80 H56 Cl8 O16 -","4","1","BR1036","Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J.","Crystal structure and photochemistry of dimethyl 9,10-dichloro-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate","Acta Crystallographica Section C","1993","49","11","2014","2018","10.1107/S0108270193004445","","","1.5418","CuKα","","","0.039","","","0.061","","","","","2.04","2.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001257","9.012","0.004","13.272","0.008","7.869","0.006","94.07","0.06","97.79","0.05","88.34","0.04","930","1","294","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H14 Cl2 O6 -","- C20 H14 Cl2 O6 -","- C40 H28 Cl4 O12 -","2","1","BR1036","Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J.","Crystal structure and photochemistry of dimethyl 9,10-dichloro-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate","Acta Crystallographica Section C","1993","49","11","2014","2018","10.1107/S0108270193004445","","","1.5418","CuKα","","","0.087","","","0.121","","","","","3.7","3.7","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001258","10.176","0.001","12.075","0.002","8.077","0.001","108.88","0.01","112.79","0.01","83.86","0.01","865.6","0.2","294","","294","","","","","","","","","3","P -1","-P 1","2","","Dimethyl 9-formyl-9,10-dihydro-9,10-ethenoanthracene- 11,12-dicarboxylate","","- C21 H16 O5 -","- C21 H16 O5 -","- C42 H32 O10 -","2","1","BR1045","Chen, J.; Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J.","Structure of dimethyl 9-formyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate","Acta Crystallographica Section C","1993","49","11","2018","2019","10.1107/S010827019300575X","","","1.5418","CopperKα","","0.104","0.04","","0.058","0.052","","","","","1.42","1.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001259","7.687","0.003","11.553","0.005","16.003","0.008","90","","91.26","0.03","90","","1420.8","1.1","293","","293","","","","","","","","","3","P 1 21 1","P 2yb","4","","cerleaside-A","","- C30 H46 O9 -","- C30 H46 O9 -","- C60 H92 O18 -","2","1","PA1053","Nguyen-Ngoc, S.; Nguyen-Ngoc, H.; Khuong-Huu, F.; Khuong-Huu, Q.; Chiaroni, A.; Riche, C.","Study of cerleaside A, a glycoside from <i>Cerbera odollam</i>","Acta Crystallographica Section C","1993","49","11","2020","2022","10.1107/S0108270193004500","","","1.5418","CuKα","","","0.048","","","0.066","","","","","1.45","1.45","","","","","has coordinates","194455","2020-10-21","18:00:00",""
"2001260","5.73","0.001","15.767","0.006","8.394","0.001","90.09","0.01","104.5","0.02","90.63","0.01","734.1","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","cis-transoid-cis-7,8-dihydroxytricyclo[7.5.0.0^2,8^]tetradec-1-yl acetate","","- C16 H26 O4 -","- C16 H26 O4 -","- C32 H52 O8 -","2","1","AL1053","Ianelli, S.; Nardelli, M.; Belletti, D.; Brosse, N.; Jamart-Grégoire, B.; Caubère, P.","Structural studies of the regioselectivity of bishydroxylation of polycyclic methylenecyclobutanol derivatives","Acta Crystallographica Section C","1993","49","11","2022","2027","10.1107/S0108270193004718","","","1.54178","CuKᾱ","","0.0512","0.0366","","0.1076","0.0998","","","","1.009","1.128","1.128","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001261","14.172","0.003","12.174","0.002","11.105","0.002","65.36","0.01","65.09","0.12","63.81","0.01","1495.2","1.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","cis-cisoid-cis-8,9-dihydroxytricyclo[6.5.0.0^2,7^]tridec-2-yl acetate","","- C15 H24 O4 -","- C15 H24 O4 -","- C60 H96 O16 -","4","2","AL1053","Ianelli, S.; Nardelli, M.; Belletti, D.; Brosse, N.; Jamart-Grégoire, B.; Caubère, P.","Structural studies of the regioselectivity of bishydroxylation of polycyclic methylenecyclobutanol derivatives","Acta Crystallographica Section C","1993","49","11","2022","2027","10.1107/S0108270193004718","","","1.54178","CuKᾱ","","0.0817","0.0492","","0.1681","0.1351","","","","0.924","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001262","10.196","0.002","9.233","0.002","20.068","0.004","90","","90.33","0.01","90","","1889.2","0.7","293","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H21 N3 O6 -","- C17 H21 N3 O6 -","- C68 H84 N12 O24 -","4","1","AB1055","Ravikumar, K.; Mehdi, S.","Structure of a cyclohexanone derivative","Acta Crystallographica Section C","1993","49","11","2027","2030","10.1107/S0108270193004809","","","0.71063","MoKα","","","0.056","","","0.053","","","","","1.92","1.92","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001263","9.12","0.003","15.407","0.001","10.573","0.003","90","","103.96","0.01","90","","1441.8","0.6","293","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","","","","","- C17 H14 O5 -","- C17 H14 O5 -","- C68 H56 O20 -","4","1","PA1047","Wallet, J.-C.; Gaydou, E. M.; Mas, M.; Molins, E.; Miravitlles, C.","2-(2,3-Dimethoxyphenyl)-6-hydroxy-4<i>H</i>-1-benzopyran-4-one (6-hydroxy-2',3'-dimethoxyflavone)","Acta Crystallographica Section C","1993","49","11","2030","2032","10.1107/S0108270193005177","","","0.71073","MoKα","","","0.053","","","0.084","","","","","3","3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001264","19.466","0.005","9.554","0.002","18.936","0.004","90","","117.5","0.02","90","","3123.8","1.4","295","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C14 H18 O7 S -","- C14 H18 O7 S -","- C112 H144 O56 S8 -","8","1","PA1045","Rodier, N.; Ronco, G.; Julien, R.; Postel, D.; Villa, P.","2,4:3,5-Di-<i>O</i>-méthylène-1-<i>p</i>-toluènesulfonylxylitol","Acta Crystallographica Section C","1993","49","11","2032","2033","10.1107/S0108270193005153","","","1.5418","CuKᾱ","","","0.043","","","0.042","","","","","1.94","1.94","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001265","11.357","0.001","11.733","0.001","15.205","0.001","91.637","0.008","111.561","0.007","96.03","0.009","1868.9","0.3","294","","","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H19 Cl2 N3 O2 -","- C19.5 H20 Cl2 N3 O3 -","- C78 H80 Cl8 N12 O12 -","4","2","PA1048","Rodier, N.; Céolin, R.; Agafonov, V.; Toscani, S.; Dugué, J.; Nicolaï, E.; Teulon, J.-M.","Acide 4-{6-chloro-3-(4-chlorobenzyl)imidazo[4,5-<i>b</i>]pyridin-2-yl}-3,3-diméthylbutanoïque","Acta Crystallographica Section C","1993","49","11","2034","2037","10.1107/S0108270193005001","","","1.5418","CuKᾱ","","","0.048","","","0.05","","","","","1.79","1.79","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001266","12.226","0.002","8.565","0.001","12.675","0.001","90","","109.85","0.01","90","","1248.4","0.3","294","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 N2 O2 -","- C13 H14 N2 O2 -","- C52 H56 N8 O8 -","4","1","PA1049","Rodier, N.; Céolin, R.; Dugué, J.; Lepage, F.","2,6-Diméthyl-<i>N</i>-(5-méthyl-3-isoxazolyl)benzamide","Acta Crystallographica Section C","1993","49","11","2037","2039","10.1107/S0108270193004998","","","1.5418","CuKᾱ","","","0.043","","","0.051","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001267","13.655","0.001","5.562","0.001","17.1","0.002","90","","98.82","0.01","90","","1283.4","0.3","291","1","291","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-(2-methylpropylthio)pyridin-2-yl methanesulfonate","","- C10 H15 N O3 S2 -","- C10 H15 N O3 S2 -","- C40 H60 N4 O12 S8 -","4","1","HL1033","Mackay, M. F.; Holan, G.; Wernert, G. T.; Winkler, D. A.","6-(2-Methylpropylthio)-2-pyridyl methanesulfonate","Acta Crystallographica Section C","1993","49","11","2039","2040","10.1107/S0108270193005815","","","1.5418","CopperKα","","","0.041","","","0.059","","","","","1","1","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2001268","13.394","0.008","4.718","0.002","8.084","0.007","90","","103.12","0.02","90","","497.5","0.6","296","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H9 N O2 -","- C13 H9 N O2 -","- C26 H18 N2 O4 -","2","1","OH1020","Terao, H.; Kakuta, A.; Fukazawa, Y.","3-Aminoxanthene-9-one","Acta Crystallographica Section C","1993","49","11","2041","2042","10.1107/S010827019300410X","","","0.71073","MoKα","","","0.043","","","0.056","","","","","1.83","1.83","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001269","11.511","0.003","15.654","0.005","12.358","0.005","90","","90","","90","","2226.8","1.3","294","","","","","","","","","","","4","A b a 2","A 2 -2ab","","","","","- C8 H20 I7 N -","- C8 H18 I7 N -","- C32 H72 I28 N4 -","4","","SE1023","Tebbe, K.-F.; Gilles, T.","Verfeinerung der Kristallstruktur des Tetraethylammoniumheptaiodids","Acta Crystallographica Section C","1993","49","11","2042","2045","10.1107/S0108270193003993","","","0.71069","MoKα","","","0.0321","","","0.0306","","","","","1.75","1.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001270","8.9562","0.0004","7.1033","0.0003","22.744","0.001","90","","90.017","0.004","90","","1446.94","0.11","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","methyl 4-(N-benzylamino)-6-methyl-2-oxo-3-cyclohexene-1-oate","","- C16 H19 N O3 -","- C16 H19 N O3 -","- C64 H76 N4 O12 -","4","1","CR1068","Kubicki, M.; Codding, P. W.","Methyl 4-(benzylamino)-6-methyl-2-oxo-3-cyclohexene-1-carboxylate, C~16~H~19~NO~3~","Acta Crystallographica Section C","1993","49","11","2045","2046","10.1107/S0108270193006055","","","1.54178","CuKα","","0.0443","0.041","","0.114","0.1115","","","","1.05","1.085","1.085","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2001271","15.214","0.006","19.077","0.008","9.991","0.004","90","","90","","90","","2900","2","","","","","","","","","","","","6","P n c a","-P 2a 2n","60","","","","- C7 H13 Br2 N5 O4 Pt -","- C7 H13 Br2 N5 O4 Pt -","- C56 H104 Br16 N40 O32 Pt8 -","8","1","CD1020","Rochon, F. D.; Melanson, R.; Farrell, N.","Structures of the nitroimidazole platinum group metal complexes <i>cis</i>-amminedibromo[1-({[(2-hydroxyethyl)amino]carbonyl}methyl)-2-nitroimidazole]platinum(II) and <i>trans</i>-dichlorobis(1-hydroxyethyl-2-methyl-5-nitroimidazole)palladium(II)","Acta Crystallographica Section C","1993","49","10","1703","1706","10.1107/S0108270193002537","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208226","2020-10-21","18:00:00",""
"2001272","7.155","0.004","20.989","0.009","7.148","0.004","90","","115.37","0.04","90","","969.9","0.9","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C12 H18 Cl2 N6 O6 Pd -","- C12 H18 Cl2 N6 O6 Pd -","- C24 H36 Cl4 N12 O12 Pd2 -","2","0.5","CD1020","Rochon, F. D.; Melanson, R.; Farrell, N.","Structures of the nitroimidazole platinum group metal complexes <i>cis</i>-amminedibromo[1-({[(2-hydroxyethyl)amino]carbonyl}methyl)-2-nitroimidazole]platinum(II) and <i>trans</i>-dichlorobis(1-hydroxyethyl-2-methyl-5-nitroimidazole)palladium(II)","Acta Crystallographica Section C","1993","49","10","1703","1706","10.1107/S0108270193002537","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","190709","2020-10-21","18:00:00",""
"2001273","8.775","0.002","18.848","0.009","25.185","0.008","90","","90","","90","","4165","3","295","1","","","","","","","","","","6","P b c a","-P 2ac 2ab","","","","","- C20 H18 N4 Ni O2 S2 -","- C20 H18 N4 Ni O2 S2 -","- C160 H144 N32 Ni8 O16 S16 -","8","1","HH1041","Macchia, D. J.; Furey, Jnr, W. F.; Lalancette, R. A.","A comparison of the inner coordination spheres of a series of nickel(II) macrocyclic imine ethers","Acta Crystallographica Section C","1993","49","10","1706","1713","10.1107/S0108270193004597","","","0.71069","MoKα","","","0.065","","","0.083","","","","","1.25","1.25","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001274","10.593","0.003","18.366","0.004","10.42","0.003","90","","90","","90","","2027.2","0.9","295","1","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C20 H22 Br2 N2 Ni O2 -","- C20 H16 Br2 N2 Ni O2 -","- C80 H64 Br8 N8 Ni4 O8 -","4","1","HH1041","Macchia, D. J.; Furey, Jnr, W. F.; Lalancette, R. A.","A comparison of the inner coordination spheres of a series of nickel(II) macrocyclic imine ethers","Acta Crystallographica Section C","1993","49","10","1706","1713","10.1107/S0108270193004597","","","0.71069","MoKα","","","0.054","","","0.067","","","","","1.46","1.46","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001275","8.358","0.002","13.259","0.003","12.87","0.004","106.74","0.02","73.51","0.02","110.54","0.01","1252.1","0.6","295","1","","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H31 I N2 Ni O2 -","- C24 H19 I N2 Ni O2 -","- C48 H38 I2 N4 Ni2 O4 -","2","1","HH1041","Macchia, D. J.; Furey, Jnr, W. F.; Lalancette, R. A.","A comparison of the inner coordination spheres of a series of nickel(II) macrocyclic imine ethers","Acta Crystallographica Section C","1993","49","10","1706","1713","10.1107/S0108270193004597","","","0.71069","MoKα","","","0.054","","","0.073","","","","","1.35","1.35","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001276","20.704","0.016","10.287","0.006","16.982","0.008","90","","90","","90","","3617","4","","","","","","","","","","","","5","P n a 21","P 2c -2n","","","","","- C41 H39 Cl Cu P3 -","- C41 H39 Cl Cu P3 -","- C164 H156 Cl4 Cu4 P12 -","4","1","HH1044","Fife, D. J.; Mueh, H. J.; Campana, C. F.","Structure of chloro[1,1,1-tris(diphenylphosphinomethyl)ethane]copper(I)","Acta Crystallographica Section C","1993","49","10","1714","1716","10.1107/S0108270193006584","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001277","16.948","0.004","17.163","0.004","17.677","0.006","90","","109.59","0.02","90","","4844","2","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","","","","","- C15 H12 N2 -","- C15 H12 N2 -","- C240 H192 N32 -","16","2","CR1006","Raptis, R. G.; Staples, R. J.; King, C.; Fackler, Jnr, J. P.","Structure of [3,5-(C~6~H~5~)~2~C~3~H~2~N~2~]~4~. A 3,5-diphenylpyrazole tetramer linked by hydrogen bonds","Acta Crystallographica Section C","1993","49","10","1716","1719","10.1107/S0108270193005980","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001278","11.137","0.001","17.361","0.002","5.5641","0.0004","90","","90","","90","","1075.82","0.18","","","","","","","","","","","","5","P n a 21","P 2c -2n","","","","","- C10 H8 Br N O3 -","- C10 H8 Br N O3 -","- C40 H32 Br4 N4 O12 -","4","1","AS1011","Ha, H.-J.; Park, K. P.; Jeong, J. H.","Structure of (<i>E</i>)-3-bromo-4-nitro-4-phenyl-3-buten-2-one","Acta Crystallographica Section C","1993","49","10","1720","1721","10.1107/S0108270193003956","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001279","8.4561","0.0006","8.4561","0.0006","20.82","0.003","90","","90","","90","","1488.7","0.3","","","","","","","","","","","","4","P 41","P 41","","","","","- C15 H23 N2 O2 -","- C15 H23 N2 O2 -","- C60 H92 N8 O8 -","4","1","HA1044","Olszak, T. A.; Grabowski, M. J.; Gwoździński, K.","Piperidine nitroxide radicals with heterocyclic ring substituents. I. Structure of 4-hydroxy-2,2,6,6-tetramethyl-4-(2-pyridylmethyl)piperidine 1-oxide","Acta Crystallographica Section C","1993","49","10","1722","1723","10.1107/S0108270193005463","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001280","7.927","0.002","6.086","0.002","10.934","0.003","90","","90","","90","","527.5","0.3","291","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- O4 Se Tl2 -","- O4 Se Tl2 -","- O16 Se4 Tl8 -","4","0.5","MU1031","Fábry, J.; Breczewski, T.","Thallium(I) selenate","Acta Crystallographica Section C","1993","49","10","1724","1727","10.1107/S0108270193003373","","","0.71073","MoKα","","","0.0472","","","0.0392","","","","","0.896","0.896","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001281","11.343","0.003","13.078","0.003","6.272","0.001","89.79","0.02","94.36","0.02","104.2","0.02","899.3","0.4","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H15 K2 Li O15 -","- C12 H15 K2 Li O15 -","- C24 H30 K4 Li2 O30 -","2","1","CR1032","Zacharias, D. E.; Glusker, J. P.","Structure of a citrate double salt: potassium dihydrogen citrate‒lithium potassium hydrogen citrate monohydrate","Acta Crystallographica Section C","1993","49","10","1727","1730","10.1107/S0108270193002112","","","0.71069","MoKα","","","0.039","","","0.49","","","","","0.68","0.68","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001282","10.757","0.002","9.65","0.002","18.918","0.003","90","","90.09","0.01","90","","1963.8","0.6","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C6 H6 K2 O7 -","- C6 H6 K2 O7 -","- C48 H48 K16 O56 -","8","1","CR1033","Zacharias, D. E.; Glusker, J. P.","Structure of dipotassium hydrogen citrate","Acta Crystallographica Section C","1993","49","10","1730","1732","10.1107/S0108270193001477","","","0.71069","MoKα","","","0.04","","","0.051","","","","","2.18","2.18","","","","","has coordinates","198853","2020-10-21","18:00:00",""
"2001283","10.72","0.002","12.467","0.002","9.124","0.002","104.77","0.02","100.12","0.02","111.19","0.02","1049.7","0.4","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H20 O19 Sr3 -","- C12 H20 O19 Sr3 -","- C24 H40 O38 Sr6 -","2","1","CR1034","Zacharias, D. E.; Glusker, J. P.","Structure of strontium citrate pentahydrate","Acta Crystallographica Section C","1993","49","10","1732","1735","10.1107/S0108270193000964","","","1.5418","CuKα","","","0.031","","","0.042","","","","","1.25","1.25","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001284","9.99","0.002","17.875","0.004","12.743","0.002","90","","111.76","0.01","90","","2113.4","0.7","291","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C22 H18 N2 S2 Sn -","- C22 H18 N2 S2 Sn -","- C88 H72 N8 S8 Sn4 -","4","1","AB1057","Schmiedgen, R.; Huber, F.; Preut, H.","Diphenylbis(2-pyridinethiolato)tin(IV)","Acta Crystallographica Section C","1993","49","10","1735","1737","10.1107/S0108270193002781","","","0.71073","MoKα","","","0.031","","","0.042","","","","","0.83","0.83","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001285","13.01","0.003","7.687","0.001","13.412","0.002","90","","103.63","0.02","90","","1303.5","0.4","293","","","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C26 H30 Cl N6 O3 V -","- C26 H28 Cl N6 O4 V -","- C52 H56 Cl2 N12 O8 V2 -","2","0.5","SH1042","Neves, A.; Hörner, M.; Fenner, H.; Strähle, J.","Structure of dioxo[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis(2-pyridylmethyl)ethylenediamine]vanadium(V) chloride monohydrate, [VO~2~(tpen)]Cl.H~2~O","Acta Crystallographica Section C","1993","49","10","1737","1739","10.1107/S0108270193003105","","","0.71069","MoKα","","","0.048","","","0.052","","","","","0.844","0.844","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001286","10.197","0.002","12.007","0.003","11.075","0.002","90","","110.16","0.02","90","","1272.9","0.5","20","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H12 As Cl5 Cu2 -","- C4 H12 As Cl5 Cu2 -","- C16 H48 As4 Cl20 Cu8 -","4","1","AB1031","Murray, K.; Willett, R. D.","Tetramethylarsonium pentachlorodicuprate(II)","Acta Crystallographica Section C","1993","49","10","1739","1741","10.1107/S0108270193003853","","","0.71069","MoKα","","","0.0417","","","0.0594","","","","","1.581","1.581","","","","","has coordinates","176342","2020-10-21","18:00:00",""
"2001287","11.763","0.004","13.598","0.005","14.635","0.004","87.66","0.03","66.45","0.02","86.44","0.03","2141.5","1.3","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- C43 H30 Fe3 O7 P2 Te2 -","- C43 H30 Fe3 O7 P2 Te2 -","- C86 H60 Fe6 O14 P4 Te4 -","2","1","HH1039","Rheingold, A. L.; Ostrander, R. L.; Mathur, P.","Heptacarbonylbis(triphenylphosphine)bis(μ~3~-tellurium)-triiron","Acta Crystallographica Section C","1993","49","10","1741","1743","10.1107/S0108270193003075","","","0.71073","MoKα","","","0.0271","","","0.0323","","","","","0.997","0.997","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001288","18.178","0.007","22.16","0.011","24.421","0.008","90","","93.64","0.04","90","","9818","7","295","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","","","","","- C44.5 H Br8 Cl F20 N4 Ni -","- C44.5 H Br8 Cl F20 N4 Ni -","- C356 H8 Br64 Cl8 F160 N32 Ni8 -","8","1","HH1023","Henling, L. M.; Schaefer, W. P.; Hodge, J. A.; Hughes, M. E.; Gray, H. B.; Lyons, J. E.; Ellis, Jnr, P. E.","Copper(II) and nickel(II) octabromo-tetrakis(pentafluorophenyl)porphyrin complexes","Acta Crystallographica Section C","1993","49","10","1743","1747","10.1107/S0108270193003051","","","0.71073","MoKα","","","0.042","","","","","","","","1.22","1.22","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001289","18.099","0.004","22.326","0.004","24.303","0.005","90","","92.31","","90","","9812","3","294","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","","","","","- C44.5 H Br8 Cl Cu F20 N4 -","- C44.5 H Br8 Cl Cu F20 N4 -","- C356 H8 Br64 Cl8 Cu8 F160 N32 -","8","1","HH1023","Henling, L. M.; Schaefer, W. P.; Hodge, J. A.; Hughes, M. E.; Gray, H. B.; Lyons, J. E.; Ellis, Jnr, P. E.","Copper(II) and nickel(II) octabromo-tetrakis(pentafluorophenyl)porphyrin complexes","Acta Crystallographica Section C","1993","49","10","1743","1747","10.1107/S0108270193003051","","","0.71073","MoKα","","","0.047","","","","","","","","1.18","1.18","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001290","14.506","0.002","14.823","0.002","19.243","0.002","90","","90","","90","","4137.7","0.9","298","3","","","","","","","","","","6","P c a b","-P 2bc 2ac","61","","","","- C10 H29 Cl2 Cu N5 O9 -","- C10 H29 Cl2 Cu N5 O9 -","- C80 H232 Cl16 Cu8 N40 O72 -","8","1","AS1026","Lu, T.-H.; Tahirov, T. H.; Bin, C.-K.; Hsiao, C.-D.; Liu, Y.-L.; Lee, J.-C.; Chung, C.-S.","Structure of (2,5,8,11,14-pentaazapentadecane)copper(II) diperchlorate monohydrate","Acta Crystallographica Section C","1993","49","10","1747","1749","10.1107/S010827019300280X","","","1.54178","CuKα","","","0.048","","","0.049","","","","","10.44","10.44","","","","","has coordinates,has disorder","205962","2020-10-21","18:00:00",""
"2001291","10.327","0.004","11.306","0.003","18.427","0.006","90","","90","","90","","2151.5","1.2","294","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C19 H25 Cr N O5 Si -","- C22 H16 Cr N O5 Si -","- C88 H64 Cr4 N4 O20 Si4 -","4","1","ST1037","Heaton, S. B.; Jones, G. B.; Pennington, W. T.","Preparation of chiral tricarbonyl(η^6^-arene)chromium(0) complexes derived from (<i>S</i>)-2-indolinecarboxylic acid","Acta Crystallographica Section C","1993","49","10","1749","1753","10.1107/S0108270193003026","","","0.71073","MoKα","","","0.0383","","","0.0485","","","","","1.51","1.51","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001292","10.183","0.003","11.618","0.004","18.29","0.005","90","","90","","90","","2163.8","1.1","294","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C19 H25 Cr N O5 Si -","- C19 H25 Cr N O5 Si -","- C76 H100 Cr4 N4 O20 Si4 -","4","1","ST1037","Heaton, S. B.; Jones, G. B.; Pennington, W. T.","Preparation of chiral tricarbonyl(η^6^-arene)chromium(0) complexes derived from (<i>S</i>)-2-indolinecarboxylic acid","Acta Crystallographica Section C","1993","49","10","1749","1753","10.1107/S0108270193003026","","","0.71073","MoKα","","","0.0289","","","0.0369","","","","","1.09","1.09","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001293","10.612","0.004","13.902","0.007","17.898","0.006","90","","104.62","0.03","90","","2555","1.9","294","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C29 H25 P S Te -","- C29 H22 P S Te -","- C116 H88 P4 S4 Te4 -","4","1","ST1024","Zhao, J.; Kolis, J. W.; Pennington, W. T.","Tetraphenylphosphonium salts of 2-telluro-5-methylthiophene and its mercury(II) metal complex","Acta Crystallographica Section C","1993","49","10","1753","1756","10.1107/S010827019300232X","","","0.71073","MoKα","","","0.0486","","","0.0552","","","","","1.53","1.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001294","9.632","0.003","17.067","0.004","25.04","0.005","90","","90","","90","","4116.3","1.8","294","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C39 H35 Hg P S3 Te3 -","- C39 Hg P S3 Te3 -","- C156 Hg4 P4 S12 Te12 -","4","1","ST1024","Zhao, J.; Kolis, J. W.; Pennington, W. T.","Tetraphenylphosphonium salts of 2-telluro-5-methylthiophene and its mercury(II) metal complex","Acta Crystallographica Section C","1993","49","10","1753","1756","10.1107/S010827019300232X","","","0.71073","MoKα","","","0.053","","","0.0566","","","","","1.27","1.27","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001295","7.607","0.002","17.091","0.004","8.416","0.002","90","","94.18","0.03","90","","1091.3","0.5","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 Cu N8 O6 -","- C10 H9 Cu0.5 N4 O3 -","- C20 H18 Cu N8 O6 -","2","1","AL1036","Muñoz, M. C.; Lázaro, J. M.; Faus, J.; Julve, M.","Structures of bis(di-2-pyridylamine)dinitratocopper(II) and bis(acetato)bis(di-2-pyridylamine)copper(II) monohydrate","Acta Crystallographica Section C","1993","49","10","1756","1761","10.1107/S0108270193002859","","","0.71069","MoKα","","","0.0426","","","0.0426","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001296","7.309","0.001","10.917","0.001","11.183","0.002","83.45","0.01","76.7","0.01","73.36","0.01","830.9","0.2","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H17 Cu N3 O5 -","- C14 H17 Cu N3 O5 -","- C28 H34 Cu2 N6 O10 -","2","1","AL1036","Muñoz, M. C.; Lázaro, J. M.; Faus, J.; Julve, M.","Structures of bis(di-2-pyridylamine)dinitratocopper(II) and bis(acetato)bis(di-2-pyridylamine)copper(II) monohydrate","Acta Crystallographica Section C","1993","49","10","1756","1761","10.1107/S0108270193002859","","","0.71069","MoKα","","","0.071","","","0.071","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001297","6.895","0.001","9.181","0.001","6.3377","0.0008","105.24","0.01","108.2","0.01","99.45","0.01","354.2","0.09","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H16 Cu N2 O8 -","- C12 H16 Cu N2 O8 -","- C12 H16 Cu N2 O8 -","1","0.5","OH1018","Okabe, N.; Nakamura, T.; Fukuda, H.","Structure of the copper(II) complex isonicotinic acid","Acta Crystallographica Section C","1993","49","10","1761","1762","10.1107/S010827019300318X","","","0.71069","MoKα","","","0.033","","","0.041","","","","","1.68","1.68","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001298","13.08","0.003","11.667","0.007","7.8001","0.0001","90","","90","","90","","1190.3","0.8","296","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H15 Cl O2 Ru -","- C12 H15 Cl O2 Ru -","- C48 H60 Cl4 O8 Ru4 -","4","0.5","HA1028","Toerien, J. G.; Dillen, J. L. M.","Structure of [Ru(η^6^-C~7~H~8~)(acetylacetonato)Cl]","Acta Crystallographica Section C","1993","49","10","1762","1764","10.1107/S0108270193003002","","","0.7107","MoKα","","","0.038","","","0.025","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001299","13.824","0.007","6.178","0.008","17.844","0.006","90","","112.26","0.03","90","","1410","2","294","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C15 H11 Co N2 S2 -","- C15 H11 Co N2 S2 -","- C60 H44 Co4 N8 S8 -","4","1","MU1042","Armstrong, E. M.; Austerberry, M. S.; Beddoes, R. L.; Helliwell, M.; Joule, J. A.; Garner, C. D.","Structure of (η^5^-cyclopentadienyl)[1-(2-quinoxalinyl)ethene-1,2-dithiolato]cobalt(III), [(η^5^-C~5~H~5~)Co{S~2~C~2~H(2-quinoxalinyl)}]","Acta Crystallographica Section C","1993","49","10","1764","1766","10.1107/S0108270193003452","","","0.71069","MoKα","","","0.043","","","0.043","","","","","1.33","1.33","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001300","11.8271","0.0004","11.9869","0.0004","13.0821","0.0005","90","","90","","90","","1854.65","0.11","295","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C8 H12 Cl2 Pd -","- C8 H12 Cl2 Pd -","- C64 H96 Cl16 Pd8 -","8","1","HH1058","Kumar, R.; Maverick, A. W.; Fronczek, F. R.; Doyle, J. R.; Baenziger, N. C.; Howells, M. A. M.","The <i>Pbca</i> polymorph of dichloro(η^4^-1,5-cyclooctadiene)palladium(II)","Acta Crystallographica Section C","1993","49","10","1766","1767","10.1107/S0108270193003889","","","0.71073","MoKα","","","0.022","","","0.029","","","","","1.455","1.455","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001301","9.387","0.005","9.507","0.005","21.279","0.008","90","","92.63","0.04","90","","1897","1.6","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H34 N2 O14 U2 -","- C17 H17 N O7 U -","- C34 H34 N2 O14 U2 -","2","1","PA1039","Navaza, A.; Iroulart, M. G.; Nierlich, M.; Lance, M.; Vigner, J.","Bis(μ-benzoato-κ<i>O</i>:κ<i>O</i>')-bis[(benzoato-κ^2^<i>O</i>,<i>O</i>')(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)dioxouranium(VI)]","Acta Crystallographica Section C","1993","49","10","1767","1770","10.1107/S0108270193003518","","","0.71073","MoKα","","","0.025","","","0.028","","","","","2.4","2.4","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001302","14.33","0.003","7.3123","0.0006","7.236","0.001","90","","115.85","","90","","682.36","0.18","295","","","","","","","","","","","5","C 1 2/m 1","-C 2y","","","","","- C10 H10 Cl4 N2 Ta -","- C10 H10 Cl4 N2 Ta -","- C20 H20 Cl8 N4 Ta2 -","2","0.25","ST1043","Miller, G. J.; Lin, J.; Young, Jnr, V.","Structure and bonding in [TaCl~4~(C~5~H~5~N)~2~]","Acta Crystallographica Section C","1993","49","10","1770","1773","10.1107/S0108270193003919","","","0.71073","MoKα","","","0.042","","","0.059","","","","","1.05","1.05","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001303","13.784","0.004","22.51","0.004","13.409","0.003","90","","90","","90","","4160.5","1.7","295","","295","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","8-N,N-di-p-toluenesulphonamidoquinoline","","- C23 H20 N2 O4 S2 -","- C23 H20 N2 O4 S2 -","- C184 H160 N16 O32 S16 -","8","1","AS1053","Lincoln, S. F.; Mahadevan, I. B.; Tiekink, E. R. T.; Ward, A. D.","8-(<i>N</i>,<i>N</i>-Di-<i>p</i>-toluenesulfonylamino)quinoline","Acta Crystallographica Section C","1993","49","10","1775","1777","10.1107/S0108270193002689","","","0.7107","MoKα","","","0.055","","","0.056","","","","","3.02","3.02","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001304","12.647","0.006","8.277","0.001","13.551","0.006","90","","95.88","0.03","90","","1411","0.9","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 Cl N2 O2 -","- C14 H15 Cl N2 O2 -","- C56 H60 Cl4 N8 O8 -","4","1","LI1044","Palmer, R. A.; Puddle, N.; Lisgarten, J. N.","<i>N</i>-(2-Chloro-6-methylphenyl)-6-methyl-3-pyridinecarboxamide hydrate: an anticonvulsant drug exhibiting solid-state rotational disorder","Acta Crystallographica Section C","1993","49","10","1777","1779","10.1107/S0108270193002768","","","1.54178","CuKα","","","0.048","","","0.0501","","","","","","","","","","","has coordinates,has disorder","277834","2022-09-14","16:39:43",""
"2001305","8.9413","0.0008","7.434","0.001","10.686","0.002","90","","101.27","0.01","90","","696.6","0.17","298","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H6 N4 O7 -","- C14 H6 N4 O7 -","- C28 H12 N8 O14 -","2","1","SH1037","Ramm, M.; Kind, J.; Niclas, H.-J.","Structure of 5,7-dinitro-2,1,3-benzoxadiazol-4-yl phenyl diketone","Acta Crystallographica Section C","1993","49","10","1779","1781","10.1107/S0108270193001659","","","0.71073","MoKα","","","0.032","","","0.042","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001306","10.1029","0.0007","14.5274","0.0009","10.8606","0.0006","90","","109.922","0.005","90","","1498.61","0.17","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C16 H13 N3 S Se -","- C16 H13 N3 S Se -","- C64 H52 N12 S4 Se4 -","4","1","HU1038","Billing, D. G.; Boeyens, J. C. A.; Haag, W.; Lai, L.-L.; Reid, D. H.","Structure of 5,10-dihydro-3-phenylimino-1,2,4-thiaselenazolo[4,5-<i>b</i>][2,4]benzodiazepine","Acta Crystallographica Section C","1993","49","10","1781","1783","10.1107/S0108270193001611","","","0.71069","MoKα","","","0.0431","","","0.0349","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001307","12.478","0.001","6.223","0.001","23.024","0.011","90","","96.36","0.03","90","","1776.8","0.9","298","","298","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","6,6a,7,11b-Tetrahydro-6a-methyl-5-phenyl-5,7-methano-5H- benzo[c]fluorene","","- C25 H22 -","- C25 H22 -","- C100 H88 -","4","1","HH1040","Sullins, D. W.; Holt, E. M.; Eisenbraun, E. J.","6,6a,7,11b-Tetrahydro-6a-methyl-5-phenyl-5,7-methano-5<i>H</i>-benzo[<i>c</i>]fluorene and 9-methyl-1,3,9-triphenylfluorene","Acta Crystallographica Section C","1993","49","10","1783","1786","10.1107/S0108270193001647","","","0.71069","MoKα","","","","","","","","","","","1.12","1.12","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001308","10.543","0.003","11.4","0.003","10.444","0.003","106.9","0.02","77.24","0.02","107.96","0.02","1130.6","0.6","298","","298","","","","","","","","","2","P -1","-P 1","2","","9-Methyl-1,3,9-triphenyl-4aH-fluorene.","","- C32 H24 -","- C32 H24 -","- C64 H48 -","2","1","HH1040","Sullins, D. W.; Holt, E. M.; Eisenbraun, E. J.","6,6a,7,11b-Tetrahydro-6a-methyl-5-phenyl-5,7-methano-5<i>H</i>-benzo[<i>c</i>]fluorene and 9-methyl-1,3,9-triphenylfluorene","Acta Crystallographica Section C","1993","49","10","1783","1786","10.1107/S0108270193001647","","","0.71069","MoKα","","","","","","","","","","","0.61","0.61","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001309","8.934","0.003","11.556","0.004","14.884","0.006","90","","90","","90","","1536.6","1","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2H,3H-2-phenyl-3,4-dimethyl-6-carbonitrile 2R-[2α,3α,6β,9α]- hexahydropyrido [2,1-b][1,3,4] oxadiazin","","- C16 H21 N3 O -","- C16 H21 N3 O -","- C64 H84 N12 O4 -","4","1","PA1042","Chiaroni, A.; Riche, C.; Guerrier, L.; Royer, J.; Grierson, D. S.; Husson, H.-P.","X-ray diffraction analysis of two hexahydropyrido[2,1-<i>b</i>][1,3,4]oxadiazines: evidence for the effect of steric congestion on anion formation at the aminonitrile centre","Acta Crystallographica Section C","1993","49","10","1786","1789","10.1107/S0108270193002136","","","1.5418","CuKα","","","0.041","","","0.06","","","","","0.82","0.82","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2001310","11.756","0.004","7.564","0.003","17.261","0.008","90","","99.78","0.05","90","","1512.6","1.1","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","2H,3H-2-phenyl-3,4-dimethyl-6-carbonitrile 2S-[2β,3α,6β,9β]- hexahydropyrido [2,1-b][1,3,4] oxadiazin","","- C16 H21 N3 O -","- C16 H21 N3 O -","- C64 H84 N12 O4 -","4","2","PA1042","Chiaroni, A.; Riche, C.; Guerrier, L.; Royer, J.; Grierson, D. S.; Husson, H.-P.","X-ray diffraction analysis of two hexahydropyrido[2,1-<i>b</i>][1,3,4]oxadiazines: evidence for the effect of steric congestion on anion formation at the aminonitrile centre","Acta Crystallographica Section C","1993","49","10","1786","1789","10.1107/S0108270193002136","","","1.5418","CuKα","","","0.052","","","0.064","","","","","0.51","0.51","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001311","13.98","0.004","14.788","0.003","5.119","0.003","90","","90","","90","","1058.3","0.7","296","1","296","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","β-cytidine","4-amino-1-β-D-ribofuranosyl-2(1H)-pyrimidinone","","- C9 H13 N3 O5 -","- C9 H13 N3 O5 -","- C36 H52 N12 O20 -","4","1","AB1018","Ward, D. L.","β-Cytidine, C~9~H~13~N~3~O~5~","Acta Crystallographica Section C","1993","49","10","1789","1792","10.1107/S0108270193003464","","","0.71069","MoKα","","0.0615","0.0287","","0.0392","0.033","","","","","1.28","1.28","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001312","6.623","0.003","18.411","0.004","15.631","0.005","90","","96.75","0.02","90","","1892.8","1.1","150","1","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H27 N O5 -","- C22 H27 N O5 -","- C88 H108 N4 O20 -","4","2","BR1032","Parvez, M.; Bai, Y.; Sun, F.; Benn, M. H.","Delnuttaline, (6β,9β,13β)-13-acetoxy-6,9-dihydroxyhetisan-2-one","Acta Crystallographica Section C","1993","49","10","1871","1873","10.1107/S0108270193002525","","","0.71069","MoKα","","","0.048","","","0.047","","","","","2.43","2.43","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001313","9.315","0.001","11.162","0.001","7.657","0.001","108.42","0.01","93.98","0.01","98.9","0.01","740.28","0.15","296","","","","","","","","","","","3","P -1","-P 1","2","","","","- C20 H19 F -","- C20 H19 F -","- C40 H38 F2 -","2","1","GR1009","Gallucci, J. C.; Sharma, P. K.; Black, S. D.; Rinderle, S. J.; Witiak, D. T.","Structure of 6-fluoro-1,2,3,4,7,12-hexahydro-7-methyl-12-methylenebenz[<i>a</i>]anthracene","Acta Crystallographica Section C","1993","49","10","1868","1871","10.1107/S0108270193003713","","","0.71073","MoKα","","","0.041","","","0.046","","","","","1.44","1.44","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001314","7.2471","0.0004","7.2644","0.0004","14.2762","0.0009","85.504","0.005","81.588","0.005","75.323","0.004","718.57","0.07","294","","","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H20 Br N O2 -","- C13 H20 Br N O2 -","- C26 H40 Br2 N2 O4 -","2","1","ST1053","Keblys, V. E.; Garcia, J. G.; Gandour, R. D.; Fronczek, F. R.; Watkins, S. F.","(Benzoylmethyl)(3-hydroxypropyl)dimethylammonium bromide","Acta Crystallographica Section C","1993","49","10","1867","1868","10.1107/S0108270193003610","","","0.71073","MoKα","","","0.03","","","0.031","","","","","1.665","1.665","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001315","16.356","0.004","8.07","0.002","18.379","0.003","90","","114.55","0.01","90","","2206.6","0.9","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3,7-Diphenyl-5,6,10,11-Dibenzotricyclo[7.2.1.0^3,8^]dodeca-5,7,10-trien-4-one","","- C32 H24 O -","- C32 H24 O -","- C128 H96 O4 -","4","1","CR1058","Kashyap, R. P.; Watson, W. H.; Balcı, M.; Taskesenligil, Y.","3,7-Diphenyl-5,6;10,11-dibenzotricyclo[7.2.1.0^3,8^]dodeca-5,7,10-trien-4-one","Acta Crystallographica Section C","1993","49","10","1865","1866","10.1107/S0108270193004470","","","1.54178","CuKα","","","0.0488","","","0.0513","","","","","4.187","4.187","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001316","6.357","0.001","11.429","0.001","11.706","0.001","61.87","0.01","85.52","0.01","87.56","0.01","747.72","0.16","295","","295","","","","","","","","","2","P -1","-P 1","2","","8-Pentacyclo[6.3.0^2,6^.0^3,10^.0^5,9^]undec-3-yl-exo-pentacyclo-[5.4.0.^2,6^.0 ^3,10^.0^5,9^]undecane.","","- C22 H26 -","- C22 H26 -","- C44 H52 -","2","1","HH1068","Watson, W. H.; Kashyap, R. P.; Marchand, A. P.; Deshpande, M. N.","8-Pentacyclo[6.3.0.0^2,6^.0^3,10^.0^5,9^]undec-3'-yl-<i>exo</i>-pentacyclo[5.4.0.0^2,6^.0^3,10^.0^5,9^]undecane","Acta Crystallographica Section C","1993","49","10","1862","1865","10.1107/S0108270193003907","","","0.71073","MoKα","","","0.0504","","","0.0651","","","","","1.371","1.371","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001317","21.972","0.002","9.2992","0.0006","12.486","0.001","90","","90","","90","","2551.2","0.4","294","","","","","","","","","","","3","P b c n","-P 2n 2ab","","","","","- C17 H16 O3 -","- C17 H16 O3 -","- C136 H128 O24 -","8","1","AB1054","Coxon, J. M.; Fong, S. T.; Steel, P. J.; Bott, S. G.; Marchand, A. P.; Zope, U. R.","Structures of two hexacyclic cage diketone monoacetals","Acta Crystallographica Section C","1993","49","10","1859","1862","10.1107/S0108270193003865","","","0.71073","MoKα","","","0.044","","","0.045","","","","","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001318","8.726","0.006","10.013","0.005","10.322","0.007","96.26","0.05","109.63","0.05","91.24","0.05","842.8","1","175","","","","","","","","","","","3","P -1","-P 1","2","","","","- C21 H26 O3 -","- C21 H26 O3 -","- C42 H52 O6 -","2","1","AB1054","Coxon, J. M.; Fong, S. T.; Steel, P. J.; Bott, S. G.; Marchand, A. P.; Zope, U. R.","Structures of two hexacyclic cage diketone monoacetals","Acta Crystallographica Section C","1993","49","10","1859","1862","10.1107/S0108270193003865","","","0.71073","MoKα","","","0.051","","","0.052","","","","","1.18","1.18","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001319","5.856","0.005","21.758","0.004","14.495","0.004","90","","98.16","0.05","90","","1828.2","1.7","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","cis-14-phenylsulfonyl-1,7,9-trioxadispiro[5.1.5.3]hexadecane","","- C19 H26 O5 S -","- C21 H30 O5 S -","- C84 H120 O20 S4 -","4","1","LI1033","Baker, E. N.; Brimble, M. A.; Norris, G. E.; Quail, J. W.; Rush, C. A.","Structure of a bis-spiroacetal, <i>cis</i>-14-phenylsulfonyl-1,7,9-trioxadispiro[5.1.5.3]hexadecane","Acta Crystallographica Section C","1993","49","10","1857","1859","10.1107/S0108270193004135","","","0.7093","MoKα","","0.085","0.051","","0.07","0.061","","","","","1.35","1.35","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001320","13.25","0.001","10.054","0.001","19.496","0.001","90","","90","","90","","2597.2","0.4","298","2","","","","","","","","","","3","P b c a","-P 2ac 2ab","","","","","- C15 H22 O2 -","- C15 H22 O2 -","- C120 H176 O16 -","8","1","OH1027","Kawata, T.; Ohba, S.; Umehara, M.; Honnami, H.","Three isomers of tricyclo[10.3.0.0^4,9^]pentadecane-2,10-dione, (I), (II) and (III), and <i>cis</i>-<i>cisoid</i>-<i>cis</i>-9-hydroxy-9-methyltricyclo[9.3.0.0^3,7^]tetradecan-2-one, (IV)","Acta Crystallographica Section C","1993","49","10","1854","1857","10.1107/S0108270193003750","","","0.71073","MoKα","","","0.046","","","0.043","","","","","3.85","3.85","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001321","10.326","0.003","6.706","0.002","9.761","0.005","90","","101.05","0.04","90","","663.4","0.4","299","2","","","","","","","","","","3","P 1 c 1","P -2yc","","","","","- C15 H22 O2 -","- C15 H22 O2 -","- C30 H44 O4 -","2","1","OH1027","Kawata, T.; Ohba, S.; Umehara, M.; Honnami, H.","Three isomers of tricyclo[10.3.0.0^4,9^]pentadecane-2,10-dione, (I), (II) and (III), and <i>cis</i>-<i>cisoid</i>-<i>cis</i>-9-hydroxy-9-methyltricyclo[9.3.0.0^3,7^]tetradecan-2-one, (IV)","Acta Crystallographica Section C","1993","49","10","1854","1857","10.1107/S0108270193003750","","","0.71073","MoKα","","","0.045","","","0.049","","","","","2.15","2.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001322","18.73","0.003","9.63","0.002","7.218","0.001","90","","94.92","0.02","90","","1297.1","0.4","297","2","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H22 O2 -","- C15 H22 O2 -","- C60 H88 O8 -","4","1","OH1027","Kawata, T.; Ohba, S.; Umehara, M.; Honnami, H.","Three isomers of tricyclo[10.3.0.0^4,9^]pentadecane-2,10-dione, (I), (II) and (III), and <i>cis</i>-<i>cisoid</i>-<i>cis</i>-9-hydroxy-9-methyltricyclo[9.3.0.0^3,7^]tetradecan-2-one, (IV)","Acta Crystallographica Section C","1993","49","10","1854","1857","10.1107/S0108270193003750","","","0.71073","MoKα","","","0.048","","","0.035","","","","","3.15","3.15","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001323","14.276","0.001","10.984","0.002","17.117","0.003","90","","90","","90","","2684.1","0.7","299","2","","","","","","","","","","3","P b c n","-P 2n 2ab","","","","","- C15 H24 O2 -","- C15 H24 O2 -","- C120 H192 O16 -","8","1","OH1027","Kawata, T.; Ohba, S.; Umehara, M.; Honnami, H.","Three isomers of tricyclo[10.3.0.0^4,9^]pentadecane-2,10-dione, (I), (II) and (III), and <i>cis</i>-<i>cisoid</i>-<i>cis</i>-9-hydroxy-9-methyltricyclo[9.3.0.0^3,7^]tetradecan-2-one, (IV)","Acta Crystallographica Section C","1993","49","10","1854","1857","10.1107/S0108270193003750","","","0.71073","MoKα","","","0.054","","","0.033","","","","","2.33","2.33","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001324","13.155","0.009","33.433","0.005","14.634","0.005","90","","90","","90","","6436","5","298","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C29 H38 I O9 P -","- C29 H36 I O9 P -","- C232 H288 I8 O72 P8 -","8","1","HA1047","Chaloner, P. A.; Harrison, R. M.; Hitchcock, P. B.","Structure of methyltris(2,4,6-trimethoxyphenyl)phosphonium iodide ethanol solvate","Acta Crystallographica Section C","1993","49","10","1852","1854","10.1107/S0108270193004317","","","0.71069","MoKα","","","0.059","","","0.081","","","","","2.3","2.3","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001325","8.078","0.002","19.274","0.005","12.686","0.003","90","","102.85","0.02","90","","1925.7","0.8","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","endo 3-Acetoxy-2,4-diethoxy-6-(carbonyloxazolidin-2'-on)-3,4-dihydropyrane","","- C16 H23.5 N O3.5 -","- C17 H26 N O8.5 -","- C68 H104 N4 O34 -","4","1","NA1040","Pohl, E.; Herbst-Irmer, R.; Noltemeyer, M.; Schneider, C.; Tietze, L. F.","Structures of <i>endo</i>- and <i>exo</i>-3-acetoxy-2,4-diethoxy-6-(2-oxo-1,3-oxazolidin-3-ylcarbonyl)-3,4-dihydro-2<i>H</i>-pyran","Acta Crystallographica Section C","1993","49","10","1850","1852","10.1107/S0108270193004202","","","0.71073","MoKα","","0.0595","0.0482","","0.1326","0.1195","","","","1.062","1.06","1.06","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2001326","9.016","0.002","9.038","0.002","10.85","0.002","104.6","0.02","91.6","0.02","91.48","0.02","854.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","exo 3-Acetoxy-2,4-diethoxy-6-(carbonyloxazolidin-2'-on)-3,4-dihydropyrane","","- C15 H21 N O8 -","- C15 H21 N O8 -","- C30 H42 N2 O16 -","2","1","NA1040","Pohl, E.; Herbst-Irmer, R.; Noltemeyer, M.; Schneider, C.; Tietze, L. F.","Structures of <i>endo</i>- and <i>exo</i>-3-acetoxy-2,4-diethoxy-6-(2-oxo-1,3-oxazolidin-3-ylcarbonyl)-3,4-dihydro-2<i>H</i>-pyran","Acta Crystallographica Section C","1993","49","10","1850","1852","10.1107/S0108270193004202","","","0.71073","MoKα","","0.0471","0.0401","","0.1124","0.101","","","","1.058","1.039","1.039","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001327","8.276","0.001","8.819","0.001","12.045","0.002","110.19","0.01","92.61","0.01","106.84","0.01","779.3","0.2","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H21 N2 P -","- C15 H21 N2 P -","- C30 H42 N4 P2 -","2","1","ST1047","Abboud, K. A.; Villanueva, L. A.; Boncella, J. M.","Structure of a phosphazene–aniline compound","Acta Crystallographica Section C","1993","49","10","1848","1850","10.1107/S0108270193002343","","","0.71073","MoKα","","","0.0546","","","0.0658","","","","","2.13","2.13","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001328","6.616","0.001","8.661","0.001","11.693","0.001","77.79","0.01","87.14","0.01","69.02","0.01","611.21","0.14","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H32 O2 Si4 -","- C20 H32 O2 Si4 -","- C20 H32 O2 Si4 -","1","0.5","ST1046","Abboud, K. A.; Smith, Jnr, D. W.; Wagener, K. B.","Structure of cyclo-1,1',4,4'-bis(1,1,3,3-tetramethyl-1,3-disiloxanediyl)dibenzene","Acta Crystallographica Section C","1993","49","10","1845","1848","10.1107/S0108270193002331","","","0.71073","MoKα","","","0.0516","","","0.0655","","","","","2.25","2.25","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001329","6.644","0.002","14.531","0.003","9.413","0.001","90","","103.57","0.02","90","","883.4","0.3","296","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C8 H9 Cl N4 -","- C8 H9 Cl N4 -","- C32 H36 Cl4 N16 -","4","1","OH1021","Okabe, N.; Fukuda, H.; Nakamura, T.","Structure of hydralazine hydrochloride","Acta Crystallographica Section C","1993","49","10","1844","1845","10.1107/S0108270193003762","","","0.71069","MoKα","","","0.047","","","0.056","","","","","1.61","1.61","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001330","7.131","0.001","10.852","0.004","29.553","0.008","90","","91.85","0.02","90","","2285.8","1.1","290","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C25 H16 N4 O9 -","- C25 H19 N4 O9 -","- C100 H76 N16 O36 -","4","1","CD1015","Baldwin, S. L.; Baughman, R. G.","Structure of the charge-transfer complexes 2,4,5,7-tetranitro-9-fluorenone‒1-ethylnaphthalene (1/1) (I) and 2,4,5,7-tetranitro-9-fluorenone‒3,6-dimethylphenanthrene (1/1) (II)","Acta Crystallographica Section C","1993","49","10","1840","1844","10.1107/S0108270193002446","","","1.54184","CuKα","","","0.063","","","0.046","","","","","3.77","3.77","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001331","12.84","0.004","15.072","0.004","14.439","0.003","90","","114.54","0.02","90","","2541.9","1.2","290","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H18 N4 O9 -","- C29 H24 N4 O9 -","- C116 H96 N16 O36 -","4","1","CD1015","Baldwin, S. L.; Baughman, R. G.","Structure of the charge-transfer complexes 2,4,5,7-tetranitro-9-fluorenone–1-ethylnaphthalene (1/1) (I) and 2,4,5,7-tetranitro-9-fluorenone–3,6-dimethylphenanthrene (1/1) (II)","Acta Crystallographica Section C","1993","49","10","1840","1844","10.1107/S0108270193002446","","","1.54184","CuKα","","","0.05","","","0.031","","","","","1.9","1.9","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001332","12.764","0.002","5.768","0.002","20.129","0.005","90","","96.18","0.02","90","","1473.3","0.7","122","","122","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(dl)-trans-3-Hydroxy-5-iodomethyl-2,2-diphenyl-tetrahydrofuran","","- C17 H17 I O2 -","- C17 H17 I O2 -","- C68 H68 I4 O8 -","4","1","AB1063","Frydenvang, K.","Structure determinations of (<i>dl</i>)-<i>trans</i>-3-hydroxy-5-iodomethyl-2,2-diphenyltetrahydrofuran and (<i>dl</i>)-<i>trans</i>-<i>N</i>,<i>N</i>,<i>N</i>-trimethyl-(3-hydroxy-2,2-diphenyltetrahydro-5-furyl)methylammonium iodide","Acta Crystallographica Section C","1993","49","10","1837","1840","10.1107/S0108270193003944","","","1.5418","CuKα","","","0.047","","","0.063","","","","","1.305","1.305","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001333","10.599","0.002","9.27","0.003","19.641","0.004","90","","96.17","0.01","90","","1918.6","0.8","122","","122","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(dl)-trans-N,N,N-trimethyl-(3-hydroxy-2,2-diphenyl-5-tetrahydrofuryl)- methylammonium iodide","","- C20 H26 I N O2 -","- C20 H26 I N O2 -","- C80 H104 I4 N4 O8 -","4","1","AB1063","Frydenvang, K.","Structure determinations of (<i>dl</i>)-<i>trans</i>-3-hydroxy-5-iodomethyl-2,2-diphenyltetrahydrofuran and (<i>dl</i>)-<i>trans</i>-<i>N</i>,<i>N</i>,<i>N</i>-trimethyl-(3-hydroxy-2,2-diphenyltetrahydro-5-furyl)methylammonium iodide","Acta Crystallographica Section C","1993","49","10","1837","1840","10.1107/S0108270193003944","","","0.71073","MoKα","","","0.039","","","0.052","","","","","2.323","2.323","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001334","12.708","0.001","13.131","0.001","7.444","0.001","90","","90","","90","","1242.2","0.2","122","","122","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(-)-muscarone iodide","(-)-cis-N,N,N-Trimethyl-(2(S)-methyl-3-oxotetrahydro-5(S)-furyl)methylammonium iodide","","- C9 H18 I N O2 -","- C12 H18 I -","- C48 H72 I4 -","4","1","AB1062","Frydenvang, K.; Jensen, B.","Structure of (‒)-muscarone iodide","Acta Crystallographica Section C","1993","49","10","1834","1837","10.1107/S0108270193003932","","","0.71073","MoKα","","","0.031","","","0.037","","","","","1.505","1.505","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001335","12.4588","0.0011","7.8993","0.0005","13.222","0.002","90","","90","","90","","1301.3","0.2","297","","","","","","","","","","","3","P b c a","-P 2ac 2ab","","","","","- C16 H14 O2 -","- C16 H14 O2 -","- C64 H56 O8 -","4","0.5","BR1031","Davis, D. S.; Fronczek, F. R.; Gandour, R. D.","Ethynylenebis(2-methoxybenzene)","Acta Crystallographica Section C","1993","49","10","1833","1834","10.1107/S0108270193002732","","","1.54184","CuKα","","","0.039","","","0.063","","","","","4.054","4.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001336","8.2844","0.0004","11.9757","0.001","14.5732","0.0006","68.929","0.005","89.855","0.004","71.337","0.005","1267.82","0.15","293","","293","","","","","","","","","3","P -1","-P 1","2","","(trans-anti-cis)tetramethyl-1-(methoxymethoxymethyl)tricyclo[9.4.0.0^2,8^] pentadec-9-ene-5,5,13,13-tetracarboxylate","","- C26 H38 O10 -","- C26 H38 O10 -","- C52 H76 O20 -","2","1","CD1042","Michel, A. G.; Drouin, M.","Functionalized hydrocarbons with condensed ring skeletons. XV. A (methoxymethoxymethyl)tricyclo[9.4.0.0^2,8^]pentadec-9-ene","Acta Crystallographica Section C","1993","49","10","1830","1833","10.1107/S0108270193002756","","","0.7093","MoKα","","0.069","0.039","","0.031","0.028","","","","","1.58","1.58","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001337","11.747","0.004","9.2937","0.001","12.983","0.003","90","","99.63","0.019","90","","1397.4","0.6","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2-trans-1,10-cis-1-methoxycardonyl-8,14-dioxotricyclo[8.4.0.0^2,7^]tetradec- 6-ene","","- C16 H20 O4 -","- C16 H20 O4 -","- C64 H80 O16 -","4","1","CD1041","Michel, A. G.; Drouin, M.","Functionalized hydrocarbons with condensed ring skeletons. XIV. A dioxotricyclo[8.4.0.0^2,7^]tetradec-6-ene","Acta Crystallographica Section C","1993","49","10","1828","1830","10.1107/S0108270193002975","","","0.7093","MoKα","","0.048","0.034","","0.032","0.03","","","","","1.85","1.85","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001338","6.669","0.002","14.842","0.001","7.7","0.001","90","","96.58","0.01","90","","757.1","0.3","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Phosphinoalanine monohydrate, 2-amino-3-phosphinopropanoic acid monohydrate","2-Amino-2-carboxyethylphosphinic acid monohydrate","","- C3 H10 N O5 P -","- C3 H10 N O5 P -","- C12 H40 N4 O20 P4 -","4","1","HA1053","Schwalbe, C. H. W.; Freeman, S.; DasGupta, M.","2-Amino-2-carboxyethylphosphinic acid monohydrate","Acta Crystallographica Section C","1993","49","10","1826","1828","10.1107/S0108270193003683","","","0.71069","MolybdenumKα","","","0.03","","","0.047","","","","","0.44","0.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001339","7.244","0.007","9.959","0.009","13.727","0.001","90","","102.2","0.1","90","","967.9","1.3","293","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H36 O -","- C22 H36 O -","- C44 H72 O2 -","2","1","LI1047","Decanniere, K.; Maes, D.; Lisgarten, J. N.; Zegers, I.; Biesemans, M.","Structure of 23,24-dinor-5α-cholan-12-one","Acta Crystallographica Section C","1993","49","10","1824","1826","10.1107/S0108270193003336","","","1.5418","CuKα","","","0.0491","","","0.0617","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001340","7.298","0.0003","16.0475","0.0008","7.9701","0.0003","90","","108.289","0.004","90","","886.26","0.07","298","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 O2 -","- C11 H10 O2 -","- C44 H40 O8 -","4","1","CD1038","Garcia, J. G.; Enas, J. D.; Fronczek, F. R.","Structure of a 2-acylindan-1-one","Acta Crystallographica Section C","1993","49","10","1823","1824","10.1107/S0108270193002963","","","0.71073","MoKα","","","0.039","","","0.047","","","","","2.261","2.261","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001341","9.371","0.002","10.14","0.004","19.471","0.002","90","","91.32","0.01","90","","1849.7","0.9","292","","292","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-cyano-4-(2-methoxyphenyl)-1,1-diphenyl-2-aza-1,3-butadiene","","- C23 H18 N2 O -","- C23 H18 N2 O -","- C92 H72 N8 O4 -","4","1","KA1035","Angelova, O.; Macíček, J.; Dryanska, V.","Structures of 1,1-diphenyl-2-aza-1,3-butadienes. I. 3-Cyano-4-(<i>n</i>-methoxyphenyl)-1,1-diphenyl-2-aza-1,3-butadienes (<i>n</i> = 2, 3, 4)","Acta Crystallographica Section C","1993","49","10","1813","1818","10.1107/S0108270193003695","","","0.71073","MoKα","","","0.038","","","0.046","","","","","1.297","1.297","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001342","10.216","0.001","7.706","0.001","23.933","0.003","90","","100.13","0.01","90","","1854.7","0.4","292","","292","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-cyano-4-(3-methoxyphenyl)-1,1-diphenyl-2-aza-1,3-butadiene","","- C23 H18 N2 O -","- C23 H18 N2 O -","- C92 H72 N8 O4 -","4","1","KA1035","Angelova, O.; Macíček, J.; Dryanska, V.","Structures of 1,1-diphenyl-2-aza-1,3-butadienes. I. 3-Cyano-4-(<i>n</i>-methoxyphenyl)-1,1-diphenyl-2-aza-1,3-butadienes (<i>n</i> = 2, 3, 4)","Acta Crystallographica Section C","1993","49","10","1813","1818","10.1107/S0108270193003695","","","0.71073","MoKα","","","0.043","","","0.056","","","","","1.606","1.606","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001343","9.319","0.001","10.391","0.001","10.953","0.001","116.41","0.01","103","0.01","91.49","0.01","915.87","0.19","292","","292","","","","","","","","","4","P -1","-P 1","2","","3-cyano-4-(4-methoxyphenyl)-1,1-diphenyl-2-aza-1,3-butadiene","","- C23 H18 N2 O -","- C23 H18 N2 O -","- C46 H36 N4 O2 -","2","1","KA1035","Angelova, O.; Macíček, J.; Dryanska, V.","Structures of 1,1-diphenyl-2-aza-1,3-butadienes. I. 3-Cyano-4-(<i>n</i>-methoxyphenyl)-1,1-diphenyl-2-aza-1,3-butadienes (<i>n</i> = 2, 3, 4)","Acta Crystallographica Section C","1993","49","10","1813","1818","10.1107/S0108270193003695","","","0.71073","MoKα","","","0.042","","","0.051","","","","","1.435","1.435","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001344","6.103","0.001","12.04","0.001","18.997","0.002","90","","90","","90","","1395.9","0.3","294","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","","","","","- C19 H18 -","- C19 H18 -","- C76 H72 -","4","1","HA1041","Beddoes, R. L.; Gorman, A. A.; McNeeney, S. P.","Structure of 2,3-diphenyl-2-norbornene: comparison with data for a <i>cis</i>-stilbene","Acta Crystallographica Section C","1993","49","10","1811","1813","10.1107/S0108270193002914","","","0.71069","MoKα","","","0.05","","","0.051","","","","","0.83","0.83","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001345","8.283","0.002","6.428","0.002","12.707","0.003","90","","101.39","0.02","90","","663.2","0.3","178","","","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C2 F4 O4 P4 S4 -","- C2 F4 O4 P4 S4 -","- C4 F8 O8 P8 S8 -","2","0.5","HA1040","Jones, P. G.; Weinkauf, A.","9,9,10,10-Tetrafluoro-1,3,5,7-tetrathio-2,4,6,8-tetraaoxa-1,3,5,7-tetraphosphatricyclo[3.3.1.1^3,7^]decane, P~4~O~4~(CF~2~)~2~S~4~: a cage structure related to P~4~O~6~","Acta Crystallographica Section C","1993","49","10","1810","1811","10.1107/S0108270193003014","","","0.71069","MoKα","","","0.027","","","0.038","","","","","2","2","","","","","has coordinates","203415","2020-10-21","18:00:00",""
"2001346","10.622","0.001","11.249","0.002","9.654","0.001","90","","113.9","0.01","90","","1054.6","0.3","295","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C13 H14 O2 -","- C13 H14 O2 -","- C52 H56 O8 -","4","1","SH1043","Aebi, R.; Buechel, R.; Bürgi, H.-B.; Foertsch, M.; Venugopalan, P.","5-Methoxy-3,3a,8,8a-tetrahydro-1<i>H</i>-cyclopenta[<i>a</i>]inden-2-one","Acta Crystallographica Section C","1993","49","10","1808","1809","10.1107/S0108270193003117","","","0.71069","MoKα","","","0.039","","","0.058","","","","","0.875","0.875","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001347","13.407","0.009","8.483","0.008","9.94","0.008","90","","90","","90","","1130.5","1.6","296","","296","","","","","","","","","6","P n m a","-P 2ac 2n","62","N-Fluoroquinuclidinium Triflate","N-Fluoroquinuclidinium Trifluoromethanesulfonate","","- C8 H13 F4 N O3 S -","- C8 H13 F4 N O3 S -","- C32 H52 F16 N4 O12 S4 -","4","0.5","AL1049","Banks, R. E.; Pritchard, R. G.; Sharif, I.","<i>N</i>-Fluoroquinuclidinium trifluoromethanesulfonate (triflate): a novel electrophilic fluorinating agent","Acta Crystallographica Section C","1993","49","10","1806","1807","10.1107/S0108270193003646","","","0.71069","MoKα","","","0.0557","","","0.0718","","","","","2.692","2.692","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001348","15.233","0.0008","8.1208","0.0005","15.6685","0.0008","90","","93.132","0.004","90","","1935.36","0.19","296.15","","296.15","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","endo-(5S^*^,6S^*^,11R^*^,12R^*^)-5,6,11,12-Tetrahydro-5,6-dihydroxy-4,11,12- trimethoxy-9,13,13-trimethyl-6,10-methano-8(7H)-benzocyclodecenone","","- C21 H28 O6 -","- C21 H28 O6 -","- C84 H112 O24 -","4","1","AS1058","Kamei, S.; Sakai, Y.; Ohashi, Y.; Tsuruta, K.; Horiguchi, Y.; Kuwajima, I.","Structure of <i>endo</i>-(5<i>S</i>*,6<i>S</i>*,11<i>R</i>*,12<i>R</i>*)-5,6,11,12-tetrahydro-5,6-dihydroxy-4,11,12-trimethoxy-9,13,13-trimethyl-6,10-methano-8(7<i>H</i>)-benzocyclodecenone","Acta Crystallographica Section C","1993","49","10","1802","1804","10.1107/S0108270193003968","","","1.54178","CuKα","","","0.0523","","","0.0648","","","","","2.044","2.044","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001349","8.087","0.003","9.365","0.001","6.2","0.001","98.45","0.01","98.19","0.03","99.75","0.02","451","0.2","296","","296","","","","","","","","","3","P -1","-P 1","2","","(3R^*^,6S^*^)-3,6-Bis(methoxymethoxy)-2,2,7,7-tetramethyl-4-octene","","- C16 H32 O4 -","- C16 H32 O4 -","- C16 H32 O4 -","1","0.5","AS1056","Nemoto, T.; Ohashi, Y.; Arai, M.; Nakamura, E.","Structure of (3<i>R</i>*,6<i>S</i>*)-3,6-bis(methoxymethoxy)-2,2,7,7-tetramethyl-4-octene","Acta Crystallographica Section C","1993","49","10","1801","1802","10.1107/S0108270193003440","","","0.71069","MoKα","","","0.058","","","0.035","","","","","3.01","3.01","","","","","has coordinates","190526","2020-10-21","18:00:00",""
"2001350","13.436","0.002","7.001","0.002","20.698","0.003","90","","93.56","0.02","90","","1943.2","0.7","299","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C22 H26 O2 Si -","- C22 H26 O2 Si -","- C88 H104 O8 Si4 -","4","1","BR1034","Delord, T. J.; Fronczek, F. R.; Betancourt de Perez, R. M.; Larson, G. L.","Structure of an α-(methyldiphenylsilyl)-γ-lactone","Acta Crystallographica Section C","1993","49","10","1799","1801","10.1107/S010827019300263X","","","0.71073","MoKα","","","0.084","","","0.039","","","","","1.262","1.262","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001351","7.764","0.003","18.692","0.008","13.775","0.006","90","","100.05","0.03","90","","1968.4","1.4","243","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C34 H60 O14 S2 -","- C34 H57 O14 S2 -","- C68 H114 O28 S4 -","2","1","CD1024","Chênevert, R.; Gagnon, R.; Bélanger-Gariépy, F.","18-Crown-6‒bis(methyl 10-camphorsulfonate) (1/2)","Acta Crystallographica Section C","1993","49","10","1796","1799","10.1107/S0108270192012794","","","0.7093","MoKα","","","0.054","","","0.059","","","","","2.31","2.31","","","","","has coordinates,has disorder","206191","2020-10-21","18:00:00",""
"2001352","22.268","0.008","9.039","0.002","12.361","0.005","90","","100.27","0.03","90","","2448.2","1.4","294","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H20 P2 S4 -","- C24 H20 P2 S4 -","- C96 H80 P8 S16 -","4","0.5","CR1049","Gallacher, A. C.; Pinkerton, A. A.","Structures of the bis(diarylthiophosphoryl) disulfides [Ph~2~P(S)]~2~S~2~ and [(PhO)~2~P(S)]~2~S~2~ and the question of P‒S π bonding","Acta Crystallographica Section C","1993","49","10","1793","1796","10.1107/S010827019300366X","","","0.71073","MoKα","","","0.034","","","0.043","","","","","1.265","1.265","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2001353","6.618","0.001","11.584","0.002","34.533","0.004","90","","90","","90","","2647.4","0.7","294","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H20 O4 P2 S4 -","- C24 H20 O4 P2 S4 -","- C96 H80 O16 P8 S16 -","4","1","CR1049","Gallacher, A. C.; Pinkerton, A. A.","Structures of the bis(diarylthiophosphoryl) disulfides [Ph~2~P(S)]~2~S~2~ and [(PhO)~2~P(S)]~2~S~2~ and the question of P‒S π bonding","Acta Crystallographica Section C","1993","49","10","1793","1796","10.1107/S010827019300366X","","","0.71073","Mo-Kα","","","0.034","","","0.043","","","","","1.274","1.274","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001354","9.755","0.004","10.8","0.004","17.797","0.007","90","","90","","90","","1875","1.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H24 N2 O2 -","- C20 H24 N2 O2 -","- C80 H96 N8 O8 -","4","1","HH1061","Flippen-Anderson, J. L.; Zajac, W. W.; Buzby, J. H.; Walters, T. R.","Structure of 1-benzoyl-4,4,5,5-tetramethyl-2-phenylimidazoline hydrate","Acta Crystallographica Section C","1993","49","10","1792","1793","10.1107/S0108270193002276","","","0.71073","MoKα","","0.0574","0.044","","0.1377","0.1148","","","","1.118","1.111","1.111","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2001355","9.487","0.004","9.179","0.004","10.666","0.007","90","","90","","90","","928.8","0.8","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","Poldervaartite","- Ca2 H2 O5 Si -","- Ca2 O5 Si -","- Ca16 O40 Si8 -","8","2","OH0018","Yano, T.; Urabe, K.; Ikawa, H.; Teraushi, T.; Ishizawa, N.; Udagawa, S.","Structure of α-dicalcium silicate hydrate","Acta Crystallographica Section C","1993","49","9","1555","1559","10.1107/S0108270193004767","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:03",""
"2001356","7.127","0.004","7.127","0.004","7.127","0.004","90","","90","","90","","362","0.4","298","","","","","","","","","","","3","P 41 3 2","","","","","","- Ag3 Cu12 Y5 -","- Ag24 Cu144 Y40 -","- Ag24 Cu144 Y40 -","1","0.0416667","AL1043","Zeng, L.; Li, D.; Zhuang, Y.","Structure of Ag~3~Cu~12~Y~5~, a new ternary compound","Acta Crystallographica Section C","1993","49","9","1559","1561","10.1107/S0108270193003634","","","1.54178","CuKα","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001357","10.549","0.001","9.2465","0.0009","25.256","0.002","90","","101.42","0.01","90","","2414.7","0.4","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C16 H28 Cl2 Cu N6 O8 -","- C16 H28 Cl2 Cu N6 O8 -","- C64 H112 Cl8 Cu4 N24 O32 -","4","1","ST1040","Stibrany, R. T.; Potenza, J. A.; Schugar, H. J.","Isostructural trigonal-bipyramidal Cu^II^ and nominally 1% Cu^II^-doped Zn^II^ complexes with N~5~ ligation","Acta Crystallographica Section C","1993","49","9","1561","1564","10.1107/S0108270193004275","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001358","4.872","0.002","11.526","0.004","15.811","0.004","90","","90","","90","","887.9","0.5","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C13 H9 N -","- C13 H9 N -","- C52 H36 N4 -","4","1","SE1015","Brett, W. A.; Rademacher, P.; Boese, R.","Redetermination of the structure of phenanthridine","Acta Crystallographica Section C","1993","49","9","1564","1566","10.1107/S0108270193005062","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001359","22.386","0.004","22.386","0.004","13.8834","0.0007","90","","90","","90","","6957.4","1.8","","","","","","","","","","","","3","I 41/a","-I 4ad","","","","","- C10 H10 S2 -","- C10 H10 S2 -","- C320 H320 S64 -","32","","SE1016","Brett, W. A.; Rademacher, P.; Boese, R.","Structure of 1,3,6,8-tetrahydrodithieno[3,4-<i>a</i>:3',4'-<i>c</i>]benzene","Acta Crystallographica Section C","1993","49","9","1566","1568","10.1107/S0108270193005074","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001360","12.577","0.002","12.577","0.002","29.893","0.004","90","","90","","90","","4728.5","1.2","","","","","","","","","","","","4","P 43 21 2","P 41n 2abw","","","","","- C25 H31 N3 O6 -","- C25 H31 N3 O6 -","- C200 H248 N24 O48 -","8","1","HH1000","Wang, B.; Takusagawa, F.; Mertes, M. P.; Bowman-James, K.","Structure of the product from a novel cyclization reaction involving a C(6)-substituted uridine analog","Acta Crystallographica Section C","1993","49","9","1568","1571","10.1107/S0108270193004123","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001361","19.79","0.01","15.609","0.009","42.17","0.04","90","","92.63","0.06","90","","13013","16","298","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Sodium tetrastrontium decatungstoeuropate 34.5-hydrate 'W10 Eu Sr4 Na O70.5 H69'","","","- Eu H69 Na O70.5 Sr4 W10 -","- Eu Na O70.5 Sr4 W10 -","- Eu8 Na8 O564 Sr32 W80 -","8","1","AS1050","Yamase, T.; Ozeki, T.; Ueda, K.","Structure of NaSr~4~[EuW~10~O~36~].34.5H~2~O","Acta Crystallographica Section C","1993","49","9","1572","1574","10.1107/S0108270193002082","","","0.71069","MoKα","","","0.067","","","0.0589","","","","","1.77","1.77","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001362","29.894","0.005","16.072","0.003","11.446","0.003","90","","96.32","0.02","90","","5466","2","298","","290","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Tripotassium Tetrasodium Dihydrogen Decatungstosamarate 22 Hydrate","","","- H46 K3 Na4 O58 Sm W10 -","- K3 Na4 O58.0001 Sm W10 -","- K12 Na16 O232 Sm4 W40 -","4","1","AS1049","Ozeki, T.; Yamase, T.","Structure of K~3~Na~4~H~2~[SmW~10~O~36~].22H~2~O","Acta Crystallographica Section C","1993","49","9","1574","1577","10.1107/S0108270193002070","","","0.71069","MoKα","","","0.0528","","","0.0346","","","","","2.03","2.03","","","","","has coordinates","192027","2020-10-21","18:00:00",""
"2001363","29.92","0.005","16.103","0.005","11.449","0.003","90","","96.36","0.01","90","","5482","2","298.15","","298.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Tripotassium Tetrasodium Digydrogen Decatungstogadolinate 21 Hydrate","","","- Gd H44 K3 Na4 O57 W10 -","- Gd K3 Na4 O57 W10 -","- Gd4 K12 Na16 O228 W40 -","4","1","AS1055","Yamase, T.; Ozeki, T.","Structure of K~3~Na~4~H~2~[GdW~10~O~36~].21H~2~O","Acta Crystallographica Section C","1993","49","9","1577","1580","10.1107/S0108270193003300","","","0.71069","MoKα","","","0.0585","","","0.0519","","","","","2.152","2.152","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001364","10.176","0.001","9.1471","0.0005","22.91","0.003","90","","105.14","0.07","90","","2058.5","0.8","295","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- La5 Mo32 O54 -","- La5 Mo32 O54 -","- La10 Mo64 O108 -","2","0.5","DU1032","Gall, P.; Toupet, L.; Gougeon, P.","Structure of La~5~Mo~32~O~54~ containing <i>trans</i> bicapped Mo~8~ octahedral clusters and tricluster Mo~7~‒Mo~10~‒Mo~7~ chain fragments","Acta Crystallographica Section C","1993","49","9","1580","1584","10.1107/S0108270193001532","","","0.71073","MoKα","","","0.028","","","0.04","","","","","1.26","1.26","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001365","3.885","0.004","3.885","0.004","6.947","0.004","90","","90","","90","","104.85","0.16","113","","113","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","uranium oxyselenide","","- O Se U -","- O Se U -","- O2 Se2 U2 -","2","0.125","ST1058","Mansuetto, M. F.; Jobic, S.; Ng, H. P.; Ibers, J. A.","Structure of UOSe","Acta Crystallographica Section C","1993","49","9","1584","1585","10.1107/S0108270193002380","","","0.7093","MoKα","","0.0226","0.0215","","0.0491","0.0481","","","","1.079","1.094","1.094","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001366","8.2785","0.0002","8.2785","0.0002","8.2785","0.0002","90","","90","","90","","567.36","0.02","298","","","","","","","","","","","4","I m -3 m","-I 4 2 3","","","","","- Ba4 Na O12 Sb3 -","- Ba4 Na O12 Sb3 -","- Ba8 Na2 O24 Sb6 -","2","0.0208333","ST1048","Reis, K. P.; Jacobson, A. J.","Structure of Ba~4~NaSb~3~O~12~ by neutron powder diffraction","Acta Crystallographica Section C","1993","49","9","1585","1588","10.1107/S0108270193002379","","neutron","","NeutronTOF","","","7.25","","","10.63","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001367","8.598","0.002","8.598","0.002","7.312","0.003","90","","90","","90","","540.5","0.3","296","","","","","","","","","","","3","I 4/m c m","-I 4 2c","","","","","- In K Te2 -","- In K Te2 -","- In4 K4 Te8 -","4","0.125","ST1049","Hung, Y.-C.; Hwu, S.-J.","The KInTe~2~ structure revisited","Acta Crystallographica Section C","1993","49","9","1588","1589","10.1107/S0108270193003038","","","0.71069","MoKα","","","0.021","","","0.032","","","","","1.61","1.61","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001368","9.134","0.004","16.801","0.006","17.335","0.008","90","","99.15","0.03","90","","2626.4","1.9","293","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C12 H13 Cl2 Cu N2 O0.5 -","- C12 H13 Cl2 Cu N2 O0.5 -","- C96 H104 Cl16 Cu8 N16 O4 -","8","1","CD1026","González Q., O.; Atria, A. M.; Spodine, E.; Manzur, J.; Garland, M. T.","Structure of dimeric dichloro(4,4'-dimethyl-2,2'-bipyridine)copper(II) hemihydrate","Acta Crystallographica Section C","1993","49","9","1589","1591","10.1107/S0108270193001969","","","0.71073","MoKα","","","0.039","","","0.052","","","","","1.21","1.21","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001369","12.928","0.002","14.814","0.002","15.028","0.003","90","","90","","90","","2878.1","0.8","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H24 P S6 W -","- C26 H24 P S6 W -","- C104 H96 P4 S24 W4 -","4","1","AL1035","Burrow, T. E.; Morris, R. H.; Hills, A.; Hughes, D. L.; Richards, R. L.","Structure of dimethyl(phenyl)phosphonium tris(1,2-benzenedithiolato)tungsten(V)","Acta Crystallographica Section C","1993","49","9","1591","1594","10.1107/S0108270193001295","","","0.71069","MoKα","","","0.078","","","0.064","","","","","","","","","","","has coordinates","203417","2020-10-21","18:00:00",""
"2001370","14.7507","0.0006","14.7507","0.0006","19.373","0.001","90","","90","","120","","3650.5","0.3","298","","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C12 H36 Bi Cl6 N3 -","- C12 H36 Bi Cl6 N3 -","- C72 H216 Bi6 Cl36 N18 -","6","0.333333","SH1023","Jarraya, S.; Salah, A. B.; Daoud, A.; Rothammel, W.; Burzlaff, H.","Structure of [(C~2~H~5~)~2~NH~2~]~3~BiCl~6~","Acta Crystallographica Section C","1993","49","9","1594","1596","10.1107/S0108270193001283","","","0.70926","MoKα~1~","","","0.0177","","","0.0159","","","","","2.27","2.27","","","","","has coordinates","203907","2020-10-21","18:00:00",""
"2001371","16.32","0.001","9.153","0.001","8.649","0.001","90","","95.21","0.01","90","","1286.6","0.2","293","","","","","","","","","","","5","A 1 2/a 1","-A 2ya","","","","","- C6 H16 Cl2 Hg N4 -","- C6 H16 Cl2 Hg N4 -","- C24 H64 Cl8 Hg4 N16 -","4","0.5","SH1015","Zouari, R.; Salah, A. B.; Daoud, A.; Rothammel, W.; Burzlaff, H.","Structure of [NH~3~(C~2~H~5~)]~2~[Hg(CN)~2~Cl~2~]","Acta Crystallographica Section C","1993","49","9","1596","1598","10.1107/S0108270193002124","","","0.70926","MoKα~1~","","","0.039","","","0.0392","","","","","2.54","2.54","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001372","15.61","0.004","14.809","0.005","25.918","0.009","90","","92.34","0.02","90","","5986","3","130","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C60 H56 Cl2 N14 O10 Pt2 -","- C60 H56 Cl2 N14 O10 Pt2 -","- C240 H224 Cl8 N56 O40 Pt8 -","4","1","HH1046","Bailey, J. A.; Catalano, V. J.; Gray, H. B.","A monodentate 1,3-diphenyl-2-triazeno terpyridineplatinum(II) complex","Acta Crystallographica Section C","1993","49","9","1598","1602","10.1107/S0108270193002215","","","0.71073","MoKα","","","0.056","","","0.058","","","","","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001373","12.639","0.004","16.931","0.006","9.458","0.003","90","","90","","90","","2023.9","1.2","295","","25","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","chloro[(dimethylphenylphosphine)]gold(I)","","- C8 H11 Au Cl P -","- C8 H11 Au Cl P -","- C64 H88 Au8 Cl8 P8 -","8","2","AS1052","Cookson, P. D.; Tiekink, E. R. T.","Chloro(dimethylphenylphosphine)gold(I)","Acta Crystallographica Section C","1993","49","9","1602","1603","10.1107/S0108270193002707","","","0.71073","MoKα","","","0.035","","","0.039","","","","","2.38","2.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001374","8.9982","0.0006","9.1024","0.0007","16.774","0.0007","88.285","0.005","74.676","0.005","63.459","0.006","1179.19","0.15","296","","","","","","","","","","","6","P 1","P 1","1","","","","- C21 H27 Cl O4 P2 Pd -","- C21 H26.5 Cl O4 P2 Pd -","- C42 H53 Cl2 O8 P4 Pd2 -","2","2","HA1039","Manojlović-Muir, L.; Cross, R. J.; Hoyle, R. W.","Structure of (η^5^-cyclopentadienyl)bis(dimethylphenylphosphine)palladium(II) perchlorate","Acta Crystallographica Section C","1993","49","9","1603","1606","10.1107/S0108270193002604","","","0.71069","MoKα","","","0.0238","","","0.0312","","","","","1.63","1.63","","","","","has coordinates","278201","2022-09-27","00:27:37",""
"2001375","18.98","0.03","13.24","0.02","30.18","0.05","90","","90","","90","","7584","2","294","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C26 H56 Cl6 O5 Ti2 -","- C26 H56 Cl6 O5 Ti2 -","- C208 H448 Cl48 O40 Ti16 -","8","1","AB1051","Iiskola, E.; Pelkonen, A.; Kakkonen, H. J.; Ahlgrén, M.; Pakkanen, T. A.; Pursiainen, J.","Structure of μ-oxo-bis[trichloro(2,2-diisobutyl-1,3-dimethoxypropane-<i>O</i>,<i>O</i>')titanium(IV)]","Acta Crystallographica Section C","1993","49","9","1607","1609","10.1107/S0108270193002148","","","0.71073","MoKα","","","0.049","","","0.052","","","","","1.17","1.17","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001376","9.888","0.004","13.827","0.003","13.307","0.006","90","","107.31","0.04","90","","1737","1.2","294","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H25 Cl2 N2 Nb -","- C15 H25 Cl2 N2 Nb -","- C60 H100 Cl8 N8 Nb4 -","4","1","PA1029","Hubert-Pfalzgraf, L. G.; Zaki, A.; Toupet, L.","Niobium 1,4-diazabutadiene derivatives. Structure of (η^5^-Cp)NbCl~2~(^<i>t^</i>BuNCHCHN^<i>t^</i>Bu)","Acta Crystallographica Section C","1993","49","9","1609","1611","10.1107/S0108270193004494","","","0.71073","MoKα","","","0.03","","","0.028","","","","","1.2","1.2","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001377","7.139","0.001","7.907","0.001","20.199","0.002","90","","93.09","0.01","90","","1138.5","0.2","173","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H24 Cl4 Fe2 N2 O8 -","- C16 H24 Cl4 Fe2 N2 O8 -","- C32 H48 Cl8 Fe4 N4 O16 -","2","0.5","VS1005","Sabirov, V. Kh.; Porai-Koshitz, M. A.; Struchkov, Yu. T.","Structure of the dimeric complex of iron(III) chloride with pyridoxine","Acta Crystallographica Section C","1993","49","9","1611","1614","10.1107/S0108270193000691","","","0.71069","MoKα","","","0.0235","","","0.0257","","","","","0.93","0.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001378","9.222","0.008","22.62","0.01","18.138","0.006","90","","91.74","0.05","90","","3782","4","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H40 F6 Fe Ir P3 -","- C42 H40 F6 Fe Ir P3 -","- C168 H160 F24 Fe4 Ir4 P12 -","4","1","LI1043","Bedford, R. B.; Chaloner, P. A.; Hitchcock, P. B.","Structure of an iridium complex of 1,1'-bisdiphenylphosphinoferrocene","Acta Crystallographica Section C","1993","49","9","1614","1616","10.1107/S0108270193002288","","","0.71073","MoKα","","","0.055","","","0.072","","","","","2","2","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001379","11.3947","0.0009","12.653","0.001","16.872","0.001","90.639","0.007","107.891","0.006","114.817","0.007","2073.3","0.3","293","","","","","","","","","","","7","P -1","-P 1","2","","","","- C40 H44 Cl2 Co Fe P2 Si2 -","- C40 H44 Cl2 Co Fe P2 Si2 -","- C80 H88 Cl4 Co2 Fe2 P4 Si4 -","2","1","HU1021","Ahmet, M. T.; Brown, R. A.; Roberts, R. M. G.; Miller, J. R.; Silver, J.; Houlton, A.","Ferrocenyl ligands. Part 4. Structure of [1,1'-bis(diphenylphosphino)-3,3'-bis(trimethylsilyl)ferrocene]dichlorocobalt","Acta Crystallographica Section C","1993","49","9","1616","1619","10.1107/S0108270193001581","","","0.71069","MoKα","","","0.041","","","0.046","","","","","0.332","0.332","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001380","7.628","0.002","19.526","0.004","13.12","0.003","90","","97.45","0.02","90","","1937.7","0.8","197","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(μ^3^-butenato)-bis(μ^2^-butenato)-octacarbonylbis( trimethylammine)tetraruthenium","","- C30 H38 N2 O16 Ru4 -","- C36 H56 N2 O16 Ru4 -","- C72 H112 N4 O32 Ru8 -","2","0.5","ST1057","Reibenspies, J. H.; Fontal, B.; Darensbourg, D. J.","Structure of Ru~4~(CO)~8~(O~2~CCH~2~CH=CH~2~)~4~(NMe~3~)~2~","Acta Crystallographica Section C","1993","49","9","1619","1621","10.1107/S0108270193002483","","","0.71073","MoKα","","0.0779","0.0634","","0.0784","0.0622","","","","","2.5814","2.5814","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001381","20.088","0.009","13.895","0.004","17.751","0.012","90","","105.07","0.04","90","","4784","4","296","1","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C34 H62 Cu2 N4 S10 V2 -","- C42 H22 Cu2 N4 S10 V2 -","- C168 H88 Cu8 N16 S40 V8 -","4","0.5","AB1048","Yang, Y.; Liu, Q.","Structure of a V~2~Cu~2~S~4~ cubane-like cluster (Et~4~N)~2~[V~2~Cu~2~S~4~(S~2~CNMe~2~)~2~(SPh)~2~]","Acta Crystallographica Section C","1993","49","9","1623","1625","10.1107/S0108270193002173","","","0.71069","MoKα","","","0.067","","","0.074","","","","","1.33","1.33","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001382","7.851","0.002","15.851","0.003","26.854","0.003","90","","90","","90","","3341.9","1.1","293","","","","","","","","","","","6","P b c m","-P 2c 2b","","","μ-oxamidato-bis-[1,4,7-trimethyl-1,4,7-triazacyclononane copper(II)] (triiodide)(iodide)","","- C20 H44 Cu2 I4 N8 O2 -","- C20 H42 Cu2 I4 N6 O4 -","- C80 H168 Cu8 I16 N24 O16 -","4","0.5","SH1044","Flörke, U.; Haupt, H.-J.; Karpenstein, I.; Chaudhuri, P.","Ring cleavage of imidazole to oxamide by reaction with dioxygen in the presence of a Cu^I^‒amine complex. Structure of μ-oxamidato-bis[(1,4,7-trimethyl-1,4,7-triazacyclononane)copper(II)] triiodide iodide","Acta Crystallographica Section C","1993","49","9","1625","1627","10.1107/S0108270193002562","","","0.71073","MoKα","","","0.06","","","0.045","","","","","1.622","1.622","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001383","11.325","0.002","12.964","0.003","10.038","0.002","104.81","0.02","96.64","0.01","87.23","0.02","1415","0.5","293","","","","","","","","","","","5","P -1","-P 1","2","","2-(2,2-Bisdiphenylphosphino)ethylthio)phenylamine","","- C32 H29 N P2 S -","- C32 H29 N P2 S -","- C64 H58 N2 P4 S2 -","2","1","SE1019","Flörke, U.; Haupt, H.-J.","2-[2,2-Bis(diphenylphosphanyl)ethylsulfanyl]phenylamine (NSPP), a new hetero-bifunctional ligand and its PdCl~2~ complex","Acta Crystallographica Section C","1993","49","9","1627","1629","10.1107/S0108270193003233","","","0.71073","MoKα","","","0.052","","","0.049","","","","","2.019","2.019","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001384","18.299","0.004","10.832","0.003","18.452","0.003","90","0.01","117.02","0.01","90","0.01","3258.2","1.3","293","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","{2-[2,2-Bis(diphenylphosphino)ethylthio]phenylamine-P,P} dichloropalladium(II) Dichloromethane Solvate","","- C33 H30 Cl3 N P2 Pd S -","- C33 H31 Cl3 N P2 Pd S -","- C132 H124 Cl12 N4 P8 Pd4 S4 -","4","1","SE1019","Flörke, U.; Haupt, H.-J.","2-[2,2-Bis(diphenylphosphanyl)ethylsulfanyl]phenylamine (NSPP), a new hetero-bifunctional ligand and its PdCl~2~ complex","Acta Crystallographica Section C","1993","49","9","1627","1629","10.1107/S0108270193003233","","","0.71073","MoKα","","","0.043","","","0.048","","","","","1.838","1.838","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001385","7.659","0.002","11.158","0.002","6.559","0.002","96.58","0.02","98.18","0.03","87.8","0.02","551","0.2","293","","","","","","","","","","","5","P -1","-P 1","2","(Methyl viologen) bis(cis-1,2-dicyanoethene-1,2-dithiolato)palladate(II)","(N,N'-dimethyl-4,4'-bipyridinium)bis(cis-1,2-dicyan0ethene-1,2-di thiolato)palladate(II)","","- C20 H14 N6 Pd S4 -","- C20 H14 N6 Pd S4 -","- C20 H14 N6 Pd S4 -","1","0.5","SH1047","Lemke, M.; Knoch, F.; Kisch, H.","Structure of the ion-pair charge-transfer complex (methylviologen)^2+^[Pd(mnt)~2~]^2{‒^}","Acta Crystallographica Section C","1993","49","9","1630","1632","10.1107/S0108270193003129","","","0.71073","MoKα","","","0.0253","","","0.0294","","","","","1.77","1.77","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001386","12.519","0.002","14.286","0.001","14.607","0.002","90","","90","","90","","2612.4","0.6","294","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H35 N3 O5 -","- C31 H35 N3 O5 -","- C124 H140 N12 O20 -","4","1","AB1047","Pinkerton, A. A.; Carrupt, P.-A.; Claret, F.; Vogel, P.","The optical resolution of bicyclo[2.2.1]hept-5-ene-2-cyanohydrins using brucine ‒ a crystallographic and molecular-mechanics study","Acta Crystallographica Section C","1993","49","9","1632","1636","10.1107/S0108270193001180","","","0.71073","MoKα","","","0.036","","","0.043","","","","","1.189","1.189","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001387","12.378","0.002","14.088","0.002","14.582","0.003","90","","90","","90","","2542.8","0.8","294","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H33 N3 O6 -","- C30 H33 N3 O6 -","- C120 H132 N12 O24 -","4","1","AB1047","Pinkerton, A. A.; Carrupt, P.-A.; Claret, F.; Vogel, P.","The optical resolution of bicyclo[2.2.1]hept-5-ene-2-cyanohydrins using brucine ‒ a crystallographic and molecular-mechanics study","Acta Crystallographica Section C","1993","49","9","1632","1636","10.1107/S0108270193001180","","","0.71073","MoKα","","","0.036","","","0.043","","","","","1.195","1.195","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001388","10.359","0.005","10.861","0.005","9.947","0.004","91.89","0.03","99.97","0.04","89.65","0.04","1101.6","0.9","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H15 N O S -","- C11 H15 N O S -","- C44 H60 N4 O4 S4 -","4","2","HA1036","Soriano-García, M.; Cortés C., E.; Cortés R., E.; Avila Z., J. G.; Domínguez T., A.","Structure of 2,7,7-trimethyl-5,6,7,8-tetrahydro-4<i>H</i>-furo[3,2-<i>c</i>]azepine-4-thione","Acta Crystallographica Section C","1993","49","9","1637","1638","10.1107/S010827019300188X","","","1.5418","CuKα","","","0.065","","","0.088","","","","","1.06","1.06","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001389","22.566","0.005","7.3","0.001","13.532","0.004","90","","110.21","0.02","90","","2091.9","0.9","293","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","","","","","- C32 H20 N2 -","- C32 H20 N2 -","- C128 H80 N8 -","4","0.5","HH1026","Ammon, H. L.; Reid, T. L.","Structure of a 2-arylquinoline dimer, a compound with a new ring system","Acta Crystallographica Section C","1993","49","9","1638","1640","10.1107/S0108270193001374","","","1.5418","CuKα","","","0.044","","","0.061","","","","","1.63","1.63","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001390","13.484","0.003","22.325","0.003","6.987","0.001","90","","90","","90","","2103.3","0.6","293","","","","","","","","","","","4","P 21 21 2","P 2 2ab","","","","","- C10 H8 N2 O6 -","- C10 H8 N2 O6 -","- C80 H64 N16 O48 -","8","2","CR1046","Ammon, H. L.; Bashir-Hashemi, A.","Structure of 2-methoxycarbonyl-1,4-dinitrocubane","Acta Crystallographica Section C","1993","49","9","1641","1643","10.1107/S0108270193001489","","","1.5418","CuKα","","","0.05","","","0.066","","","","","1.5","1.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001391","16.45","0.002","9.781","0.002","17.818","0.002","90","","110.78","0.01","90","","2680.4","0.7","293","","","","","","","","","","","5","C 1 c 1","C -2yc","","","","","- C24 H27 N4 O7 P3 -","- C26 H39 N4 O7 P3 -","- C104 H156 N16 O28 P12 -","4","1","SH1027","Engelhardt, U.; Stromburg, B.","Phosphor(V)-Hydrazin-Sauerstoff-Achtring mit Boot-Sessel-Konformation","Acta Crystallographica Section C","1993","49","9","1643","1646","10.1107/S0108270193001271","","","0.71069","MoKα","","","0.044","","","0.023","","","","","1.58","1.58","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001392","15.158","0.004","8.435","0.002","7.277","0.001","90","","103.52","0.01","90","","904.6","0.3","138","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C9 H13 N O3 -","- C9 H13 N O3 -","- C36 H52 N4 O12 -","4","1","CD1028","Xiao, G.; van der Helm, D.; Goerlitz, F. H.; Hider, R. C.; Dobbin, P. S.","Structures of 3-hydroxy-1-(2-methoxyethyl)-2-methyl-4-pyridinone, its hydrochloride and 1-ethyl-3-hydroxy-2-methyl-4-pyridinone hydrochloride hydrate","Acta Crystallographica Section C","1993","49","9","1646","1649","10.1107/S0108270193001313","","","1.54178","CuKα","","","0.036","","","0.047","","","","","1.8","1.8","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001393","11.865","0.003","12.174","0.004","7.127","0.002","90","","90","","90","","1029.5","0.5","138","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C9 H14 Cl N O3 -","- C9 H14 Cl N O3 -","- C36 H56 Cl4 N4 O12 -","4","1","CD1028","Xiao, G.; van der Helm, D.; Goerlitz, F. H.; Hider, R. C.; Dobbin, P. S.","Structures of 3-hydroxy-1-(2-methoxyethyl)-2-methyl-4-pyridinone, its hydrochloride and 1-ethyl-3-hydroxy-2-methyl-4-pyridinone hydrochloride hydrate","Acta Crystallographica Section C","1993","49","9","1646","1649","10.1107/S0108270193001313","","","0.71073","MoKα","","","0.033","","","0.039","","","","","1.41","1.41","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001394","6.6361","0.0004","17.115","0.001","9.1024","0.0005","90","","98.473","0.005","90","","1022.54","0.1","138","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H14 Cl N O3 -","- C8 H14 Cl N O3 -","- C32 H56 Cl4 N4 O12 -","4","1","CD1028","Xiao, G.; van der Helm, D.; Goerlitz, F. H.; Hider, R. C.; Dobbin, P. S.","Structures of 3-hydroxy-1-(2-methoxyethyl)-2-methyl-4-pyridinone, its hydrochloride and 1-ethyl-3-hydroxy-2-methyl-4-pyridinone hydrochloride hydrate","Acta Crystallographica Section C","1993","49","9","1646","1649","10.1107/S0108270193001313","","","1.54178","CuKα","","","0.035","","","0.047","","","","","1.77","1.77","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2001395","11.268","0.002","11.996","0.001","12.297","0.001","90","","102.204","0.009","90","","1624.6","0.3","296","1","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H33 N5 O12 -","- C28 N5 O12 -","- C56 N10 O24 -","2","1","HU1028","Beddoes, R. L.; Russell, J. R.; Garner, C. D.; Joule, J. A.","Structure of a 6-tetrahydroxybutyl-substituted 5,6,7,8-tetrahydropteridine","Acta Crystallographica Section C","1993","49","9","1649","1652","10.1107/S0108270193001593","","","1.54178","CuKα","","","0.058","","","0.071","","","","","2.48","2.48","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001396","15.531","0.004","18.136","0.006","16.895","0.004","90","","114.67","0.02","90","","4324","2","150","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","","","","","- C17 H36 F3 N O3 S -","- C17.5 H38.5 F3 N O3 S -","- C140 H308 F24 N8 O24 S8 -","8","2","HA1038","Blake, A. J.; Radek, C.; Schröder, M.","Tetra(<i>n</i>-butyl)ammonium trifluoromethanesulfonate","Acta Crystallographica Section C","1993","49","9","1652","1654","10.1107/S0108270193001544","","","0.71073","MoKα","","","0.0557","","","0.0661","","","","","1.342","1.342","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001397","12.42","0.002","11.18","0.001","11.979","0.001","90","","110.91","0.01","90","","1553.8","0.3","153","1","153","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(+/-)-1-beta-tert.-Butoxy-3a-alpha,4-beta,5,6,7,7a-hexahydro-7a-beta- methyl-5-oxo-4-alpha-indane carboxylic acid methylester","","- C16 H26 O4 -","- C16 H26 O4 -","- C64 H104 O16 -","4","1","SE1022","Pohl, E.; Herbst-Irmer, R.; Sheldrick, G. M.; van Hommelen, S.; Groth, U.","Structure of (±)-1β-<i>tert</i>-butoxy-3aα,4β,5,6,7,7a-hexahydro-7aβ-methyl-5-oxo-4α-indancarboxylic acid methyl ester at 153 K","Acta Crystallographica Section C","1993","49","9","1654","1655","10.1107/S0108270193001684","","","0.71073","MoKα","","0.0658","0.0434","","0.1131","0.0975","","","","1.024","1.047","1.047","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001398","12.337","0.004","12.888","0.006","9.677","0.007","90","","90","","90","","1538.6","1.4","296","","296","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-Amino-1-Propylammonium Perchlorate","","- C3 H11 Cl N2 O4 -","- C3 H12 Cl N2 O4 -","- C24 H96 Cl8 N16 O32 -","8","1","LI1052","Aurangzeb, N.; McAuliffe, C. A.; Pritchard, R. G.; Watkinson, M.; Garcia-Deibe, A.; Sousa, A.; Bermejo, M. R.","3-Amino-1-propylammonium perchlorate: an extensively hydrogen-bonded system","Acta Crystallographica Section C","1993","49","9","1656","1657","10.1107/S010827019300277X","","","0.71069","MoKα","","","0.039","","","0.0523","","","","","2.077","2.077","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001399","12.664","0.001","9.424","0.001","12.883","0.001","90","","107.53","0.01","90","","1466.1","0.2","291","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 O2 -","- C18 H24 O2 -","- C72 H96 O8 -","4","1","LI1046","Iulek, J.; Zukerman-Schpector, J.; Brocksom, T. J.; Silva, Jnr, F.","Structures of the Diels–Alder reaction products of thymoquinone and 1-vinylcyclohexene. I. 2-Isopropyl-5-methyltricyclo[8.4.0.0^2,7^]tetradeca-4,9-diene-3,6-dione","Acta Crystallographica Section C","1993","49","9","1657","1659","10.1107/S010827019300229X","","","0.71073","MoKα","","","0.055","","","0.059","","","","","1.16","1.16","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001400","6.465","0.003","20.72","0.007","13.717","0.004","90","","95.61","0.02","90","","1828.7","1.2","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,5-Dihydro-3-(4,7-dihydro-1,3-dioxepin-2-yl)-8-methyl-3H-[1,3]- -dioxepino[5,6-c]pyridinium-9-ol maleate","","- C18 H21 N O9 -","- C18 H21 N O9 -","- C72 H84 N4 O36 -","4","1","KA1031","Vinković, M.; Dumić, M.; Kamenar, B.","1,5-Dihydro-3-(4,7-dihydro-1,3-dioxepin-2-yl)-8-methyl-3<i>H</i>-[1,3]dioxepino[5,6-<i>c</i>]pyridinium-9-ol maleate","Acta Crystallographica Section C","1993","49","9","1659","1661","10.1107/S0108270193002422","","","0.71069","MoKα","","","0.057","","","0.061","","","","","2.139","2.139","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001401","9.074","0.005","5.452","0.004","17.31","0.009","90","","91.17","0.04","90","","856.2","0.9","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Methanesulfonyl-1a,2,6,6a-tetrahydro-1H,4H-[1,3]-dioxepino[5,6-b]azirine","","- C6 H11 N O4 S -","- C6 H11 N O4 S -","- C24 H44 N4 O16 S4 -","4","1","KA1030","Vinković, M.; Dumić, M.; Kamenar, B.","1-Methanesulfonyl-1a,2,6,6a-tetrahydro-1<i>H</i>,4<i>H</i>-[1,3]dioxepino[5,6-<i>b</i>]azirine","Acta Crystallographica Section C","1993","49","9","1661","1663","10.1107/S0108270193002185","","","0.71069","MoKα","","","0.042","","","0.062","","","","","0.5189","0.5189","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001402","8.242","0.004","13.423","0.008","9.935","0.007","90","","107.99","0.05","90","","1045.4","1.1","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","2R,S~s~-1-(1-Benzyloxycarbonyl-2-methylprop-1-enyl)-2-benzylaminosulfinyl-4- -oxoazetidine","","- C22 H24 N2 O4 S -","- C22 H24 N2 O4 S -","- C44 H48 N4 O8 S2 -","2","1","KA1032","Vinković, M.; Herak, J. J.; Kamenar, B.","Benzyl 2-[(2<i>R</i>,S<i>S</i>)-2-(benzylaminosulfinyl)-4-oxoazetidin-1-yl]-3-methylbut-2-enoate","Acta Crystallographica Section C","1993","49","9","1663","1665","10.1107/S0108270193002616","","","0.71069","MoKα","","","0.034","","","0.057","","","","","0.9569","0.9569","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001403","7.736","0.008","12.591","0.004","20.196","0.007","90","","95.08","0.06","90","","1959","2","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 Cl N O6 -","- C20 H24 Cl N O6 -","- C80 H96 Cl4 N4 O24 -","4","1","CD1033","Ghosh, R.; Mukherjee, K.; Roychowdhury, P.; Klayman, D. L.","Structure of an antimalarial alkaloid, jatrorrhizine","Acta Crystallographica Section C","1993","49","9","1665","1667","10.1107/S0108270193002458","","","0.7135","MoKα","","","0.057","","","0.065","","","","","1.2","1.2","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001404","15.776","0.013","8.646","0.003","14.087","0.005","90","","96.05","0.05","90","","1910.8","1.8","293","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C44 H26 Cl4 N4 -","- C44 H26 Cl4 N4 -","- C88 H52 Cl8 N8 -","2","0.5","AB1038","Hökelek, T.; Ülkü, D.; Gündüz, N.; Hayvali, M.; Kiliç, Z.","5,10,15,20-Tetrakis(<i>p</i>-chlorophenyl)porphyrin","Acta Crystallographica Section C","1993","49","9","1667","1670","10.1107/S0108270193000782","","","1.5418","CuKα","","","0.07","","","0.088","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001405","17.231","0.009","9.955","0.006","7.611","0.003","90","","113.7","0.5","90","","1195","5","293","","","","","","","","","","","4","C 1 c 1","C -2yc","","","","","- C9 H14 N6 S -","- C9 H14 N6 S -","- C36 H56 N24 S4 -","4","1","DU1035","Cousson, A.; Nectoux, F.; Bachet, B.; Kokel, B.; Hubert-Habart, M.","Structure of 5-[1-(diaminomethylenehydrazono)ethyl]-4-methyl-2-methylthiopyrimidine","Acta Crystallographica Section C","1993","49","9","1670","1673","10.1107/S0108270193002367","","","1.5418","CuKα","","","0.0384","","","0.0364","","","","","0.93","0.93","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001406","5.052","0.004","11.95","0.009","18.985","0.007","90","","94.88","0.05","90","","1142","1.3","172","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H30 N6 O9 -","- C21 H30 N6 O9 -","- C42 H60 N12 O18 -","2","1","GR1004","Görbitz, C. H.; Etter, M. C.","Structure of a 1:1 complex between <small>L</small>-Asp-<small>L</small>-Phe and <small>L</small>-His-Gly","Acta Crystallographica Section C","1993","49","9","1673","1676","10.1107/S010827019300246X","","","0.71069","MoKα","","","0.046","","","0.051","","","","","1.14","1.14","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001407","9.036","0.001","10.094","0.001","7.8868","0.0009","94.11","0.01","98.84","0.01","116.556","0.008","627.74","0.13","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C9 H16 N3 O5 P -","- C9 H16 N3 O5 P -","- C18 H32 N6 O10 P2 -","2","1","OH1009","Okabe, N.; Fukuda, H.; Nakamura, T.","Structure of iproniazid phosphate","Acta Crystallographica Section C","1993","49","9","1677","1678","10.1107/S010827019300304X","","","0.71069","MoKα","","","0.039","","","0.046","","","","","1.55","1.55","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001408","4.819","0.003","11.625","0.004","14.268","0.004","90","","97.04","0.04","90","","793.3","0.6","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 N8 O8 -","- C6 H6 N4 O4 -","- C24 H24 N16 O16 -","4","1","AS1037","Okabe, N.; Nakamura, T.; Fukuda, H.","Structure of 2,4-dinitrophenylhydrazine","Acta Crystallographica Section C","1993","49","9","1678","1680","10.1107/S0108270193002550","","","0.71069","MoKα","","","0.04","","","0.043","","","","","1.16","1.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001409","15.87","0.001","8.061","0.001","14.879","0.001","90","","112.46","0.01","90","","1759.1","0.3","297","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","(1R^*^,6aS^*^,14aS^*^,14bR^*^,13E)-6a,14c-Epoxy-1,14a-dimethyl- 1,2,6,6a,7,8,9,10,11,12-decahydro-14aH-3-oxa cyclobuta[a]furo[2,3,4-b,c]cyclopentadecene-4,5-dione","","- C20 H26 O4 -","- C20 H26 O4 -","- C80 H104 O16 -","4","1","AS1054","Yamaguchi, K.; Takeda, K.; Shimotani, A.; Yoshii, E.","Cyclobutane structures fused to a 13-membered ring","Acta Crystallographica Section C","1993","49","9","1680","1683","10.1107/S0108270193002677","","","1.5405","CuKα~1~","","","0.0485","","","0.0478","","","","","1.493","1.493","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2001410","28.875","0.004","6.82","0.002","19.572","0.002","90","","108.56","0.01","90","","3653.8","1.3","297","","","","","","","","","","","3","A 1 2/a 1","","","","(1R^*^,6aR^*^,14aR^*^,14bS^*^,13E)-6a,14c-epoxy-1,14a-dimethyl- 1,2,6,6a,7,8,9,10,11,12-decahydro-14aH-3-oxa cyclobuta[a]furo[2,3,4-b,c]cyclopentadecene-4,5-dione","","- C20 H26 O4 -","- C20 H26 O4 -","- C160 H208 O32 -","8","1","AS1054","Yamaguchi, K.; Takeda, K.; Shimotani, A.; Yoshii, E.","Cyclobutane structures fused to a 13-membered ring","Acta Crystallographica Section C","1993","49","9","1680","1683","10.1107/S0108270193002677","","","1.5405","CuKα~1~","","","0.0683","","","0.061","","","","","1.995","1.995","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001411","6.4939","0.0003","11.8032","0.0003","35.0205","0.0015","90","","90","","90","","2684.28","0.18","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Methyl 17β-benzoyloxy-14β-hydroxy-3β-methylethynyl-1,7-dioxo- 5β-androstan-19-oate","","- C30 H36 O7 -","- C30 H36 O7 -","- C120 H144 O28 -","4","1","CD1040","Michel, A. G.; Drouin, M.","Non-natural 14-hydroxy steroids. III. (±)-Methyl 17β-benzoyloxy-14β-hydroxy-3β-isopropenyl-1,7-dioxo-5β-androstan-19-oate","Acta Crystallographica Section C","1993","49","9","1683","1685","10.1107/S0108270193002744","","","0.7093","MoKα","","0.103","0.072","","0.066","0.064","","","","","2.59","2.59","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001412","9.0995","0.0006","13.0675","0.0007","16.3219","0.0007","90","","90","","90","","1940.8","0.18","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3-Epiryanodol","3-Epiryanodol","","- C20 H32 O8 -","- C20 H32 O8 -","- C80 H128 O32 -","4","1","CD1044","Michel, A. G.; Drouin, M.","Structure of 3-epiryanodol: a heptahydro diterpene","Acta Crystallographica Section C","1993","49","9","1685","1688","10.1107/S0108270193002987","","","0.7093","MoKα","","0.046","0.034","","0.03","0.029","","","","","1.44","1.44","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001413","29.817","0.012","17.001","0.007","7.279","0.005","90","","90","","90","","3690","3","293","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C21 H25 N O4 -","- C21 H25 N O4 -","- C168 H200 N8 O32 -","8","1","KA1026","Ribár, B.; Lazar, D.; Gašić, O.; Kanyó, I.; Simonov, Y. A.; Kravtsov, V. Kh.","Structure of (±)-tetrahydropalmatine","Acta Crystallographica Section C","1993","49","9","1691","1693","10.1107/S0108270193002410","","","1.54178","CuKα","","","0.061","","","0.07","","","","","3.85","3.85","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001414","14.619","0.005","14.587","0.008","12.024","0.004","90","","108.66","0.03","90","","2429.3","1.8","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ethyl 3-(5-amino-4-cyano-1-imidazolylamino)but-2-enoate","","- C10 H13 N5 O2 -","- C10 H13 N5 O2 -","- C80 H104 N40 O16 -","8","1","AL1047","Booth, B. L.; Pritchard, R. G.; Freitas, A. P.; Proença, M. F. J. R. P.","Ethyl 3-(5-amino-4-cyano-1-imidazolyl-amino)-2-butenoate: an example of a combined inter- and intramolecular bifurcated hydrogen bond","Acta Crystallographica Section C","1993","49","9","1695","1696","10.1107/S0108270193002938","","","0.71069","MoKα","","","0.0376","","","0.041","","","","","1.448","1.448","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001415","10.368","0.002","15.595","0.003","7.47","0.002","101.65","0.01","97.74","0.02","78.94","0.02","1155.2","0.5","296","","296","","","","","","","","","3","P -1","-P 1","2","","1,3,5-Triacetyltriphenylbenzene","","- C30 H24 O3 -","- C30 H24 O3 -","- C60 H48 O6 -","2","1","AL1046","Booth, B. L.; Pritchard, R. G.; Taylor-Gomes, J.","1,3,5-Triacetyl-2,4,6-triphenylbenzene: a sterically hindered molecule","Acta Crystallographica Section C","1993","49","9","1696","1698","10.1107/S0108270193002902","","","0.71069","MoKα","","","0.0473","","","0.0495","","","","","1.688","1.688","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001416","14.24","0.01","9.767","0.007","16.59","0.01","90","","113.74","0.06","90","","2112","3","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-{2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]-ethyl}- 6,7,8,9-tetrahydro-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one","","- C23 H27 F N4 O2 -","- C23 H27 F N4 O2 -","- C92 H108 F4 N16 O8 -","4","1","NA1034","Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","Structure of 3-{2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)piperidino]ethyl}-6,7,8,9-tetrahydro-2-methyl-4<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidin-4-one (risperidone)","Acta Crystallographica Section C","1993","49","9","1698","1700","10.1107/S0108270193002240","","","0.71069","MoKα","","0.105","0.0475","","0.0702","0.0635","","","","","1.53","1.53","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001417","13.216","0.002","7.98","0.002","10.97","0.002","90","","102.39","0.01","90","","1130","0.4","288","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H25 N3 O10 -","- C21 H25 N3 O10 -","- C42 H50 N6 O20 -","2","1","OH1015","Ogawa, T.; Matsumoto, K.; Hatayama, K.; Kitamura, K.","Structure of a 4-phenyl-1,4-dihydropyridine derivative containing a nitrooxyalkyl ester at the 3-position","Acta Crystallographica Section C","1993","49","9","1700","1702","10.1107/S0108270193002690","","","1.54178","CuKα","","","0.035","","","0.045","","","","","4.7","4.7","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001418","5.549","0.0001","10.4774","0.0002","3.8796","0.0001","90","","90","","90","","225.556","0.008","","","","","","","","","","","","3","P b a m","-P 2 2ab","","","","","- Cu2 La2 O5 -","- Cu2 La2 O5 -","- Cu4 La4 O10 -","2","0.25","BR1018","La Placa, S. J.; Bringley, J. F.; Scott, B. A.; Cox, D. E.","Structure of La~2~Cu~2~O~5~ by high-resolution synchrotron X-ray powder diffraction","Acta Crystallographica Section C","1993","49","8","1415","1417","10.1107/S0108270193001891","","","1.2","","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001419","12.58","0.002","26.262","0.005","11.34","0.004","90","","108.11","0.02","90","","3560.9","1.6","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C48 H68 Cl2 N8 O38 V10 -","- C48 H8 Cl2 N8 O38 V10 -","- C96 H16 Cl4 N16 O76 V20 -","2","0.5","AB1007","Arrieta, J. M.; Arnaiz, A. R.; Santiago, C.; Lorente, L.; Zúñiga, F. J.; Madariaga, G.; Germain, G.; Vlassi, M.","Structure of hexakis(3-methylpyridinium) decavanadate bis(3-methylpyridinium perchlorate) dihydrate","Acta Crystallographica Section C","1993","49","8","1417","1421","10.1107/S0108270193001362","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001420","14.6703","0.0008","9.4136","0.0005","13.4665","0.0008","90","","90","","90","","1859.73","0.18","","","","","","","","","","","","5","P n a 21","P 2c -2n","","","","","- C12 H16 Cu I2 N8 -","- C12 H16 Cu I2 N8 -","- C48 H64 Cu4 I8 N32 -","4","1","HH1017","Ballester, J.; Parker, O. J.; Breneman, G. L.","Structure of tetrakis(imidazole)copper(II) diiodide","Acta Crystallographica Section C","1993","49","8","1421","1424","10.1107/S0108270193004329","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001421","22.168","0.005","13.266","0.002","24.33","0.006","90","","105.17","0.02","90","","6906","3","","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","","","","","- C64 H66 Ce Cl2 Co N6 O17 P2 -","- C64 H66 Ce Cl2 Co N6 O17 P2 -","- C256 H264 Ce4 Cl8 Co4 N24 O68 P8 -","4","1","AB1036","Collins, T. J.; Workman, J. M.","Structure of tetraphenylphosphonium μ-{[η^4^-2,4-bis(2-hydroxy-2-methylpropanamido)-2,4-dimethyl-3-oxopentane]cobalt(III)}tetranitratocerium(III) dichloromethane","Acta Crystallographica Section C","1993","49","8","1426","1428","10.1107/S0108270193002161","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","194476","2020-10-21","18:00:00",""
"2001422","31.535","0.008","14.313","0.005","9.4461","0.0003","90","","90","","90","","4263.6","1.8","","","","","","","","","","","","4","F d d 2","F 2 -2d","","","","","- C7 H9 N3 O7 -","- C7 H9 N3 O7 -","- C112 H144 N48 O112 -","16","1","HL1001","Boyd, M.; Atwell, G. J.; Denny, W. A.","Structure of 3-methoxycarbonyl-1-methyl-4-nitropyrazole-5-carboxylic acid monohydrate","Acta Crystallographica Section C","1993","49","8","1429","1430","10.1107/S0108270193003488","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001423","9.0405","0.0016","9.1893","0.0015","10.6043","0.0019","93.285","0.014","106.558","0.013","101.73","0.013","820.5","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H12 O6 Si -","- C18 H12 O6 Si -","- C36 H24 O12 Si2 -","2","1","CR1023","Ziller, J. W.; Schaber, P. M.; Dinan, F. J.","Structure of 5,5'-dimethylsilanediyldi(phthalic anhydride): a model system for aromatic polyimides","Acta Crystallographica Section C","1993","49","8","1430","1432","10.1107/S010827019300472X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001424","9.755","0.005","12.849","0.009","10.42","0.008","90","","104.16","0.04","90","","1266.4","1.5","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 N O4 -","- C13 H13 N O4 -","- C52 H52 N4 O16 -","4","1","MU1043","He, Y.; Shi, J.; Su, G.","Structure of ethyl 2-cyano-3-(3-hydroxy-4-methoxyphenyl)propenoate","Acta Crystallographica Section C","1993","49","8","1432","1434","10.1107/S0108270193003580","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001425","25.05","0.03","6.203","0.002","15.89","0.02","90","","109.6","0.1","90","","2326","4","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C28 H20 N2 O2 S2 -","- C28 H20 N2 O2 S2 -","- C112 H80 N8 O8 S8 -","4","1","MU1033","Fawcett, J.; Kemmitt, R. D. W.; Russell, D. R.; Serindag, O.; Gok, Y.","Structure of <i>o</i>,<i>o</i>'-bis(1-oxo-2,3-dihydro-1<i>H</i>-2-benzopyrrol-2-yl)diphenyl disulfide","Acta Crystallographica Section C","1993","49","8","1434","1436","10.1107/S0108270193003385","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001426","7.8723","0.0005","7.8723","0.0005","5.499","0.001","90","","90","","120","","295.13","0.06","296","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Br H6 Li O7 -","- Br H6 Li O7 -","- Br2 H12 Li2 O14 -","2","0.166667","CR1039","Blackburn, A. C.; Gallucci, J. C.; Gerkin, R. E.; Reppart, W. J.","Structure of lithium perbromate trihydrate","Acta Crystallographica Section C","1993","49","8","1437","1439","10.1107/S0108270193000538","","","0.71073","MoKα","","","0.037","","","0.057","","","","","2.55","2.55","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001427","5.6218","0.0009","8.0058","0.0007","11.9924","0.0016","80.643","0.009","89.16","0.012","89.75","0.01","532.5","0.12","296","","","","","","","","","","","4","P -1","-P 1","2","","","","- Br2 Ca H8 O12 -","- Br2 Ca H8 O12 -","- Br4 Ca2 H16 O24 -","2","1","CR1042","Blackburn, A. C.; Gerkin, R. E.","Structure of tetraaquacalcium perbromate","Acta Crystallographica Section C","1993","49","8","1439","1442","10.1107/S0108270193001714","","","0.71073","MoKα","","","0.021","","","0.027","","","","","1.18","1.18","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001428","13.173","0.006","10.101","0.007","8.734","0.004","90","","90","","90","","1162.2","1.1","130","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Sb3 Sr5 -","- Sb3 Sr5 -","- Sb12 Sr20 -","4","0.5","ST1034","Rehr, A.; Kauzlarich, S. M.","A new modification of Sr~5~Sb~3~","Acta Crystallographica Section C","1993","49","8","1442","1444","10.1107/S0108270192013362","","","0.71073","MoKα","","","0.0373","","","0.032","","","","","1.17","1.17","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001429","8.164","0.001","4.468","0.001","8.977","0.001","90","","124.16","0.01","90","","270.96","0.08","295","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- Ag2 Te -","- Ag2 Te -","- Ag8 Te4 -","4","1","HA1058","van der Lee, A.; de Boer, J. L.","Redetermination of the structure of hessite, Ag~2~Te-III","Acta Crystallographica Section C","1993","49","8","1444","1446","10.1107/S0108270193003294","","","0.71073","Mo","","","0.057","","","0.042","","","","","6.979","6.979","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001430","22.334","0.002","22.334","0.002","22.334","0.002","90","","90","","90","","11140.4","1.7","299","","","","","","","","","","","5","F m -3 m","-F 4 2 3","","","","","- H38 Mo12 Na3 O59 V -","- Mo12 Na3 O59 V -","- Mo96 Na24 O472 V8 -","8","0.0416667","HA1022","Zhang, S. W.; Huang, G. Q.; Wei, Y. G.; Shao, M. C.; Tang, Y. Q.","Structure of Na~3~[VMo~12~O~40~].19H~2~O","Acta Crystallographica Section C","1993","49","8","1446","1448","10.1107/S0108270193003257","","","0.71073","MoKα","","","0.0547","","","0.0556","","","","","26.65","26.65","","","","","has coordinates","282085","2023-03-28","12:49:24",""
"2001431","10.337","0.006","10.337","0.006","10.337","0.006","90","","90","","90","","1104.5","1.1","293","","","","","","","","","","","3","F d -3 m","-F 4vw 2vw 3","","","","","- Cr2 Cu Se4 -","- Cr2 Cu Se4 -","- Cr16 Cu8 Se32 -","8","","SH1039","Okońska-Kozlowska, I.; Kopyczok, J.; Lutz, H. D.; Stingl, T.","Single-crystal structure refinement of spinel-type CuCr~2~Se~4~","Acta Crystallographica Section C","1993","49","8","1448","1449","10.1107/S0108270193001945","","","0.7093","MoKα","","","0.027","","","0.033","","","","","0.91","0.91","","","","","has coordinates","282538","2023-04-10","16:55:39",""
"2001432","10.897","0.001","7.427","0.001","9.516","0.001","90","","112.88","0.01","90","","709.55","0.15","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","bis[(S)-prolinamidato]copper(II) dihydrate","","- C10 H22 Cu N4 O4 -","- C10 H22 Cu N4 O4 -","- C20 H44 Cu2 N8 O8 -","2","1","AL1038","Gasparri Fava, G.; Belicchi Ferrari, M.; Pelosi, G.; De Munari, E.; Corradini, R.; Marchelli, R.; Dossena, A.","Structure of bis[(<i>S</i>)-prolinamidato]copper(II) dihydrate","Acta Crystallographica Section C","1993","49","8","1449","1452","10.1107/S0108270193001179","","","1.54178","CuKα","","","0.043","","","0.048","","","","","1.09","1.09","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001433","15.945","0.004","9.845","0.003","8.912","0.003","90","","90","","90","","1399","0.7","298","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H18 N2 Na2 O10 -","- C10 H18 N2 Na2 O10 -","- C40 H72 N8 Na8 O40 -","4","0.5","AL1024","Font-Bardia, M.; Solans, X.; Font-Altaba, M.","Sodium ion complexes with ethylenediaminetetraacetic acid","Acta Crystallographica Section C","1993","49","8","1452","1456","10.1107/S0108270193001350","","","0.71069","MoKα","","","0.063","","","0.066","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2001434","13.326","0.004","9.353","0.003","8.478","0.003","99.71","0.03","115.41","0.03","92.34","0.03","933.1","0.6","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H22 N2 Na4 O13 -","- C10 H21 N2 Na4 O13 -","- C20 H42 N4 Na8 O26 -","2","1","AL1024","Font-Bardia, M.; Solans, X.; Font-Altaba, M.","Sodium ion complexes with ethylenediaminetetraacetic acid","Acta Crystallographica Section C","1993","49","8","1452","1456","10.1107/S0108270193001350","","","0.71069","MoKα","","","0.063","","","0.063","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001435","15.582","0.007","10.816","0.005","19.701","0.01","90","","108.99","0.04","90","","3140","3","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C32 H30 Cl4 P2 Ru -","- C32 H30 Cl4 P2 Ru -","- C128 H120 Cl16 P8 Ru4 -","4","1","HH1036","Suravajjala, S.; Porter, L. C.","Structure of [1,2-bis(diphenylphosphino)ethane]chloro(η^5^-cyclopentadienyl)ruthenium(II)","Acta Crystallographica Section C","1993","49","8","1456","1458","10.1107/S0108270193001386","","","0.71073","MoKα","","","4.82","","","7.5","","","","","0.79","0.79","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001436","23.125","0.007","9.131","0.002","19.36","0.005","90","","91.01","0.03","90","","4087.3","1.9","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C13 H2 O13 Ru4 -","- C13 O13 Ru4 -","- C104 O104 Ru32 -","8","2","ST1022","Rheingold, A. L.","A new polymorph of tetraruthenium tridecacarbonyl dihydride","Acta Crystallographica Section C","1993","49","8","1458","1461","10.1107/S0108270193000101","","","0.71073","MoKα","","","0.056","","","0.0635","","","","","1.44","1.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001437","16.609","0.003","13.662","0.005","17.28","0.004","90","","101.32","0.02","90","","3844.8","1.8","295","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C37 H44 F6 Ir N O6 P2 -","- C37 H44 F9 Ir N O6 P2 -","- C148 H176 F36 Ir4 N4 O24 P8 -","4","1","HA1031","Bedford, R. B.; Chaloner, P. A.; Hitchcock, P. B.","Structure of an iridium(I) complex of tris(2,6-dimethoxyphenyl)phosphine, [Ir(C~8~H~12~)(C~5~H~5~N)(P{2,6-(CH~3~O)~2~C~6~H~3~}~3~)][PF~6~]","Acta Crystallographica Section C","1993","49","8","1461","1463","10.1107/S0108270193000253","","","0.71069","MoKα","","","0.045","","","0.047","","","","","1.2","1.2","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001438","10.792","0.002","11.369","0.003","13.943","0.003","86.64","0.03","95.24","0.03","101.91","0.03","1665.5","0.7","295","1","","","","","","","","","","6","P -1","-P 1","2","","","","- C73 H62 Cl4 N12 O7 Yb2 -","- C73 H62 Cl4 N12 O7 Yb2 -","- C73 H62 Cl4 N12 O7 Yb2 -","1","0.5","NA1028","Benetollo, F.; Bombieri, G.; Grillone, M. D.","Structure of [Yb(OH)(C~12~H~8~N~2~)~2~(H~2~O)~2~]~2~Cl~4~.2C~12~H~8~N~2~.CH~3~OH","Acta Crystallographica Section C","1993","49","8","1463","1465","10.1107/S0108270193001131","","","0.71069","MoKα","","","0.0158","","","0.0173","","","","","1.13","1.13","","","","","has coordinates","190829","2020-10-21","18:00:00",""
"2001439","14.484","0.002","8.48","0.001","13.087","0.001","90","","114.753","0.007","90","","1459.7","0.3","293","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C12 H10 Mn N4 O10 -","- C12 H10 Mn N4 O10 -","- C48 H40 Mn4 N16 O40 -","4","0.5","DU1014","Nepveu, F.; Berkaoui, M. 'H.; Walz, L.","Structure of bis(hydronium) bis(pyrazine-2,3-dicarboxylato)manganate, a polymeric Mn^II^ complex","Acta Crystallographica Section C","1993","49","8","1465","1466","10.1107/S0108270193003324","","","0.71073","MoKα","","","0.0332","","","0.0242","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001440","12.184","0.005","12.616","0.004","15.243","0.004","99.07","0.02","91.12","0.03","112.24","0.03","2133.6","1.3","298","","298","","","","","","","","","5","P -1","-P 1","2","","μ-1,2-Bis(dicyclohexylphosphino)ethane]- bis[1,2-bis(dicyclohexylphosphino)ethanegold(I)] Bis(dicyanoaurate)","","- C82 H144 Au4 N4 P6 -","- C82 H144 Au4 N4 P6 -","- C82 H144 Au4 N4 P6 -","1","0.5","HH1004","McCleskey, T. M.; Henling, L. M.; Flanagan, K. A.; Gray, H. B.","Structure of μ-1,2-bis(dicyclohexylphosphino)ethane-bis{[1,2-bis(dicyclohexylphosphino)ethane]gold(I)} bis(dicyanoaurate)","Acta Crystallographica Section C","1993","49","8","1467","1469","10.1107/S0108270193000599","","","0.71073","MoKα","","0.0424","0.0424","","0.0045","0.0045","","","","1.45","1.45","1.45","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001441","15.595","0.003","24.39","0.005","11.868","0.004","104.07","0.02","74.05","0.02","95.35","0.01","4208.4","1.9","120","","","","","","","","","","","5","P -1","-P 1","2","","","","- C106 H90 Cu2 N2 O8 -","- C106 Cu2 N2 O8 -","- C212 Cu4 N4 O16 -","2","1","AS1031","Yamanaka, M.; Ohba, S.; Tokii, T.; Jury, C. F.; Steward, O. W.; Kato, M.","Dimeric copper(II) triphenylacetate adducts with 4-picoline","Acta Crystallographica Section C","1993","49","8","1469","1473","10.1107/S010827019300126X","","","0.71073","MoKα","","","0.078","","","0.079","","","","","2.2","2.2","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001442","15.569","0.002","24.619","0.004","12.005","0.003","103.75","0.02","73.62","0.01","95.94","0.01","4284.9","1.5","290","","","","","","","","","","","5","P -1","-P 1","2","","","","- C104 H86 Cu2 N2 O8 -","- C104 Cu2 N2 O8 -","- C208 Cu4 N4 O16 -","2","1","AS1031","Yamanaka, M.; Ohba, S.; Tokii, T.; Jury, C. F.; Steward, O. W.; Kato, M.","Dimeric copper(II) triphenylacetate adducts with 4-picoline","Acta Crystallographica Section C","1993","49","8","1469","1473","10.1107/S010827019300126X","","","0.71073","MoKα","","","0.091","","","0.079","","","","","1.99","1.99","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001443","8.2306","0.001","22.4835","0.0019","13.5614","0.0013","90","","97.906","0.009","90","","2485.7","0.4","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Chloro(trimesitylphosphine)gold(I)","Chloro(trimesitylphosphine)gold(I)","","- C27 H33 Au Cl P -","- C27 H33 Au Cl P -","- C108 H132 Au4 Cl4 P4 -","4","1","AB1050","Alyea, E. C.; Ferguson, G.; Gallagher, J. F.; Malito, J.","Chloro(trimesitylphosphine)gold(I)","Acta Crystallographica Section C","1993","49","8","1473","1476","10.1107/S0108270192012757","","","0.7093","MolybdenumKα","","0.077","0.032","","0.039","0.032","","","","","1.13","1.13","","","","","has coordinates","191032","2020-10-21","18:00:00",""
"2001444","17.792","0.018","16.491","0.018","24.28","0.04","90","","94.01","0.1","90","","7107","16","293","","","","","","","","","","","7","C 1 c 1","C -2yc","","","","","- C40 H27 Cu2 N9 O0.5 S0.9 Se1.1 -","- C40 Cu2 N10 O0.5 Se2 -","- C320 Cu16 N80 O4 Se16 -","8","2","KA1017","Dunaj-Jurčo, M.; Kabešová, M.; Kettmann, V.; Císařová, I.; Mikloš, D.","Structure of a mixed-valence copper complex with 1,10-phenanthroline and pseudohalogenide ligands","Acta Crystallographica Section C","1993","49","8","1476","1479","10.1107/S0108270193000745","","","0.71069","MoKα","","","0.065","","","0.056","","","","","2.16","2.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001445","11.483","0.015","12.066","0.015","15.586","0.008","107.32","0.1","107.11","0.09","106.79","0.09","1795","4","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C39 H34 Cu2 N9 O5 -","- C39 H34 Cu2 N9 O5 -","- C78 H68 Cu4 N18 O10 -","2","1","KA1018","Dunaj-Jurčo, M.; Potočňák, I.; Cíbik, J.; Kabešová, M.; Kettmann, V.; Mikloš, D.","Mixed-valence Cu^I^–Cu^II^ complexes. Structure of cyanobis(1,10-phenanthroline)copper(II) bis(cyano)(1,10-phenanthroline)cuprate(I) pentahydrate","Acta Crystallographica Section C","1993","49","8","1479","1482","10.1107/S0108270193001775","","","0.71069","MoKα","","","0.058","","","0.051","","","","","1.61","1.61","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001446","13.239","0.001","13.239","0.001","18.4","0.002","90","","90","","90","","3225","0.5","293","1","133","1","","","","","","","","5","P -4 21 c","P -4 2n","114","Di-sodium-hexasulfido-bis(pentamethyldiethylendiamine)","","","- C18 H46 N6 Na2 S6 -","- C18 H46 N6 Na2 S6 -","- C72 H184 N24 Na8 S24 -","4","0.5","HL1023","Besser, S.; Herbst-Irmer, R.; Stalke, D.; Brooker, A. T.; Snaith, R.; Wright, D. S.","Structure of bis(pentamethyldiethylenetriamine)disodium hexasulfide","Acta Crystallographica Section C","1993","49","8","1482","1483","10.1107/S0108270193001167","","","0.71073","MoKα","","0.033","0.0269","","0.0616","0.057","","","","1.08","1.057","1.057","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001447","23.586","0.008","12.584","0.002","14.54","0.005","90","","93.83","0.03","90","","4306","2","293","","","","","","","","","","","8","C 1 2/c 1","-C 2yc","","","","","- C36 H54 Cl2 Hg N2 O8 P2 Ru2 -","- C36 H54 Cl2 Hg N2 O8 P2 Ru2 -","- C144 H216 Cl8 Hg4 N8 O32 P8 Ru8 -","4","0.5","HU1035","García-Granda, S.; Van der Maelen Uría, J. F.; Cabeza, J. A.; Fernández-Colinas, J. M.; Riera, V.","Structure of μ-[bis(chloroacetato-<i>O</i>)-mercury(II)-κ^2^<i>Hg</i>]-μ-[1,8-naphthalenediamino-κ^2^<i>NN</i>':κ^2^<i>NN</i>']-bis[<i>cis</i>-dicarbonyl(triisopropylphosphine-<i>P</i>)ruthenium(I)](<i>Ru</i>‒<i>Ru</i>)","Acta Crystallographica Section C","1993","49","8","1483","1485","10.1107/S010827019300160X","","","0.71073","MoKα","","","0.033","","","0.034","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001448","9.917","0.003","10.309","0.002","18.695","0.01","90","","99.17","0.03","90","","1886.8","1.2","300","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H22 Cl2 N4 Ni O12 -","- C8 H22 Cl2 N4 Ni O12 -","- C32 H88 Cl8 N16 Ni4 O48 -","4","1","LI1039","Lee, T.-J.; Wang, A.; Chi, T.-Y.; Chung, C.-S.","Structure of diaqua(4,7-diazadecanediamide-<i>N</i>^4^,<i>N</i>^7^,<i>O</i>,<i>O</i>')nickel(II) perchlorate","Acta Crystallographica Section C","1993","49","8","1485","1487","10.1107/S0108270193001246","","","0.71073","MoKα","","","0.0552","","","0.0556","","","","","1.78","1.78","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001449","10.76","0.003","6.763","0.003","23.722","0.006","90","","93.05","0.02","90","","1723.8","1","295","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C24 H8 Cu2 F24 N2 O8 -","- C24 H8 Cu2 F24 N2 O8 -","- C48 H16 Cu4 F48 N4 O16 -","2","0.5","HH1035","Romero, R. R.; Porter, L. C.","Structure of μ-pyrazine-bis[bis(hexafluoroacetylacetonato)copper(II)]","Acta Crystallographica Section C","1993","49","8","1487","1489","10.1107/S0108270193001854","","","0.71073","MoKα","","","0.0745","","","0.0591","","","","","0.96","0.96","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001450","10.799","0.003","10.676","0.005","19.894","0.004","90","","97.13","0.02","90","","2275.8","1.3","294","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H36 K N O Si -","- C19 H36 K N O Si -","- C76 H144 K4 N4 O4 Si4 -","4","1","HH1051","Schaefer, W. P.; Cotter, W. D.; Bercaw, J. E.","The monopotassium salt of the ligand of a Ziegler–Natta catalyst","Acta Crystallographica Section C","1993","49","8","1489","1492","10.1107/S0108270193001842","","","0.71073","MoKα","","","0.064","","","0.013","","","","","3.36","3.36","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001451","9.938","0.002","8.579","0.003","14.783","0.003","90","","93.53","0.02","90","","1258","0.6","297","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H28 O6 P4 Re2 -","- C8 H14 O3 P2 Re -","- C16 H28 O6 P4 Re2 -","2","1","HH1037","Tyler, D. R.; Weakley, T. J. R.","A second crystal form of bis-μ-[bis(dimethylphosphino)methane]-bis(tricarbonylrhenium)(<i>Re</i>‒<i>Re</i>), Re~2~(dmpm)~2~(CO)~6~","Acta Crystallographica Section C","1993","49","8","1492","1493","10.1107/S0108270193001696","","","0.71069","MoKα","","","0.031","","","0.038","","","","","1.55","1.55","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001452","10.538","0.003","19.21","0.004","8.686","0.002","90","","101.56","0.04","90","","1722.7","0.8","298","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C12 H12 As Cl3 F6 Ru2 -","- C12 H12 As Cl3 F6 Ru2 -","- C48 H48 As4 Cl12 F24 Ru8 -","4","1","ST1045","McCormick, F. B.; Gleason, W. B.","Structure of tri-μ-chloro-bis[(η^6^-benzene)ruthenium(II)] hexafluoroarsenate","Acta Crystallographica Section C","1993","49","8","1493","1496","10.1107/S0108270193001490","","","0.71073","MoKα","","","0.041","","","0.052","","","","","2.15","2.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001453","26.119","0.009","4.989","0.002","11.91","0.007","90","","106.29","0.04","90","","1489.7","1.2","293","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H12 Cl2 O6 Zn -","- C7 H6 Cl O3 Zn0.5 -","- C28 H24 Cl4 O12 Zn2 -","4","1","KA1020","Potočňák, I.; Dunaj-Jurčo, M.; Černák, J.","Structure of diaquabis(4-chlorobenzoato)zinc(II)","Acta Crystallographica Section C","1993","49","8","1496","1498","10.1107/S0108270193001398","","","0.71069","MoKα","","","0.04","","","0.0409","","","","","0.363","0.363","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001454","24.375","0.009","9.791","0.006","16.127","0.006","90","","115.66","0.03","90","","3469","3","293","","","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C36 H30 Cl I2 O P2 Re -","- C18 H15 Cl0.5 I O0.5 P Re0.5 -","- C72 H60 Cl2 I4 O2 P4 Re2 -","4","1","CD1027","Rossi, S.; Bélanger, S.; Lebuis, A.-M.; Beauchamp, A. L.","Structure of (<i>OC</i>-6-14)-chlorodiiodooxobis(triphenylphosphine)rhenium(V)","Acta Crystallographica Section C","1993","49","8","1498","1500","10.1107/S0108270193001441","","","0.71069","MoKα","","","0.038","","","0.048","","","","","1.2","1.2","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001455","7.3138","0.0005","10.6101","0.0006","21.2238","0.0011","90","","94.443","0.005","90","","1642.02","0.17","293","","293","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","rel(1S,2R,4R,6S,9S,10R,11S)-4-methoxycarbonyl-1-methyl-tricyclo [7.4.0.0^2,6^]tridec-7-ene-10,11-diol-4,2-carbolactone monohydrate","","- C17 H24 O7 -","- C17 H24 O7 -","- C68 H96 O28 -","4","1","CD1039","Michel, A. G.; Drouin, M.","Functionalized hydrocarbons with condensed ring skeletons. XIII. A substituted 1-methyltricyclo[7.4.0.0^2,6^]tridec-7-ene","Acta Crystallographica Section C","1993","49","8","1500","1502","10.1107/S0108270193001726","","","0.7093","MolybdenumKα","","0.073","0.04","","0.037","0.033","","","","","1.62","1.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001456","8.906","0.003","9.826","0.003","28.039","0.008","90","","90","","90","","2453.7","1.3","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C27 H30 Br N O2 -","- C27 H30 Br N O2 -","- C108 H120 Br4 N4 O8 -","4","1","HA0113","Barlow, R. B.; Howard, J. A. K.; Batsanov, A. S.; O'Shea, D.; Rathbone, D. L.","Structures of <i>N</i>-benzyl- and <i>N</i>-cyclohexylmethyl-4-(diphenylacetoxy)piperidines","Acta Crystallographica Section C","1993","49","8","1502","1507","10.1107/S0108270193000174","","","0.71069","MoKα","","","0.078","","","0.068","","","","","1.49","1.49","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001457","7.052","0.002","12.159","0.001","13.858","0.003","94.12","0.01","90.96","0.02","94.06","0.02","1181.9","0.4","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 Br N O2 -","- C26 H28 Br N O2 -","- C52 H56 Br2 N2 O4 -","2","1","HA0113","Barlow, R. B.; Howard, J. A. K.; Batsanov, A. S.; O'Shea, D.; Rathbone, D. L.","Structures of <i>N</i>-benzyl- and <i>N</i>-cyclohexylmethyl-4-(diphenylacetoxy)piperidines","Acta Crystallographica Section C","1993","49","8","1502","1507","10.1107/S0108270193000174","","","0.71069","MoKα","","","0.031","","","0.04","","","","","1","1","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001458","5.833","0.003","35.11","0.02","11.828","0.006","90","","101.31","0.04","90","","2375","2","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H34 Cl N O2 -","- C30 H23 Cl N O2 -","- C120 H92 Cl4 N4 O8 -","4","1","HA0113","Barlow, R. B.; Howard, J. A. K.; Batsanov, A. S.; O'Shea, D.; Rathbone, D. L.","Structures of <i>N</i>-benzyl- and <i>N</i>-cyclohexylmethyl-4-(diphenylacetoxy)piperidines","Acta Crystallographica Section C","1993","49","8","1502","1507","10.1107/S0108270193000174","","","0.71069","MoKα","","","0.078","","","0.09","","","","","2.61","2.61","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001459","7.6958","0.0004","9.4503","0.0006","19.4832","0.0008","90","","90","","90","","1416.97","0.13","300","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C10 H12 I N O6 S -","- C10 H12 I N O6 S -","- C40 H48 I4 N4 O24 S4 -","4","1","ST1041","Sun, G.; Fronczek, F. R.; Gandour, R. D.","(<i>R</i>)-2-Hydroxy-3-iodo-2-methylpropyl 4-nitrobenzenesulfonate","Acta Crystallographica Section C","1993","49","8","1507","1509","10.1107/S0108270193000344","","","0.71073","MoKα","","","0.032","","","0.04","","","","","2.139","2.139","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001460","10.159","0.002","13.533","0.005","10.016","0.003","108.1","0.02","102.92","0.02","96.3","0.02","1251.6","0.7","296.15","","296.15","","","","","","","","","4","P 1","P 1","1","","(1S,3S)-3-acetyl-5-methoxy-3-methylthio-1,2,3,4- tetrahydronaphthalene-1,8-diyl di(benzoate)","","- C28 H26 O6 S -","- C28 H26 O6 S -","- C56 H52 O12 S2 -","2","2","AS1040","Kamei, S.; Sakai, Y.; Ohashi, Y.; Adachi, A.; Tanino, K.; Kuwajima, I.","Structure of an optically active anthracycline precursor","Acta Crystallographica Section C","1993","49","8","1509","1511","10.1107/S0108270193000988","","","1.54184","CuKα","","","0.0425","","","0.0556","","","","","2.45","2.45","","","","","has coordinates","190526","2020-10-21","18:00:00",""
"2001461","25.126","0.004","18.96","0.002","11.014","0.002","90","","94.22","0.01","90","","5232.7","1.4","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","α-phenyl-4'-bis(4-methylphenyl)-amino-stilbene","","- C34 H29 N -","- C34 H29 N -","- C272 H232 N8 -","8","2","AS1045","Chiba, E.","Structures of α-phenyl-amino-stilbene derivatives","Acta Crystallographica Section C","1993","49","8","1511","1514","10.1107/S0108270193002057","","","1.5418","CuKα","","0.079","0.079","","0.076","0.076","","","","2.29","2.29","2.29","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"2001462","21.595","0.005","10.311","0.003","11.206","0.001","90","","97.44","0.03","90","","2474.2","1","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","α-phenyl-N-phenyl-N-(4-methoxyphenyl)-4'-amino-stilbene","","- C33 H27 N O -","- C33 H27 N O -","- C132 H108 N4 O4 -","4","1","AS1045","Chiba, E.","Structures of α-phenyl-amino-stilbene derivatives","Acta Crystallographica Section C","1993","49","8","1511","1514","10.1107/S0108270193002057","","","1.5418","CuKα","","0.053","0.053","","0.047","0.047","","","","1.19","1.19","1.19","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001463","11.015","0.003","12.87","0.001","10.575","0.001","90","","94.78","0.01","90","","1493.9","0.4","297","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,4,5,8,9,10-hexamethyl-1,2,5,8-dithiadiazecine-6,7(5H,8H)- dione","","- C12 H18 N2 O2 S2 -","- C12 H18 N2 O2 S2 -","- C48 H72 N8 O8 S8 -","4","1","AS1048","Yamaguchi, K.; Itoh, T.; Nagata, K.; Okada, M.; Ohsawa, A.","Two novel ten-membered ring compounds: 1,2,5,8-dithiadiazecine-6,7-diones","Acta Crystallographica Section C","1993","49","8","1514","1517","10.1107/S010827019300099X","","","1.5405","CuKα~1~","","","0.0396","","","0.0464","","","","","1.458","1.458","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001464","10.344","0.003","11.27","0.003","12.361","0.004","102.63","0.03","106.08","0.03","115.82","0.02","1146.5","0.8","293","1","173","1","","","","","","","","2","P -1","-P 1","2","","15,16-Bis(dispiro[2.0.2.1]hept-7-ylidene)hexaspiro[2.0.2.0.0.0. 2.0.2.0.2.0]hexadecane","","- C30 H32 -","- C30 H32 -","- C60 H64 -","2","1","HU1043","Yufit, D. S.; Struchkov, Yu. T.; Kozhushkov, S. I.; De Meijere, A.","15,16-Bis(dispiro[2.0.2.1]hept-7-ylidene)hexaspiro[2.0.2.0.0.0.2.0.2.0.2.0]hexadecane, C~30~H~32~","Acta Crystallographica Section C","1993","49","8","1517","1519","10.1107/S0108270193000472","","","0.71073","MoKα","","0.0703","0.0489","","0.1435","0.1142","","","","0.99","0.954","0.954","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2001465","18.456","0.002","24.097","0.003","7.54","0.001","90","","91.8","0.1","90","","3351.6","0.7","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C20 H22 N2 O -","- C20 H22 N2 O -","- C160 H176 N16 O8 -","8","2","LI1040","Priya, V.; Shamala, N.; Viswamitra, M. A.; Ravindran, T.; Jeyaraman, R.","Structure of <i>N</i>-nitroso-2,4-diphenyl-3-azabicyclo[3.3.1]nonane","Acta Crystallographica Section C","1993","49","8","1519","1522","10.1107/S0108270193001258","","","1.5418","CuKα","","","0.045","","","0.045","","","","","1.362","1.362","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001466","12.491","0.008","11.85","0.004","8.068","0.003","90","","103.41","0.05","90","","1161.7","1","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","dibenzoylmethane","1,3-diphenyl-1,3-propanedione","","- C15 H12 O2 -","- C15 H12 O2 -","- C60 H48 O8 -","4","1","KA1028","Kaitner, B.; Meštrović, E.","Structure of a new crystal modification of 1,3-diphenyl-1,3-propanedione","Acta Crystallographica Section C","1993","49","8","1523","1525","10.1107/S0108270193001787","","","0.7093","MoKα","","","0.042","","","0.045","","","","","0.967","0.967","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001467","4.8238","0.0015","7.51","0.002","11.915","0.004","84.37","0.02","80.74","0.02","78.18","0.02","416","0.2","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C7 H6.5 Cl0.5 N2 O2 -","- C14 H13 Cl N4 O6 -","- C14 H13 Cl N4 O6 -","1","0.5","GR1005","Horan, C. J.; Haney, P. E.; Barnes, C. L.; Glaser, R.","Symmetrically H-bridged dimer of 2-carboxylatobenzenediazonium. The 1:1 complex between 2-carboxybenzenediazonium chloride and benzenediazonium-2-carboxylate","Acta Crystallographica Section C","1993","49","8","1525","1528","10.1107/S0108270193001040","","","0.71073","Mo","","","0.058","","","0.075","","","","","1.84","1.84","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001468","10.922","0.003","18.858","0.005","11.701","0.004","90","","104.6","0.03","90","","2332.2","1.2","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H32 N2 O5 -","- C21 H32 N2 O5 -","- C84 H128 N8 O20 -","4","2","AS1034","Doi, M.; In, Y.; Ikuma, K.; Inoue, M.; Ishida, T.","Structure of Boc-Phe-<small>D</small>-Leu-OMe","Acta Crystallographica Section C","1993","49","8","1528","1530","10.1107/S0108270193002045","","","1.5418","CuKα","","","0.053","","","0.057","","","","","1.505","1.505","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001469","29.807","0.01","9.469","0.002","11.515","0.002","90","","90","","90","","3250","1.4","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C28 H46 N4 O8 -","- C28 H46 N4 O8 -","- C112 H184 N16 O32 -","4","1","AS1046","Doi, M.; In, Y.; Tanaka, M.; Inoue, M.; Ishida, T.","Structure of Boc-Phe-<small>D</small>-Leu-Thr-OMe","Acta Crystallographica Section C","1993","49","8","1530","1532","10.1107/S0108270193002069","","","1.5418","CuKα","","","0.058","","","0.065","","","","","0.804","0.804","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001470","15.722","0.003","3.906","0.001","21.969","0.004","90","","99.44","0.02","90","","1330.8","0.5","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H13 N O -","- C19 H13 N O -","- C76 H52 N4 O4 -","4","1","LI1036","Yip, B.-C.; Fun, H.-K.; Teoh, S.-G.; Shawkataly, O. B.","Structure of 2-(1-naphthyl)-5-phenyl-1,3-oxazole (α-NPO)","Acta Crystallographica Section C","1993","49","8","1532","1534","10.1107/S0108270193001192","","","0.71069","MoKα","","","0.0382","","","0.0338","","","","","1.09","1.09","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001471","6.421","0.002","6.658","0.004","13.758","0.005","85.53","0.03","99.7","0.03","117.54","0.03","514.1","0.4","296","","","","","","","","","","","3","P -1","-P 1","2","","","","- C13 H18 O2 -","- C13 H18 O2 -","- C26 H36 O4 -","2","1","HH1010","Lloyd, B. A.; Arif, A. M.; Allred, E. L.; Sharp, T. R.","A twisted pentacyclic diol derivative","Acta Crystallographica Section C","1993","49","8","1534","1536","10.1107/S0108270193001222","","","0.71073","MoKα","","","0.0531","","","0.054","","","","","0.5522","0.5522","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001472","8.804","0.003","6.472","0.002","29.075","0.012","90","","94.75","0.02","90","","1651","1","153","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C17 H21 Cl N2 O2 -","- C17 H21 Cl N2 O2 -","- C68 H84 Cl4 N8 O8 -","4","1","VS1003","Igonin, V. A.; Lindeman, S. V.; Struchkov, Yu. T.; Huipe-Nave, E.; Mendoza, V.","Structure of 3-(3,5-dimethylpiperidino)-<i>N</i>-(<i>p</i>-chlorophenyl)succinimide","Acta Crystallographica Section C","1993","49","8","1536","1537","10.1107/S0108270193001908","","","0.71073","MoKα","","","0.052","","","0.064","","","","","2.16","2.16","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001473","10.3739","0.0005","12.0037","0.0006","17.3827","0.0009","81.416","0.004","78.567","0.004","78.379","0.004","2064.62","0.18","293","","293","","","","","","","","","4","P -1","-P 1","2","Tetrakis[(2-pyridylmethyl)oxy]calix[4]arene","25,26,27,28-Tetrakis[(2-pyridylmethyl)oxy]calix[4]arene","","- C52 H44 N4 O4 -","- C52 H44 N4 O4 -","- C104 H88 N8 O8 -","2","1","AB1052","Ferguson, G.; Gallagher, J. F.; Pappalardo, S.","Structure of the partial cone conformer of 25,26,27,28-tetrakis[(2-pyridylmethyl)oxy]calix[4]arene","Acta Crystallographica Section C","1993","49","8","1537","1540","10.1107/S0108270193000897","","","0.7093","MoKα","","0.169","0.053","","0.069","0.054","","","","","1.3","1.3","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001474","8.6406","0.0008","17.151","0.001","14.542","0.001","90","","106.106","0.008","90","","2070.5","0.3","298","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H28 N4 O2 S -","- C20 H28 N4 O2 S -","- C80 H112 N16 O8 S4 -","4","1","OH1005","Fujii, I.; Hirayama, N.; Miike, A.","Structure of 3,7-bis(dimethylamino)-10-(<i>N</i>-methylcarbamoyl)phenothiazine(MCDP)–ethanol (1/1)","Acta Crystallographica Section C","1993","49","8","1540","1541","10.1107/S0108270193001866","","","1.54184","CuKα","","","0.06","","","0.082","","","","","2.87","2.87","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001475","27.699","0.003","27.699","0.003","6.169","0.001","90","","90","","90","","4733.1","1.1","297","","","","","","","","","","","3","I 41/a","-I 4ad","88","","5,5',6,6'-tetraphenyl-3,3'-bi-1,2,4-triazine","","- C30 H20 N6 -","- C30 H20 N6 -","- C240 H160 N48 -","8","","SE1020","Breu, J.; Range, K.-J.","Structure of 5,5',6,6'-tetraphenyl-3,3'-bi-1,2,4-triazine","Acta Crystallographica Section C","1993","49","8","1541","1543","10.1107/S0108270193001556","","","1.54185","CuKα","","","0.066","","","0.034","","","","","","","","","","","has coordinates","203843","2020-10-21","18:00:00",""
"2001476","9.7659","0.0006","21.6128","0.0013","11.104","0.0007","90","","110.56","0.01","90","","2194.4","0.3","295","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C56 H44 As2 N4 -","- C56 H44 As2 N4 -","- C112 H88 As4 N8 -","2","0.5","CD1008","Aquino, M. A. S.; Crutchley, R. J.; Lee, F. L.; Gabe, E. J.; Bensimon, C.","Structure of 1,4-benzenedicyanamide dianion derivatives","Acta Crystallographica Section C","1993","49","8","1543","1547","10.1107/S0108270193001428","","","0.7093","MoKα","","","0.04","","","0.034","","","","","1.29","1.29","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001477","9.886","0.0014","16.416","0.005","14.909","0.003","90","","99.391","0.017","90","","2387.1","0.9","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C58 H48 As2 N4 -","- C58 H48 As2 N4 -","- C116 H96 As4 N8 -","2","0.5","CD1008","Aquino, M. A. S.; Crutchley, R. J.; Lee, F. L.; Gabe, E. J.; Bensimon, C.","Structure of 1,4-benzenedicyanamide dianion derivatives","Acta Crystallographica Section C","1993","49","8","1543","1547","10.1107/S0108270193001428","","","0.7093","MoKα","","","0.072","","","0.051","","","","","3.63","3.63","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001478","9.867","0.002","18.3696","0.0019","13.1791","0.0011","90","","102.875","0.014","90","","2328.7","0.6","295","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H42 As2 Cl2 N4 -","- C56 H42 As2 Cl2 N4 -","- C112 H84 As4 Cl4 N8 -","2","0.5","CD1008","Aquino, M. A. S.; Crutchley, R. J.; Lee, F. L.; Gabe, E. J.; Bensimon, C.","Structure of 1,4-benzenedicyanamide dianion derivatives","Acta Crystallographica Section C","1993","49","8","1543","1547","10.1107/S0108270193001428","","","0.7093","MoKα","","","0.026","","","0.02","","","","","4.02","4.02","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001479","10.0609","0.001","10.259","0.0011","12.0028","0.001","101.936","0.011","103.436","0.008","90.783","0.01","1176.4","0.2","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C56 H40 As2 Cl4 N4 -","- C14 H10 As0.5 Cl N -","- C56 H40 As2 Cl4 N4 -","4","2","CD1008","Aquino, M. A. S.; Crutchley, R. J.; Lee, F. L.; Gabe, E. J.; Bensimon, C.","Structure of 1,4-benzenedicyanamide dianion derivatives","Acta Crystallographica Section C","1993","49","8","1543","1547","10.1107/S0108270193001428","","","0.7093","MoKα","","","0.048","","","0.029","","","","","1.974","1.974","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001480","26.304","0.011","12.639","0.006","16.825","0.006","90","","116.68","0.03","90","","4998","4","298","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C25 H41 N2 O2 P -","- C25 H41 N2 O2 P -","- C200 H328 N16 O16 P8 -","8","1","ST1044","Koeller, K. J.; Rath, N. P.; Spilling, C. D.","Structure of a chiral bicyclic 1-hydroxyalkyl phosphonamide","Acta Crystallographica Section C","1993","49","8","1547","1549","10.1107/S0108270193001507","","","0.71073","MoKα","","","0.062","","","0.065","","","","","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001481","6.8294","0.0009","19.627","0.003","15.702","0.003","90","","98.3","0.014","90","","2082.7","0.6","193","","193","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tris(nonafluoroisobutyl)phosphine oxide","","- C12 F27 O P -","- C12 F27 O P -","- C48 F108 O4 P4 -","4","1","BR1029","Lynch, V. M.; Kampa, J. J.; Lagow, R. J.; Davis, B. E.","Structure of tris(nonafluoroisobutyl)phosphine oxide","Acta Crystallographica Section C","1993","49","8","1549","1551","10.1107/S0108270193000721","","","0.71073","MoKα","","0.0411","0.0331","","0.0459","0.043","","","","","1.379","1.379","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001482","7.453","0.0004","9.5633","0.0005","27.831","0.003","90","","90","","90","","1983.7","0.3","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C20 H26 Cl2 N2 O2 -","- C20 H26 Cl2 N2 O2 -","- C80 H104 Cl8 N8 O8 -","4","1","CR1018","Ammon, H. L.; Youssefyeh, R. D.; Airey, J. E.; Studt, W. L.; Campbell, H. F.; Powers, M. R.; Golec, F. A.","Structure and absolute configuration of a high affinity 5-HT~3~ receptor antagonist, (5a<i>S</i>,9a<i>S</i>)-<i>N</i>-[(3<i>S</i>)-1-azabicyclo[2.2.2]octan-3-yl]-2-chloro-5a,6,7,8,9,9a-hexahydro-4-dibenzofurancarboxamide hydrochloride","Acta Crystallographica Section C","1993","49","8","1551","1554","10.1107/S0108270193000824","","","1.5418","CuKα","","","0.03","","","0.04","","","","","1.71","1.71","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001483","9.878","0.001","12.326","0.001","16.512","0.003","102.37","0.01","91.05","0.02","94.22","0.01","1957.2","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C9 H9 Au S10 Te -","- C9 H9 Au S10 Te -","- C36 H36 Au4 S40 Te4 -","4","2","CR1020","Swaminathan, K.; Carroll, P. J.; Kochurani; Singh, H. B.; Bhargava, H. D.","Structure of trimethyltelluronium bis(4,5-dimercapto-1,3-dithiole-2-thionato)aurate(III)","Acta Crystallographica Section C","1993","49","7","1243","1246","10.1107/S0108270193002999","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001484","31.676","0.011","8.19","0.002","6.6242","0.0006","90","","90","","90","","1718.5","0.7","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C13 H20 Cl2 N4 Pt S -","- C13 H20 Cl2 N4 Pt S -","- C52 H80 Cl8 N16 Pt4 S4 -","4","1","HH1049","Arvanitis, G. M.; Berardini, M. E.; Parkinson, G. N.; Schneider, B. S.","Structure of a platinum(II) complex of levamisole","Acta Crystallographica Section C","1993","49","7","1246","1248","10.1107/S0108270193002471","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001485","12.902","0.001","20.561","0.002","13.558","0.006","90","","109.38","0.02","90","","3392.8","1.6","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H32 Cu2 N4 O12 -","- C36 H24 Cu2 N4 O12 -","- C144 H96 Cu8 N16 O48 -","4","1","KA1021","Poleti, D.; Karanović, Lj.; Prelesnik, B. V.","A polymeric copper(II) complex with 2,2'-bipyridine and 1,2-benzenedicarboxylate(2–)","Acta Crystallographica Section C","1993","49","7","1249","1251","10.1107/S0108270193001404","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001486","14.117","0.002","11.04","0.002","8.828","0.001","90","","106.8","0.02","90","","1317.1","0.4","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","","","","","- C6 H22 Cl2 N4 Ni O2 -","- C6 H22 Cl2 N4 Ni O2 -","- C24 H88 Cl8 N16 Ni4 O8 -","4","1","NA1022","Marzotto, A.; Clemente, D. A.; Valle, G.","Structure of aquachloro[tris(2-aminoethyl)amine]nickel(II) chloride monohydrate","Acta Crystallographica Section C","1993","49","7","1252","1255","10.1107/S0108270193001416","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001487","11.236","0.002","11.709","0.003","19.897","0.004","75.55","0.02","81.02","0.01","78.92","0.02","2471.5","1","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H46 Cl2 Fe4 N4 O14 -","- C38 Cl2 Fe4 N5 O14 -","- C76 Cl4 Fe8 N10 O28 -","2","1","CR1024","Wu, L.; Pressprich, M.; Coppens, P.; DeMarco, M. J.","A new tetranuclear iron(III) complex with an [Fe~4~O~2~] core: synthesis, structure and Mössbauer studies of [Fe~4~(μ~3~-O)~2~(μ-O~2~CCH~3~)~6~Cl~2~(3-Mepy)~4~].CH~3~C=N (3-Mepy = 3-methylpyridine)","Acta Crystallographica Section C","1993","49","7","1255","1258","10.1107/S0108270193002100","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001488","6.639","0.002","8.443","0.003","13.559","0.004","90","","100.73","0.02","90","","746.7","0.4","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C6 H18 Cl4 P2 Tc -","- C6 H18 Cl4 P2 Tc -","- C12 H36 Cl8 P4 Tc2 -","2","0.5","CD1023","Rochon, F. D.; Melanson, R.","Structures of <i>trans</i>-[TcCl~4~{P(CH~3~)~3~}~2~] and [P(C~7~H~7~)~3~{C(CH~3~)~2~CH~2~COCH~3~}]~2~[TcCl~6~]","Acta Crystallographica Section C","1993","49","7","1259","1262","10.1107/S010827019300321X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001489","15.12","0.004","11.038","0.003","21.146","0.006","90","","128.59","0.02","90","","2758.5","1.5","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C54 H64 Cl6 O2 P2 Tc -","- C54 H64 Cl6 O2 P2 Tc -","- C108 H128 Cl12 O4 P4 Tc2 -","2","0.5","CD1023","Rochon, F. D.; Melanson, R.","Structures of <i>trans</i>-[TcCl~4~{P(CH~3~)~3~}~2~] and [P(C~7~H~7~)~3~{C(CH~3~)~2~CH~2~COCH~3~}]~2~[TcCl~6~]","Acta Crystallographica Section C","1993","49","7","1259","1262","10.1107/S010827019300321X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001490","8.9522","0.001","15.356","0.002","26.317","0.003","90","","98","0.1","90","","3582.6","1.1","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H15 Co6 O11 P S2 -","- C30 H15 Co6 O11 P S2 -","- C120 H60 Co24 O44 P4 S8 -","4","1","NA1030","Gervasio, G.; Rossetti, R.","Structure of μ~6~-carbido-undecacarbonyldi(μ~3~-sulfido)(triphenylphosphine)-<i>triprismo</i>-hexacobalt","Acta Crystallographica Section C","1993","49","7","1262","1264","10.1107/S0108270193002239","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001491","12.369","0.009","7.958","0.008","13.818","0.009","90","","90","","90","","1360.1","1.9","","","","","","","","","","","","6","P c a 21","P 2c -2ac","","","","","- C5 H18 Co N5 O4 S3 -","- C5 H18 Co N5 O4 S3 -","- C20 H72 Co4 N20 O16 S12 -","4","1","CD1005","Tang, K.; Kastner, M. E.; Cooper, J. N.; Kanaskie, M.; Monoski, A.","Structures of <i>cis</i>- and <i>trans</i>-bis(ethylenediamine)(isothiocyanato)(thiosulfato)cobalt(III)","Acta Crystallographica Section C","1993","49","7","1265","1267","10.1107/S0108270193001970","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","189124","2020-10-21","18:00:00",""
"2001492","9.941","0.008","8.884","0.005","16.41","0.02","90","","94.03","0.08","90","","1446","2","","","","","","","","","","","","6","P 1 c 1","P -2yc","","","","","- C5 H19 Co N5 O4.5 S3 -","- C5 H19 Co N5 O4.5 S3 -","- C20 H76 Co4 N20 O18 S12 -","4","2","CD1005","Tang, K.; Kastner, M. E.; Cooper, J. N.; Kanaskie, M.; Monoski, A.","Structures of <i>cis</i>- and <i>trans</i>-bis(ethylenediamine)(isothiocyanato)(thiosulfato)cobalt(III)","Acta Crystallographica Section C","1993","49","7","1265","1267","10.1107/S0108270193001970","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","189124","2020-10-21","18:00:00",""
"2001493","3.8603","0.0005","3.8603","0.0005","12.729","0.003","90","","90","","90","","189.69","0.06","100","","","","","","","","","","","3","I 4/m m m","-I 4 2","","","","","- O4 Ru Sr2 -","- O4 Ru Sr2 -","- O8 Ru2 Sr4 -","2","0.0625","SH1024","Walz, L.; Lichtenberg, F.","Refinement of the structure of Sr~2~RuO~4~ with 100 and 295 K X-ray data","Acta Crystallographica Section C","1993","49","7","1268","1270","10.1107/S0108270192013143","","","0.71073","MoKα","","","0.0146","","","0.0129","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001494","3.8694","0.0004","3.8694","0.0004","12.746","0.002","90","","90","","90","","190.84","0.04","295","","","","","","","","","","","3","I 4/m m m","-I 4 2","","","","","- O4 Ru Sr2 -","- O4 Ru Sr2 -","- O8 Ru2 Sr4 -","2","0.0625","SH1024","Walz, L.; Lichtenberg, F.","Refinement of the structure of Sr~2~RuO~4~ with 100 and 295 K X-ray data","Acta Crystallographica Section C","1993","49","7","1268","1270","10.1107/S0108270192013143","","","0.71073","MoKα","","","0.0197","","","0.0168","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001495","10.873","0.005","10.873","0.005","10.873","0.005","90","","90","","90","","1285.4","1","293","","","","","","","","","","","3","F d -3 m","-F 4vw 2vw 3","","","","","- In2 S4 Yb2 -","- In3 S4 Yb4 -","- In24 S32 Yb32 -","8","","DU1005","Likforman, A.; Guittard, M.","Structure cristalline du sulfure d'ytterbium et d'indium: Yb~4/3~In~4/3~S~4~","Acta Crystallographica Section C","1993","49","7","1270","1271","10.1107/S0108270192013131","","","0.71069","MoKα","","","0.047","","","0.051","","","","","1.81","1.81","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001496","7.8906","0.0003","7.8906","0.0003","5.6628","0.0004","90","","90","","120","","305.34","0.03","296","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","- Br2 Co H12 O14 -","- Br2 Co H12 O14 -","- Br2 Co H12 O14 -","1","0.0833333","CR1038","Blackburn, A. C.; Gerkin, R. E.","Structure of hexaaquacobalt(II) perbromate","Acta Crystallographica Section C","1993","49","7","1271","1275","10.1107/S0108270192013465","","","0.71073","MoKᾱ","","","0.036","","","0.033","","","","","1.33","1.33","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001497","6.9439","0.0009","8.851","0.001","5.0143","0.0008","90","","97.25","0.01","90","","305.72","0.07","297","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Cu Na O4 P -","- Cu Na O4 P -","- Cu4 Na4 O16 P4 -","4","1","DU1029","Kawahara, A.; Kageyama, T.; Watanabe, I.; Yamakawa, J.","Structure du monophosphate synthétique de cuivre et de sodium","Acta Crystallographica Section C","1993","49","7","1275","1277","10.1107/S0108270193000460","","","0.71069","MoKα","","","0.041","","","0.047","","","","","2.62","2.62","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001498","15.33","0.003","19.808","0.004","16.915","0.003","90","","101.638","0.015","90","","5030.8","1.7","167","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H52 As2 N5 O6 Re -","- C52 H45 As2 N5 O6 Re -","- C208 H180 As8 N20 O24 Re4 -","4","1","BR1026","Britten, J. F.; Lock, C. J. L.; Wei, Y.","Bis(tetraphenylarsonium) aquatetra(cyano-<i>C</i>)nitridorhenate(V) pentahydrate","Acta Crystallographica Section C","1993","49","7","1277","1280","10.1107/S0108270193001155","","","0.56086","AgKα","","","0.0583","","","0.0315","","","","","1.41","1.41","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001499","10.978","0.001","9.628","0.001","15.53","0.002","90","","90","","90","","1641.5","0.3","153","1","153","1","","","","","","","","5","P n a 21","P 2c -2n","33","","Aminotriphenylphosphonium bromide","","- C18 H17 Br N P -","- C18 H17 Br N P -","- C72 H68 Br4 N4 P4 -","4","1","SH1034","Pohl, E.; Gosink, H. J.; Herbst-Irmer, R.; Noltemeyer, M.; Roesky, H. W.; Sheldrick, G. M.","Structures of amino(triphenyl)phosphonium bromide and amino(triphenyl)phosphonium hexachloroantimonate","Acta Crystallographica Section C","1993","49","7","1280","1283","10.1107/S0108270192013180","","","0.71073","MoKα","","0.0327","","","0.0598","","","","","1.102","1.066","1.066","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2001500","14.394","0.001","16.712","0.001","20.177","0.002","90","","90.44","0.01","90","","4853.5","0.7","293","1","293","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aminotriphenylphosphonium hexachloroantimonate","","- C18 H17 Cl6 N P Sb -","- C18 H17 Cl6 N P Sb -","- C144 H136 Cl48 N8 P8 Sb8 -","8","2","SH1034","Pohl, E.; Gosink, H. J.; Herbst-Irmer, R.; Noltemeyer, M.; Roesky, H. W.; Sheldrick, G. M.","Structures of amino(triphenyl)phosphonium bromide and amino(triphenyl)phosphonium hexachloroantimonate","Acta Crystallographica Section C","1993","49","7","1280","1283","10.1107/S0108270192013180","","","0.71073","MoKα","","0.0392","","","0.0667","","","","","1.049","1.079","1.079","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001501","17.573","0.002","17.573","0.002","17.573","0.002","90","","90","","90","","5426.7","1.1","153","2","153","2","","","","","","","","5","F -4 3 c","F -4a 2 3","219","","","","- C12 H36 K4 O4 Si4 -","- C12 H36 K4 O4 Si4 -","- C96 H288 K32 O32 Si32 -","8","0.0833333","SH1040","Pauer, F.; Sheldrick, G. M.","Structure of potassium silanolate at 153 K","Acta Crystallographica Section C","1993","49","7","1283","1284","10.1107/S0108270193001301","","","0.71072","MoKα","","0.0364","0.0227","","0.0716","0.0518","","","","1.084","1.084","1.084","","","","","has coordinates","196234","2020-10-21","18:00:00",""
"2001502","19.798","0.002","8.009","0.001","14.524","0.002","90","","94.02","0.01","90","","2297.3","0.5","162","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H38 N4 Ni O9 -","- C16 H22 N4 Ni O10 -","- C64 H88 N16 Ni4 O40 -","4","1","HA1017","Chinn, P.; Busch, D. H.; Alcock, N. W.","Structure of a phenyl dioxocyclam nickel complex","Acta Crystallographica Section C","1993","49","7","1284","1286","10.1107/S0108270193000228","","","0.71069","MoKα","","","0.052","","","0.079","","","","","1.83","1.83","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001503","7.189","0.001","7.125","0.002","11.034","0.002","103.16","0.02","96.74","0.02","99.41","0.02","535.9","0.2","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H16 K4 O14 -","- C14 H20 K4 O14 -","- C14 H20 K4 O14 -","1","0.5","ST0593","Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E.","Structures of tetrapotassium, tetrarubidium and tetracaesium 1,4,5,8-naphthalenetetracarboxylate hexahydrates","Acta Crystallographica Section C","1993","49","7","1287","1294","10.1107/S0108270193000411","","","0.71073","MoKᾱ","","","0.034","","","0.043","","","","","1.71","1.71","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001504","7.28","0.001","7.378","0.001","11.179","0.001","102.54","0.01","98.15","0.01","99.51","0.01","568.14","0.13","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H16 O14 Rb4 -","- C14 H16 O14 Rb4 -","- C14 H16 O14 Rb4 -","1","0.5","ST0593","Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E.","Structures of tetrapotassium, tetrarubidium and tetracaesium 1,4,5,8-naphthalenetetracarboxylate hexahydrates","Acta Crystallographica Section C","1993","49","7","1287","1294","10.1107/S0108270193000411","","","0.71073","MoKᾱ","","","0.032","","","0.033","","","","","1.15","1.15","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001505","7.517","0.001","7.637","0.002","11.355","0.001","101.84","0.03","99.53","0.01","100.4","0.01","613.5","0.2","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H16 Cs4 O14 -","- C14 H16 Cs4 O14 -","- C14 H16 Cs4 O14 -","1","0.5","ST0593","Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E.","Structures of tetrapotassium, tetrarubidium and tetracaesium 1,4,5,8-naphthalenetetracarboxylate hexahydrates","Acta Crystallographica Section C","1993","49","7","1287","1294","10.1107/S0108270193000411","","","0.71073","MoKᾱ","","","0.029","","","0.039","","","","","1.83","1.83","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001506","11.302","0.002","11.814","0.001","10.457","0.001","97.09","0.02","109.44","0.02","77.89","0.01","1285.2","0.3","295","","","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H18 Ag2 Cu N8 O -","- C24 H16 Ag2 Cu N8 O -","- C48 H32 Ag4 Cu2 N16 O2 -","2","1","KA1014","Černák, J.; Gérard, F.; Chomič, J.","<i>catena</i>-Poly[silver(I)-μ-(cyano-<i>C</i>:<i>N</i>)-<i>cis</i>-bis(2,2'-bipyridine-<i>N</i>,<i>N</i>')copper(II)-μ-(cyano-<i>N</i>:<i>C</i>)] dicyanoargentate(I) monohydrate","Acta Crystallographica Section C","1993","49","7","1294","1296","10.1107/S010827019300037X","","","0.7093","MoKα","","","0.0291","","","0.0387","","","","","1.1911","1.1911","","","","","has coordinates","278245","2022-09-28","14:26:39",""
"2001507","8.088","0.001","7.456","0.002","13.371","0.004","90","","92.83","0.02","90","","805.3","0.3","295","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H20 O10 Rh2 -","- C10 H20 O10 Rh2 -","- C20 H40 O20 Rh4 -","2","0.5","DU1013","Noinville, V.; Viossat, B.; Dung, Nguyen-Huy","Isotypie entre les structures cristallines des tétrakis(μ-acétato)bis(méthanol) dicuivre(II) et de dirhodium(II)","Acta Crystallographica Section C","1993","49","7","1297","1298","10.1107/S0108270193000022","","","0.7107","MoKα","","","0.035","","","0.031","","","","","1.5","1.5","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2001508","8.277","0.001","12.72","0.002","11.887","0.002","90","","91","0.1","90","","1251.3","0.3","295","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C6 H6 Br2 Cl2 Cu N4 -","- C6 H6 Br2 Cl2 Cu N4 -","- C24 H24 Br8 Cl8 Cu4 N16 -","4","0.5","NA1027","Valle, G.; Sánchez González, A.; Ettorre, R.","Structure of dibromobis(2-chloroimidazole)copper(II)","Acta Crystallographica Section C","1993","49","7","1298","1300","10.1107/S0108270193001209","","","0.7107","MoKα","","","0.074","","","0.076","","","","","0.83","0.83","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001509","11.244","0.003","12.775","0.002","21.05","0.005","97.26","0.02","103.03","0.02","89.84","0.02","2921.2","1.2","295","","","","","","","","","","","7","P -1","-P 1","2","","","","- C56 H140 As4 Mo12 N10 Na2 O74 -","- C56 H104 As4 Mo12 N10 Na2 O74 -","- C56 H104 As4 Mo12 N10 Na2 O74 -","1","0.5","LI1006","You, X.-Z.; Li, H.-L.; Yu, K.-B.; Li, L.","Hexaaquadisodium hexakis(tetramethylammonium) bis[bis(3-acetylamino-4-hydroxyphenylarsonato)aquaoctadecaoxohexamolybdate] decahydrate: [Na~2~(H~2~O)~6~][(CH~3~)~4~N]~6~[Mo~6~(C~8~H~8~AsNO~5~)~2~O~18~(H~2~O)]~2~.10H~2~O","Acta Crystallographica Section C","1993","49","7","1300","1303","10.1107/S010827019201360X","","","0.71073","Mo","","","0.038","","","0.0397","","","","","1.365","1.365","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001510","7.111","0.002","8.042","0.001","8.045","0.002","78.65","0.02","87.02","0.02","70.04","0.02","423.92","0.18","200","","","","","","","","","","","5","P -1","-P 1","2","","","","- C8 H13 Cl6 N4 Nb -","- C8 H14 Cl6 N4 Nb -","- C8 H14 Cl6 N4 Nb -","1","0.5","CD1013","Therrien, B.; Beauchamp, A. L.","Structures of hexachloroniobate(V) salts of the 1-methylimidazole/1-methylimidazolium and 2-methylimidazolium cations","Acta Crystallographica Section C","1993","49","7","1303","1307","10.1107/S0108270192012952","","","0.71069","MoKᾱ","","","0.056","","","0.057","","","","","2.69","2.69","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001511","21.43","0.01","6.851","0.002","17.65","0.01","90","","99.41","0.02","90","","2556","2","200","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C4 H7 Cl6 N2 Nb -","- C4 H7 Cl6 N2 Nb -","- C32 H56 Cl48 N16 Nb8 -","8","1","CD1013","Therrien, B.; Beauchamp, A. L.","Structures of hexachloroniobate(V) salts of the 1-methylimidazole/1-methylimidazolium and 2-methylimidazolium cations","Acta Crystallographica Section C","1993","49","7","1303","1307","10.1107/S0108270192012952","","","0.71069","MoKᾱ","","","0.03","","","0.038","","","","","1.16","1.16","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001512","14.581","0.009","14.62","0.01","16.88","0.01","102.4","0.02","105.45","0.02","113.53","0.02","2963","3","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C60 H40 As2 N6 Se6 Sn -","- C60 As2 N6 Se6 Sn -","- C120 As4 N12 Se12 Sn2 -","2","1","SH1016","Gruss, D.; Hummel, H.-U.","Structure of [As(C~6~H~5~)~4~]~2~[Sn{Se~2~C=C(CN)~2~}~3~]","Acta Crystallographica Section C","1993","49","7","1307","1309","10.1107/S0108270192012812","","","0.7099","MoKα","","","0.062","","","0.055","","","","","1.712","1.712","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001513","12.24","0.002","12.642","0.002","14.039","0.002","103.86","0.01","104.16","0.01","90.62","0.01","2039.5","0.6","153","1","153","1","","","","","","","","5","P -1","-P 1","2","","Bis[(trimethylsilylmethoxy)bis(trimethylsilylmethyl)gallium]","","- C24 H66 Ga2 O2 Si6 -","- C24 H66 Ga2 O2 Si6 -","- C48 H132 Ga4 O4 Si12 -","2","1","HL1019","Dembowski, U.; Pape, T.; Herbst-Irmer, R.; Pohl, E.; Roesky, H. W.; Sheldrick, G. M.","Structure of bis-μ-[(trimethylsilylmethanolato-<i>O</i>)-bis(trimethylsilylmethyl)gallium] and bis-μ-[(trimethylsilylmethanolato-<i>O</i>)-bis(trimethylsilylmethyl)indium]","Acta Crystallographica Section C","1993","49","7","1309","1311","10.1107/S0108270192013337","","","0.71073","MoKα","","0.0744","0.0441","","0.1015","0.0822","","","","1.109","1.054","1.054","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2001514","9.887","0.004","11.879","0.004","17.586","0.006","104.4","0.02","93.43","0.03","94.66","0.02","1987.1","1.3","153","1","153","1","","","","","","","","5","P -1","-P 1","2","","Bis((trimethylsiloxy)bis(trimethylsilylmethyl)indium)","","- C22 H62 In2 O2 Si6 -","- C22 H62 In2 O2 Si6 -","- C44 H124 In4 O4 Si12 -","2","1","HL1019","Dembowski, U.; Pape, T.; Herbst-Irmer, R.; Pohl, E.; Roesky, H. W.; Sheldrick, G. M.","Structure of bis-μ-[(trimethylsilylmethanolato-<i>O</i>)-bis(trimethylsilylmethyl)gallium] and bis-μ-[(trimethylsilylmethanolato-<i>O</i>)-bis(trimethylsilylmethyl)indium]","Acta Crystallographica Section C","1993","49","7","1309","1311","10.1107/S0108270192013337","","","0.71073","MoKα","","0.0356","0.026","","0.0627","0.0543","","","","1.069","1.049","1.049","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2001515","11.841","0.006","7.85","0.006","11.586","0.006","90","","96.028","0.019","90","","1071","1.1","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C22 H14 Cu O4 S4 -","- C30 H20 Cu O4 S6 -","- C60 H40 Cu2 O8 S12 -","2","0.5","HU1005","Baxter, L. A. M.; Blake, A. J.; Gould, R. O.; Heath, G. A.; Stephenson, T. A.","Cu^II^ and Pd^II^ complexes of 3-hydroxy-1,3-bis(2-thienyl)prop-2-en-1-one","Acta Crystallographica Section C","1993","49","7","1311","1315","10.1107/S0108270192012691","","","0.71073","MoKα","","","0.0398","","","0.0668","","","","","0.659","0.659","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001516","11.892","0.004","7.943","0.004","11.582","0.003","90","","98.02","0.03","90","","1083.3","0.7","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C22 H14 O4 Pd S4 -","- C30 H20 O4 Pd S6 -","- C60 H40 O8 Pd2 S12 -","2","0.5","HU1005","Baxter, L. A. M.; Blake, A. J.; Gould, R. O.; Heath, G. A.; Stephenson, T. A.","Cu^II^ and Pd^II^ complexes of 3-hydroxy-1,3-bis(2-thienyl)prop-2-en-1-one","Acta Crystallographica Section C","1993","49","7","1311","1315","10.1107/S0108270192012691","","","0.71073","MoKα","","","0.03","","","0.0434","","","","","1.207","1.207","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001517","9.752","0.002","11.68","0.002","9.203","0.002","92.43","0.02","115.3","0.01","110.13","0.01","867.4","0.3","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H26 O5 P2 Pt -","- C12 H24 O5 P2 Pt -","- C24 H48 O10 P4 Pt2 -","2","1","AS1035","Suzuki, Y.; Miyamoto, T. K.; Ichida, H.","(1,1-Cyclobutanedicarboxylato-<i>O</i>,<i>O</i>')bis(trimethylphosphine-<i>P</i>)platinum(II) monohydrate","Acta Crystallographica Section C","1993","49","7","1315","1317","10.1107/S0108270192013489","","","0.71069","MoKα","","","0.041","","","0.044","","","","","1.57","1.57","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001518","16.662","0.002","12.99","0.002","12.226","0.002","90","","90","","90","","2646.2","0.7","297","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H18 O4 P2 Pt -","- C8 H18 O4 P2 Pt -","- C64 H144 O32 P16 Pt8 -","8","1","AS1038","Suzuki, Y.; Miyamoto, T. K.; Ichida, H.","(Oxalato-<i>O</i>,<i>O</i>')bis(trimethylphosphine)platinum(II)","Acta Crystallographica Section C","1993","49","7","1317","1318","10.1107/S0108270192013490","","","0.71069","MoKα","","","0.04","","","0.044","","","","","1.68","1.68","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001519","8.514","0.001","14.76","0.001","11.36","0.002","90","","98.79","0.01","90","","1410.8","0.3","296","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 N2 O6 P2 Pt -","- C6 H18 N2 O6 P2 Pt -","- C24 H72 N8 O24 P8 Pt4 -","4","1","AS1039","Suzuki, Y.; Miyamoto, T. K.; Ichida, H.","[<i>SP</i>-4-2]-Dinitratobis(trimethylphosphine)platinum(II)","Acta Crystallographica Section C","1993","49","7","1318","1320","10.1107/S0108270192013507","","","0.71069","MoKα","","","0.044","","","0.045","","","","","1.38","1.38","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001520","25.008","0.004","14.045","0.002","17.378","0.003","90","","112.39","0.01","90","","5643.7","1.6","293","","293","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","iucr: bis-μ-(2-{[(diphenylphosphino)propyl](phenyl)phosphino}phenyl)- 1κC^1^:2κ^2^P,P';1κ^2^P,P':2κC^1^-μ-hydroxo-diplatinum(II) tetrafluoroborate bis(dichloromethane) solvate author: μHydroxy-bis(1-(diphenylphosphino)-3-(μ-ortho-phenyl, phenylphosphino)propane platinum(II)) tetrafluoroborate disolvate (solvent=dichloromethane).","","- C56 H55 B Cl4 F4 O P4 Pt2 -","- C56 H55 B Cl4 F4 O P4 Pt2 -","- C224 H220 B4 Cl16 F16 O4 P16 Pt8 -","4","1","CD1032","Bennett, M. A.; Berry, D. E.; Beveridge, K. A.; Browning, J.; Russow, M. P.","μ-Hydroxo diplatinum(II) complex containing bridging cyclometallated 1,3-bis(diphenylphosphino)propane as the tetrafluoroborate salt","Acta Crystallographica Section C","1993","49","7","1320","1322","10.1107/S0108270193000010","","","0.71069","MoKα","","","0.0597","","","0.0619","","","","","1.8532","1.8532","","","","","has coordinates","202202","2020-10-21","18:00:00",""
"2001521","9.71","0.002","9.71","0.002","25.746","0.006","90","","90","","120","","2102.2","0.8","295","2","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","","","- C20 Co6 O18 -","- C20 Co6 O18 -","- C60 Co18 O54 -","3","0.5","HH1034","Geiser, U.; Kini, A. M.","Structure of the trigonal phase of bis(methinyltricobaltenneacarbonyl), [CCo~3~(CO)~9~]~2~","Acta Crystallographica Section C","1993","49","7","1322","1324","10.1107/S010827019300085X","","","0.7107","MoKα","","","0.025","","","0.023","","","","","0.948","0.948","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2001522","8.4008","0.0007","18.178","0.002","15.164","0.002","90","","93.803","0.007","90","","2310.6","0.4","297","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 N2 Ni P2 S2 -","- C20 H24 N2 Ni P2 S2 -","- C80 H96 N8 Ni4 P8 S8 -","4","1","AB1033","Juma, B.; Fronczek, F. R.; Stanley, G. G.","Structures of nickel(II) bis- and trisphosphine diisothiocyanate complexes","Acta Crystallographica Section C","1993","49","7","1325","1328","10.1107/S0108270193000770","","","1.54184","CuKα","","","0.039","","","0.05","","","","","2.154","2.154","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001523","7.602","0.002","20.599","0.002","20.712","0.004","90","","97.98","0.02","90","","3212","1.1","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H33 N2 Ni P3 S2 -","- C32 H33 N2 Ni P3 S2 -","- C128 H132 N8 Ni4 P12 S8 -","4","1","AB1033","Juma, B.; Fronczek, F. R.; Stanley, G. G.","Structures of nickel(II) bis- and trisphosphine diisothiocyanate complexes","Acta Crystallographica Section C","1993","49","7","1325","1328","10.1107/S0108270193000770","","","1.54184","CuKα","","","0.081","","","0.089","","","","","3.23","3.23","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001524","10.809","0.003","10.947","0.006","10.955","0.004","108.02","0.04","93.66","0.03","118.44","0.03","1048.8","0.9","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- C10 H20 I2 N2 S4 Te -","- C12 I2 N2 S4 Te -","- C24 I4 N4 S8 Te2 -","2","1","AB1024","Kumar, R. K.; Aravamudan, G.; Udupa, M. R.; Seshasayee, M.; Hamor, T. A.","Structure of bis(diethyldithiocarbamato)diiodotellurium(IV)","Acta Crystallographica Section C","1993","49","7","1328","1330","10.1107/S0108270192012745","","","0.71069","MoKα","","","0.042","","","0.051","","","","","0.995","0.995","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001525","8.115","0.001","13.998","0.001","13.919","0.001","90","","104.19","0.007","90","","1532.9","0.2","294","1","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Au Cl N4 O2 -","- C12 H18 Au Cl N4 O3 -","- C48 H72 Au4 Cl4 N16 O12 -","4","1","BR1023","Lock, C. J. L.; Wang, Z.","Bis(4-hydroxymethyl-1,5-dimethylimidazole-<i>N</i>^3^)gold(I) chloride","Acta Crystallographica Section C","1993","49","7","1330","1333","10.1107/S0108270193000848","","","0.71073","MoKα","","","0.044","","","0.033","","","","","1.81","1.81","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001526","10.574","0.003","11.037","0.003","13.58","0.004","86.96","0.02","76.7","0.02","78.32","0.02","1510.4","0.8","294","1","","","","","","","","","","7","P -1","-P 1","2","","","","- C29 H29 F6 N O P2 Ru -","- C29 H29 F6 N O P2 Ru -","- C58 H58 F12 N2 O2 P4 Ru2 -","2","1","HE1004","Simpson, S. J.","(<i>tert</i>-Butyl isocyano-<i>C</i>)(carbonyl)(η^5^-cyclopentadienyl)(triphenylphosphine-<i>P</i>)ruthenium(II) hexafluorophosphate","Acta Crystallographica Section C","1993","49","7","1333","1335","10.1107/S0108270193000733","","","0.71073","MoKα","","","0.0436","","","0.0604","","","","","2.12","2.12","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001527","14.073","0.001","14.073","0.001","14.073","0.001","90","","90","","90","","2787.1","0.3","293","","","","","","","","","","","5","P a -3","-P 2ac 2ab 3","","","","","- C3 H12 F6 Ga N9 -","- C3 H18 F6 Ga N9 -","- C24 H144 F48 Ga8 N72 -","8","0.333333","KA1015","Małuszyńska, H.","Structure of guanidinium hexafluorogallate, [C(NH~2~)~3~]~3~GaF~6~","Acta Crystallographica Section C","1993","49","7","1335","1336","10.1107/S0108270193000368","","","1.54178","CuKα","","","0.034","","","0.045","","","","","0.9","0.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001528","8.647","0.006","6.627","0.002","12.118","0.003","90","","101.58","0.01","90","","680.3","0.5","296","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H12 K2 Ni O14 -","- C4 H12 K2 Ni O14 -","- C8 H24 K4 Ni2 O28 -","2","0.5","AB1046","Román, P.; Guzmán-Miralles, C.; Luque, A.","Structure of dipotassium <i>trans</i>-diaquabis(oxalato-<i>O</i>,<i>O</i>')nickelate(II)–water (1/4)","Acta Crystallographica Section C","1993","49","7","1336","1339","10.1107/S0108270193000940","","","0.71069","MoKα","","","0.027","","","0.03","","","","","0.69","0.69","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001529","12.053","0.004","18.453","0.006","29.259","0.01","90","","90","","90","","6508","4","295","","","","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C54.5 H14 Br8 Cl6 F20 N4 O2.5 Zn -","- C64 Br8 Cl12 F20 N4 O2 Zn -","- C256 Br32 Cl48 F80 N16 O8 Zn4 -","4","0.5","HH1024","Marsh, R. E.; Schaefer, W. P.; Hodge, J. A.; Hughes, M. E.; Gray, H. B.; Lyons, J. E.; Ellis, Jnr, P. E.","A highly solvated zinc(II) tetrakis(pentafluorophenyl)-β-octabromoporphyrin","Acta Crystallographica Section C","1993","49","7","1339","1342","10.1107/S0108270193000642","","","0.71073","MoKα","","","0.066","","","","","","","","1.74","1.74","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001530","11.794","0.005","14.492","0.004","14.731","0.002","87.51","0.05","73.48","0.05","78.4","0.03","2364.3","1.4","294","","","","","","","","","","","6","P -1","-P 1","2","","","","- C45 H2 Cl10 Cu F20 N4 -","- C45 H2 Cl10 Cu F20 N4 -","- C90 H4 Cl20 Cu2 F40 N8 -","2","1","HH1022","Schaefer, W. P.; Hodge, J. A.; Hughes, M. E.; Gray, H. B.; Lyons, J. E.; Ellis, Jnr, P. E.; Wagner, R. W.","Copper(II) tetrakis(pentafluorophenyl)-β-octachloroporphyrin","Acta Crystallographica Section C","1993","49","7","1342","1345","10.1107/S0108270193000587","","","0.71073","MoKα","","","0.052","","","0.014","","","","","3.75","3.75","","","","","has coordinates","202204","2020-10-21","18:00:00",""
"2001531","11.009","0.005","10.236","0.006","27.627","0.012","90","","97.02","0.04","90","","3090","3","195","1","195","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Trimeric bis(cyclopentadienyl)oxozirconium(IV) benzene solvate","","- C36 H36 O3 Zr3 -","- C36 H36 O3 Zr3 -","- C144 H144 O12 Zr12 -","4","1","HU1023","Mikhailova, O. A.; Minacheva, M. H.; Burlakov, V. V.; Shur, V. B.; Pisarevsky, A. P.; Yanovsky, A. I.; Struchkov, Yu. T.","Trimeric bis(cyclopentadienyl)oxozirconium(IV) benzene solvate","Acta Crystallographica Section C","1993","49","7","1345","1347","10.1107/S0108270192013349","","","0.71073","MoKα","","0.0884","0.0438","","0.1677","0.0926","","","","1.056","1.02","1.02","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001532","19.347","0.009","25.289","0.007","9.698","0.003","100.6","0.02","96.02","0.03","76.01","0.03","4517","3","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H10 Co Ni S10 -","- C16 H10 Co Ni S10 -","- C128 H80 Co8 Ni8 S80 -","8","4","LI1014","Fang, Q.; You, X.-Z.; Cai, J.-H.; He, M.-Y.","Cobaltocenium bis[(4,5-dimercapto-<i>S</i>^4^,<i>S</i>^5^)-1,3-dithiole-2-thionato]nickelate","Acta Crystallographica Section C","1993","49","7","1347","1350","10.1107/S0108270193000332","","","0.71069","MoKα","","","0.047","","","0.062","","","","","1.32","1.32","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001533","18.049","0.006","17.661","0.008","23.475","0.01","90","","92.1","0.03","90","","7478","5","290","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40.5 H36.5 Mo O3 P3 -","- C40.5 H33 Mo O3 P3 -","- C324 H264 Mo8 O24 P24 -","8","2","LI1041","Willey, G. R.; Butcher, M. L.; Lakin, M. T.; Downs, G. W.","Structure of tricarbonyltris(diphenylphosphine)molybdenum(0) hexane solvate: <i>fac</i>-[Mo(CO)~3~(PPh~2~H)~3~] ^.^ 0.25C~6~H~14~","Acta Crystallographica Section C","1993","49","7","1350","1352","10.1107/S0108270193000289","","","0.71069","MoKα","","","0.062","","","0.066","","","","","1.1159","1.1159","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001534","18.731","0.004","7.789","0.002","10.371","0.002","90","","96.32","0.02","90","","1503.9","0.6","293","1","293","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-1-Ferrocenyl-2-(2-nitrophenyl)ethylene","","- C18 H15 Fe N O2 -","- C18 H15 Fe N O2 -","- C72 H60 Fe4 N4 O8 -","4","1","VS1004","Todres, Z. V.; Yanovsky, A. I.; Ermekov, D. S.; Struchkov, Yu. T.","<i>cis</i>-1-Ferrocenyl-2-(2-nitrophenyl)ethylene","Acta Crystallographica Section C","1993","49","7","1352","1354","10.1107/S0108270192013386","","","0.71073","MoKα","","0.086","0.0657","","0.1597","0.1399","","","","1.194","1.233","1.233","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001535","12.353","0.004","6.334","0.001","10.044","0.002","90","","111.75","0.02","90","","729.9","0.3","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[(2S,4R)-γ-hydroxynorvalinato-(2R,4S)-γ-hydroxynorvalinato]copper(II)","","- C10 H20 Cu N2 O6 -","- C10 H20 Cu N2 O6 -","- C20 H40 Cu2 N4 O12 -","2","0.5","KA1023","Deljac, A.; Kaitner, B.; Kirin, S. I.; Meštrović, E.","Structure of [(2<i>S</i>,4<i>R</i>)-γ-hydroxynorvalinato][(2<i>R</i>,4<i>S</i>)-γ-hydroxynorvalinato]copper(II)","Acta Crystallographica Section C","1993","49","7","1354","1357","10.1107/S0108270193000381","","","0.7093","MoKα","","","0.032","","","0.046","","","","","1.208","1.208","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001536","11.182","0.001","17.816","0.001","12.137","0.001","90","","97.437","0.001","90","","2397.6","0.3","223","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H34 Co N2 O4 -","- C26 H34 Co N2 O4 -","- C104 H136 Co4 N8 O16 -","4","1","SH1013","Hiller, W.; Nishinaga, A.; Tsutsui, T.; Rieker, A.","Structure of [di-<i>tert</i>-butyl(dimethoxy)salen]cobalt(II)","Acta Crystallographica Section C","1993","49","7","1357","1359","10.1107/S010827019300109X","","","1.54056","CuKα","","","0.039","","","0.043","","","","","1.48","1.48","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001537","9.023","0.003","11.74","0.003","11.861","0.003","107.78","0.02","107.83","0.02","107.74","0.02","1023.2","0.6","290","","","","","","","","","","","4","P -1","-P 1","2","","","","- C23 H25 Ga N4 -","- C23 H25 Ga N4 -","- C46 H50 Ga2 N8 -","2","1","HU1029","Alcock, N. W.; Blacker, N. C.; Errington, W.; Wallbridge, M. G. H.","Structure of the monomethylgallium derivative of TMTAA (dibenzotetramethyltetraaza[14]annulene)","Acta Crystallographica Section C","1993","49","7","1359","1361","10.1107/S0108270193000484","","","0.71073","MoKα","","","0.053","","","0.06","","","","","0.84","0.84","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001538","11.7","0.001","10.878","0.001","12.892","0.001","90","","90","","90","","1640.8","0.2","293","","","","","","","","","","","6","P c a b","-P 2bc 2ac","61","","","","- C11 H24 Cl2 Cr N5 S -","- C11 H24 Cl2 Cr N5 S -","- C44 H96 Cl8 Cr4 N20 S4 -","4","0.5","LI1031","Bouckaert, J.; Maes, D.; Lisgarten, J. N.; Chattopadhyay, T. K.; Palmer, R. A.; Mazid, M. A.; Gazi, D. M.","Structures of chromium(III) cyclam complexes. 5. Structure of <i>trans</i>-dichloro(1,4,8,11-tetraazacyclotetradecane)chromium(III) isothiocyanate","Acta Crystallographica Section C","1993","49","7","1361","1363","10.1107/S010827019300054X","","","0.71069","MoKα","","","0.036","","","0.036","","","","","","","","","","","has coordinates,has disorder","205962","2020-10-21","18:00:00",""
"2001540","15.106","0.007","13.57","0.005","7.386","0.003","101.55","0.02","94.18","0.02","92.49","0.02","1476.8","1.1","303","","303","","","","","","","","","6","P 1","P 1","1","","(N,N'-o-Phenylenedisalicylideneaminato)iron(III)chloride","","- C20 H14 Cl Fe N2 O2 -","- C20 H14 Cl Fe N2 O2 -","- C60 H42 Cl3 Fe3 N6 O6 -","3","3","SH1030","Elmali, A.; Elerman, Y.; Svoboda, I.; Fuess, H.","Structure of [<i>N</i>,<i>N</i>'-<i>o</i>-phenylenebis(salicylideneaminato)]iron(III) chloride as a five-coordinate monomer","Acta Crystallographica Section C","1993","49","7","1365","1367","10.1107/S0108270193000617","","","0.71069","MoKα","","","0.0484","","","0.0466","","","","","1.03","1.03","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001541","9.775","0.002","30.857","0.01","9.698","0.002","90","","90","","90","","2925.2","1.3","128","5","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C21 Co6 O19 -","- C21 Co6 O19 -","- C84 Co24 O76 -","4","1","HL1020","Worth, G. H.; Robinson, B. H.; Simpson, J.","Redetermination of the structure of μ~6~-acetonato-1:2:3κ^3^<i>C</i>^1^;4:5:6κ^3^<i>C</i>^3^-bis[nonacarbonyl-1κ^3^<i>C</i>,2κ^3^<i>C</i>,3κ^3^<i>C</i>-<i>triangulo</i>-tricobalt(3 <i>Co</i>‒<i>Co</i>)] at 128 K","Acta Crystallographica Section C","1993","49","7","1367","1369","10.1107/S0108270193000526","","","0.71069","Mo","","","0.0316","","","0.047","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001542","6.975","0.002","7.482","0.003","19.122","0.007","90","","90","","90","","997.9","0.6","294","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C5 H11 Cl N3 O3 Pt -","- C5 H11 Cl N3 O3 Pt -","- C20 H44 Cl4 N12 O12 Pt4 -","4","1","DU1027","Viossat, B.; Khodadad, P.; Rodier, N.","Diamminechloro(5-oxoprolinato)platine(II)","Acta Crystallographica Section C","1993","49","7","1370","1372","10.1107/S0108270193000046","","","0.7107","MoKᾱ","","","0.027","","","0.037","","","","","1.48","1.48","","","","","has coordinates","187340","2020-10-21","18:00:00",""
"2001543","12.151","0.002","12.151","0.002","6.545","0.001","90","","90","","90","","966.3","0.3","293","1","293","1","","","","","","","","3","P -4 21 c","P -4 2n","114","","Tetraphenyllead","","- C24 H20 Pb -","- C24 H20 Pb -","- C48 H40 Pb2 -","2","0.25","AL1039","Preut, H.; Huber, F.","Redetermination of tetraphenyllead","Acta Crystallographica Section C","1993","49","7","1372","1373","10.1107/S0108270193001878","","","0.71073","MoKα","","0.0347","0.0301","","0.0505","0.0412","","","","","1.32","1.32","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001544","7.9122","0.0008","13.788","0.002","19.15","0.004","90","","90","","90","","2089.1","0.6","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C21 H32 O6 -","- C21 H32 O6 -","- C84 H128 O24 -","4","1","NA1024","Puliti, R.; Fontana, A.; Cimino, G.; Mattia, C. A.; Mazzarella, L.","Structure of a keto derivative of 9,11-dihydrogracilin A","Acta Crystallographica Section C","1993","49","7","1373","1376","10.1107/S0108270193001003","","","1.54056","CuKα","","","0.05","","","0.049","","","","","0.22","0.22","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001545","7.0711","0.0004","15.09","0.001","11.1925","0.0006","90","","106.916","0.004","90","","1142.6","0.12","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","","(3,5-dinitrobenzoic acid)(benzo-15-crown-5)monohydrate","","- C21 H26 N2 O12 -","- C21 H26 N2 O12 -","- C42 H52 N4 O24 -","2","1","HA1021","Schouten, A.; Kanters, J. A.; Poonia, N. S.","Structure of the benzo-15-crown-5‒3,5-dinitrobenzoic acid‒water (1/1/1) complex","Acta Crystallographica Section C","1993","49","7","1376","1378","10.1107/S010827019201357X","","","0.71073","MoKα","","","0.0332","","","0.0297","","","","","1.49","1.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001546","12.462","0.003","8.035","0.003","13.539","0.004","90","","112.89","0.03","90","","1248.9","0.7","291","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C13 H18 O2 -","- C13 H18 O2 -","- C52 H72 O8 -","4","2","AL1030","Freer, A. A.; Bunyan, J. M.; Shankland, N.; Sheen, D. B.","Structure of (<i>S</i>)-(+)-ibuprofen","Acta Crystallographica Section C","1993","49","7","1378","1380","10.1107/S0108270193000629","","","0.71069","MoKα","","","0.056","","","0.067","","","","","3.09","3.09","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001547","11.915","0.001","19.228","0.003","8.05","0.001","90","","99.1","0.01","90","","1821.1","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4b,6a-bis(acetyloxy)-4b,6a,10b,10c-tetrahydrobenzo[3,4]-cyclo-buta[1,2a] biphenylene","","- C22 H18 O4 -","- C22 H18 O4 -","- C88 H72 O16 -","4","1","HA1033","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mouaddib, A.; Caubère, P.","Synthesis and structure of new families of potential antitumor or antiviral agents. I. 4b,6a,10b,10c-Tetrahydrobenzo[3,4]cyclobuta[1,2-<i>a</i>]biphenylene-4b,6a-diyl diacetate","Acta Crystallographica Section C","1993","49","7","1380","1384","10.1107/S0108270193000265","","","1.54178","X-rayCu-Kαmean","","0.0506","0.0459","","0.1413","0.1266","","","","1.058","1.101","1.101","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001548","14.434","0.006","9.637","0.002","14.398","0.007","90","","96.34","0.02","90","","1990.5","1.3","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","1-(p-Toluenesulfonyl)-3,4:7,8-dibenzotricyclo[3.3.2.0^2,6^]decane","","- C25 H22 O3 S -","- C25 H22 O3 S -","- C100 H88 O12 S4 -","4","1","AL1032","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Zouaoui, A.; Caubère, P.","Synthesis and structure of new families of potential antitumor or antiviral agents. II. 1-(<i>p</i>-Toluenesulfonyloxy)-3,4:7,8-dibenzotricyclo[3.3.2.0^2,6^]decane","Acta Crystallographica Section C","1993","49","7","1384","1388","10.1107/S0108270192012782","","","1.54178","CuKᾱ","","0.1048","0.0655","","0.1849","0.1394","","","","0.864","1.098","1.098","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001549","8.573","0.001","10.628","0.001","6.544","0.001","90","","105.55","0.01","90","","574.42","0.13","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Cis,anti,cis-8-methoxytricyclo[6.3.0.0^2,7^]undecan-2,3-diol","","- C12 H20 O3 -","- C12 H20 O3 -","- C24 H40 O6 -","2","1","HA1032","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Brosse, N.; Caubère, P.","Synthesis and structure of strained polycyclic cyclobutane-containing derivatives","Acta Crystallographica Section C","1993","49","7","1388","1392","10.1107/S0108270193000319","","","1.54056","CuKα~1~","","0.0667","0.0486","","0.1384","0.1219","","","","0.944","1.049","1.049","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001550","8.394","0.001","14.26","0.002","12.007","0.001","90","","91.79","0.01","90","","1436.5","0.3","293","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","13-spiro-2'-[1,3]dioxolanetricyclo[6.5.0.0^2,7^]tridec-6-ene","","- C16 H24 O3 -","- C16 H24 O3 -","- C64 H96 O12 -","4","1","HA1032","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Brosse, N.; Caubère, P.","Synthesis and structure of strained polycyclic cyclobutane-containing derivatives","Acta Crystallographica Section C","1993","49","7","1388","1392","10.1107/S0108270193000319","","","1.54056","CuKα~1~","","0.1092","0.0603","","0.2305","0.1635","","","","0.883","1.064","1.064","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001551","15.738","0.007","4.854","0.002","9.944","0.005","90","","96.58","0.02","90","","754.6","0.6","297","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C8 H8 F N O2 -","- C8 H8 F N O2 -","- C32 H32 F4 N4 O8 -","4","1","HH1019","Burns, J. H.; Hagaman, E. W.","Three monofluorinated small molecules: <i>ortho</i>-fluorophenylglycine, methyl 4-(fluorocarbonyl)benzoate and 16α-fluoro-α-estradiol 3-methyl ether","Acta Crystallographica Section C","1993","49","7","1393","1396","10.1107/S0108270193000605","","","0.71069","MoKα","","","0.061","","","0.071","","","","","1.95","1.95","","","","","has coordinates","281832","2023-03-13","07:37:27",""
"2001552","7.394","0.004","17.363","0.004","7.288","0.003","90","","116.51","0.02","90","","837.3","0.6","297","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C9 H7 F O3 -","- C9 H7 F O3 -","- C36 H28 F4 O12 -","4","1","HH1019","Burns, J. H.; Hagaman, E. W.","Three monofluorinated small molecules: <i>ortho</i>-fluorophenylglycine, methyl 4-(fluorocarbonyl)benzoate and 16α-fluoro-α-estradiol 3-methyl ether","Acta Crystallographica Section C","1993","49","7","1393","1396","10.1107/S0108270193000605","","","0.71069","MoKα","","","0.05","","","0.05","","","","","1.35","1.35","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001553","6.057","0.002","8.968","0.002","29.354","0.005","90","","90","","90","","1594.5","0.7","300","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C19 H25 F O2 -","- C19 H25 F O2 -","- C76 H100 F4 O8 -","4","1","HH1019","Burns, J. H.; Hagaman, E. W.","Three monofluorinated small molecules: <i>ortho</i>-fluorophenylglycine, methyl 4-(fluorocarbonyl)benzoate and 16α-fluoro-α-estradiol 3-methyl ether","Acta Crystallographica Section C","1993","49","7","1393","1396","10.1107/S0108270193000605","","","0.71069","MoKα","","","0.033","","","0.043","","","","","1.36","1.36","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001554","12.248","0.002","8.637","0.001","10.934","0.003","90","","92.25","0.01","90","","1155.8","0.4","298","","","","","","","","","","","4","P 1 2/a 1","-P 2yab","","","","","- C14 H13 N O2 -","- C14 H12 N O2 -","- C56 H48 N4 O8 -","4","1","HH1028","Yeap, G.-Y.; Teo, S.-B.; Fun, H.-K.; Teoh, S.-G.","Structure of 4-[(3-methoxyphenylimino)methyl]phenol","Acta Crystallographica Section C","1993","49","7","1396","1398","10.1107/S0108270193000654","","","0.71069","MoKα","","","0.0526","","","0.0566","","","","","1.32","1.32","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001555","17.099","0.005","10.091","0.003","11.386","0.004","90","","92.09","0.03","90","","1963.3","1.1","294","","","","","","","","","","","5","A 1 2/a 1","-A 2ya","","","","","- C20 H20 I2 N2 O -","- C20 H20 I2 N2 O -","- C80 H80 I8 N8 O4 -","4","0.5","AS1030","Mori, Y.; Matsuyama, Y.; Suzuki, J.; Ishii, Y.; Yamada, S.; Maeda, K.","Structure of diiodide salts of <i>N</i>-heteroaromatic dications","Acta Crystallographica Section C","1993","49","7","1398","1401","10.1107/S0108270193000393","","","0.71068","MoKα","","","0.035","","","0.039","","","","","1.428","1.428","","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2001556","21.867","0.005","6.119","0.001","14.47","0.004","90","","90.52","0.03","90","","1936.1","0.8","294","","","","","","","","","","","4","A 1 2/a 1","-A 2ya","","","","","- C20 H18 I2 N2 -","- C20 H18 I2 N2 -","- C80 H72 I8 N8 -","4","0.5","AS1030","Mori, Y.; Matsuyama, Y.; Suzuki, J.; Ishii, Y.; Yamada, S.; Maeda, K.","Structure of diiodide salts of <i>N</i>-heteroaromatic dications","Acta Crystallographica Section C","1993","49","7","1398","1401","10.1107/S0108270193000393","","","0.71068","MoKα","","","0.039","","","0.04","","","","","1.401","1.401","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001557","12.9862","0.0005","6.4062","0.0005","14.0857","0.0012","90","","116.275","0.006","90","","1050.75","0.14","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C11 H9 N O4 -","- C11 H9 N O4 -","- C44 H36 N4 O16 -","4","1","HH1038","Garcia, J. G.; Enas, J. D.; Chang, E.; Fronczek, F. R.","Structure of 2-ethyl-2-nitroindan-1,3-dione","Acta Crystallographica Section C","1993","49","7","1401","1402","10.1107/S0108270193000976","","","1.54184","CuKα","","","0.041","","","0.054","","","","","2.565","2.565","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001558","9.609","0.002","5.087","0.001","15.923","0.002","90","","91.74","0.01","90","","778","0.2","296","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C7 H9 N3 O -","- C7 H9 N3 O -","- C28 H36 N12 O4 -","4","1","OH1004","Okabe, N.","Structure of 1-phenylsemicarbazide","Acta Crystallographica Section C","1993","49","7","1402","1404","10.1107/S0108270193000198","","","0.71069","MoKα","","","0.034","","","0.06","","","","","1.96","1.96","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001559","10.701","0.005","8.999","0.004","14.97","0.007","90","","110.56","0.04","90","","1349.8","1.1","293","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C13 H20 O4 -","- C13 H20 O4 -","- C52 H80 O16 -","4","1","HA1030","Soriano-García, M.; Iribe, R. V.; Silva, A. L.; Maldonado, L. A.","Structure of 1,4-diethyl-3,5-dimethoxy-1,4-dihydrobenzoic acid","Acta Crystallographica Section C","1993","49","7","1404","1406","10.1107/S0108270193000241","","","1.5418","CuKα","","","0.065","","","0.095","","","","","1.32","1.32","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001560","6.363","0.001","13.536","0.002","25.703","0.004","90","","91.74","0.03","90","","2212.8","0.6","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(±)-p-nitrobenzyl 2-(2,2-dimethyl-1-phenylpropylamino)-1-cyclopentene-1-carboxylate","","- C24 H28 N2 O4 -","- C24 H28 N2 O4 -","- C96 H112 N8 O16 -","4","1","PA1038","Chiaroni, A.; Riche, C.; Guingant, A.; d'Angelo, J.","The asymmetric Michael process involving chiral imines: structure of (±)-<i>p</i>-nitrobenzyl 2-(2,2-dimethyl-1-phenylpropylamino)-1-cyclopentene-1-carboxylate","Acta Crystallographica Section C","1993","49","7","1406","1409","10.1107/S0108270193000320","","","1.5418","CuKα","","","0.072","","","0.113","","","","","1.44","1.44","","","","","has coordinates","190731","2020-10-21","18:00:00",""
"2001561","20.529","0.002","17.075","0.002","11.82","0.001","90","","98.65","0.01","90","","4096.2","0.7","298","","298","","","","","","","","","6","A 1 2/a 1","-A 2ya","15","","1,3-acetonebis(triphenylphosphonium)(trifluoromethanesulfonate)","","- C41 H34 F6 O7 P2 S2 -","- C41 H34 F6 O7 P2 S2 -","- C164 H136 F24 O28 P8 S8 -","4","0.5","SH1045","Bram, A.; Burzlaff, H.; Hadawi, D.; Bestmann, H.-J.","Structure of 1,3-bis(triphenylphosphonium)acetone bis(trifluoromethanesulfonate)","Acta Crystallographica Section C","1993","49","7","1409","1410","10.1107/S0108270193001660","","","0.7093","MoKα~1~","","","0.061","","","0.059","","","","","1.49","1.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001562","8.1213","0.0007","17.514","0.003","18.903","0.003","90","0.01","90","0.009","90","0.01","2688.7","0.7","287","","287","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(α-hydroxybenzyl)-methyl-8-azabicyclo[3.2.1]octan-3-one","","- C15 H19 N O2 -","- C15 H19 N O2 -","- C120 H152 N8 O16 -","8","1","CD1010","Li, J.; Quail, J. W.; Zheng, G. Z.; Majewski, M.","Structure of 2-(α-hydroxybenzyl)-8-methyl-8-azabicyclo[3.2.1]octan-3-one","Acta Crystallographica Section C","1993","49","7","1410","1412","10.1107/S0108270192013581","","","1.5418","CuKα","","0.072","0.048","","0.062","0.059","","","","2.219","2.619","2.619","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001563","9.718","0.001","9.83","0.001","10.731","0.001","99.26","0.01","105.3","0.01","72.9","0.01","941.2","0.17","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H26 N4 O2 -","- C18 H26 N4 O2 -","- C36 H52 N8 O4 -","2","1","OH1014","Hirayama, N.; Nagahara, Y.; Shimada, J.; Suzuki, F.","Structure of 8-(dicyclopropylmethyl)-1,3-dipropylxanthine","Acta Crystallographica Section C","1993","49","7","1413","1414","10.1107/S0108270193000678","","","1.54184","CuKα","","","0.073","","","0.072","","","","","0.686","0.686","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001564","5.886","0.003","10.566","0.006","6.146","0.003","90","","111.6","0.04","90","","355.4","0.3","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- B H4 Na O4 -","- B H4 Na O4 -","- B4 H16 Na4 O16 -","4","1","MU1036","Csetenyi, L. J.; Glasser, F. P.; Howie, R. A.","Structure of sodium tetrahydroxyborate","Acta Crystallographica Section C","1993","49","6","1039","1041","10.1107/S0108270193000058","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001565","9.264","0.003","9.264","0.003","35.503","0.012","90","","90","","90","","3046.9","1.7","","","","","","","","","","","","6","P 43","P 43","","","","","- C25 H34 Cu N6 O8 S -","- C25 H28 Cu N7 O11 S -","- C100 H112 Cu4 N28 O44 S4 -","4","1","HU1013","Fritsky, I. O.; Lampeka, R. D.; Kravtsov, V. Kh.; Simonov, Y. A.","Structure of <i>catena</i>-poly[tris(pyridine)copper-μ-{<i>N</i>-(2-hydroxyiminopropionyl)-<small>L</small>-methioninato(1‒)-<i>O</i>'',<i>N</i>':<i>O</i>}] nitrate ethanol solvate","Acta Crystallographica Section C","1993","49","6","1041","1044","10.1107/S0108270192012836","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001566","10.882","0.004","12.127","0.004","12.986","0.004","90","","90","","90","","1713.7","1","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C18 H15 Cl2 Sb -","- C18 H15 Cl2 Sb -","- C72 H60 Cl8 Sb4 -","4","1","AL1016","Begley, M. J.; Sowerby, D. B.","Structures of triphenylantimony(V) dibromide and dichloride","Acta Crystallographica Section C","1993","49","6","1044","1046","10.1107/S0108270192011958","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001567","24.179","0.008","10.282","0.003","14.234","0.005","90","","90","","90","","3539","2","","","","","","","","","","","","4","F d d 2","F 2 -2d","","","","","- C18 H15 Br2 Sb -","- C18 H15 Br2 Sb -","- C144 H120 Br16 Sb8 -","8","0.5","AL1016","Begley, M. J.; Sowerby, D. B.","Structures of triphenylantimony(V) dibromide and dichloride","Acta Crystallographica Section C","1993","49","6","1044","1046","10.1107/S0108270192011958","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001568","8.416","0.002","15.423","0.005","8.679","0.003","90","","110.08","0.05","90","","1058.1","0.7","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Cu2 N8 O8 -","- C12 H32 Cu2 N8 O8 -","- C24 H64 Cu4 N16 O16 -","2","0.5","AL0493","Begley, M. J.; Hubberstey, P.; Spittle, P. H.; Walton, P. H.","Structure of tetrakis(μ-acetato-5κ<i>O</i>:κ<i>O</i>')-bis(2-cyano-κ<i>N</i>-guanidine)dicopper(II)","Acta Crystallographica Section C","1993","49","6","1047","1049","10.1107/S0108270192005122","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001569","8.848","0.002","9.375","0.001","11.906","0.002","74.1","0.01","74.36","0.01","83.43","0.01","913.8","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H12 Cl2 Co N8 -","- C16 H12 Cl2 Co N8 -","- C32 H24 Cl4 Co2 N16 -","2","1","NA1021","De Munno, G.; Nicolò, F.; Julve, M.","Structure of bis(2,2'-bipyrimidine-<i>N</i>,<i>N</i>')dichlorocobalt(II), [Co(bpm)~2~Cl~2~]","Acta Crystallographica Section C","1993","49","6","1049","1052","10.1107/S0108270192013192","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001570","9.22","0.005","11.493","0.002","12.433","0.003","102.74","0.02","90.82","0.03","93.25","0.03","1282.5","0.8","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C26 H22 Cl9 N2 O2 Re6 S17 -","- C26 H22 Cl6 N2 O2 Re6 S20 -","- C26 H22 Cl6 N2 O2 Re6 S20 -","1","0.5","DU1024","Gabriel, J.-C.; Johannsen, I.; Batail, P.; Coulon, C.","A novel type of two-dimensional pattern of association of mixed-valence dimers in the structures of two cation radical salts of thieno- and selenolo[3,4-<i>d</i>]-1,3-dithiol-2-ylidene and a monovalent hexanuclear chalcohalide rhenium cluster anion","Acta Crystallographica Section C","1993","49","6","1052","1056","10.1107/S0108270193001076","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001571","9.245","0.001","11.576","0.002","12.433","0.002","102.75","0.01","90.72","0.01","93.21","0.01","1295.3","0.3","","","","","","","","","","","","8","P -1","-P 1","2","","","","- C26 H22 Cl9 N2 O2 Re6 S13 Se4 -","- C26 H22 Cl6 N2 O2 Re6 S16 Se4 -","- C26 H22 Cl6 N2 O2 Re6 S16 Se4 -","1","0.5","DU1024","Gabriel, J.-C.; Johannsen, I.; Batail, P.; Coulon, C.","A novel type of two-dimensional pattern of association of mixed-valence dimers in the structures of two cation radical salts of thieno- and selenolo[3,4-<i>d</i>]-1,3-dithiol-2-ylidene and a monovalent hexanuclear chalcohalide rhenium cluster anion","Acta Crystallographica Section C","1993","49","6","1052","1056","10.1107/S0108270193001076","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001572","16.493","0.003","13.691","0.004","21.422","0.008","90","","111.2","0.02","90","","4510","2","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H69 B Fe N2 P4 -","- C44 H69 B Fe N2 P4 -","- C176 H276 B4 Fe4 N8 P16 -","4","1","HL1022","Buys, I. E.; Field, L. D.; Hambley, T. W.; McQueen, A. E. D.","Structure of [FeH(N~2~){(H~5~C~2~)~2~PCH~2~CH~2~P(C~2~H~5~)~2~}~2~]BPh~4~","Acta Crystallographica Section C","1993","49","6","1056","1059","10.1107/S0108270193000903","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001573","10.253","0.003","12.765","0.003","13.407","0.003","63.42","0.02","82.38","0.02","80.8","0.02","1545.4","0.7","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C60 H68 Br2 Hg2 Li2 O8 P4 -","- C30 H34 Br Hg Li O4 P2 -","- C60 H68 Br2 Hg2 Li2 O8 P4 -","2","1","CR1029","Kresinski, R. A.; Fackler, Jnr, J. P.","Structure of diaquadibromobis(tetrahydrofuran)dilithium–tetrakis(methyleneoxydiphenylphosphinato)dimercury(II), [Hg(Br){CH~2~P(O)Ph~2~}~2~Li(H~2~O)(C~4~H~8~O)]~2~","Acta Crystallographica Section C","1993","49","6","1059","1061","10.1107/S0108270193000551","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001574","7.692","0.002","10.565","0.001","15.057","0.003","90","","98.99","0.01","90","","1208.6","0.4","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H15 Ir O2 -","- C12 Ir O2 -","- C48 Ir4 O8 -","4","1","HH0570","Chen, J.; Daniels, L. M.; Angelici, R. J.","Structure of dicarbonyl(η^5^-pentamethylcyclopentadienyl)iridium","Acta Crystallographica Section C","1993","49","6","1061","1063","10.1107/S0108270193000630","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001575","12.145","0.002","13.832","0.003","14.624","0.004","90","","90","","90","","2456.7","0.9","","","","","","","","","","","","6","P b n a","-P 2ac 2b","","","","","- C12 H32 Cl3 Cr N6 O12 -","- C6 Cl1.5 Cr0.5 N3 O6 -","- C48 Cl12 Cr4 N24 O48 -","8","1","BR1007","Beveridge, K. A.; Heyd, D.; Kirk, A. D.","Structure of <i>cis</i>-(1,2-ethanediamine)(1,4,8,11-tetraazacyclotetradecane)chromium(III) perchlorate","Acta Crystallographica Section C","1993","49","6","1063","1066","10.1107/S0108270193002033","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001576","10.871","0.006","21.962","0.01","11.65","0.006","90","","110.11","0.04","90","","2612","2","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C28 H24 Cl4 Pb -","- C28 H24 Cl4 Pb -","- C112 H96 Cl16 Pb4 -","4","1","SH1031","Fahrenkampf, U.; Schürmann, M.; Huber, F.","Tetrakis(2-chlorobenzyl)lead","Acta Crystallographica Section C","1993","49","6","1066","1068","10.1107/S010827019300157X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001577","37.912","0.003","9.286","0.001","17.482","0.003","90","","90","","90","","6154.6","1.3","","","","","","","","","","","","6","P n a 21","P 2c -2n","","","","","- C28 H44 N O Re S4 -","- C28 H44 N O Re S4 -","- C224 H352 N8 O8 Re8 S32 -","8","2","SH1033","Hübener, R.; Abram, U.","Structure of tetrabutylammonium bis[benzene-1,2-dithiolato(2‒)]oxorhenate(V)","Acta Crystallographica Section C","1993","49","6","1068","1070","10.1107/S0108270193001568","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001578","10.3997","0.0014","4.6395","0.0012","18.2211","0.0011","90","","100.994","0.007","90","","863","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H11 N3 O -","- C8 H11 N3 O -","- C32 H44 N12 O4 -","4","1","BR1006","Jean-Claude, B. J.; Britten, J. F.; Just, G.","Structure of <i>N</i>-(2-aminophenyl)-<i>N</i>'-methylurea","Acta Crystallographica Section C","1993","49","6","1070","1072","10.1107/S0108270192012290","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001579","11.429","0.001","14.39","0.004","19.459","0.003","70.49","0.02","78.14","0.01","69.69","0.02","2814.4","1","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C27 H35 O11 P -","- C27 H32.5 O11 P -","- C108 H130 O44 P4 -","4","2","HA1027","Chaloner, P. A.; Harrison, R. M.; Hitchcock, P. B.","Structure of tris(2,4,6-trimethoxyphenyl)phosphine oxide hydrate","Acta Crystallographica Section C","1993","49","6","1072","1075","10.1107/S010827019300023X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001580","18.787","0.007","43.46","0.02","5.828","0.002","90","","90","","90","","4758","3","","","","","","","","","","","","4","F d d 2","F 2 -2d","","","","","- C14 H12 O S -","- C14 H12 O S -","- C224 H192 O16 S16 -","16","1","CR1026","Li, Z.; Su, G.","Thiophene chalcone","Acta Crystallographica Section C","1993","49","6","1075","1077","10.1107/S0108270192013441","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001581","6.133","0.001","8.834","0.002","20.653","0.003","90","","90","","90","","1119","0.4","","","","","","","","","","","","5","P b c 21","P 2c -2b","","","","","- C9 H10 Cl2 N2 O2 -","- C9 H10 Cl2 N2 O2 -","- C36 H40 Cl8 N8 O8 -","4","1","DU1020","Cadiergue, H.; Pèpe, G.; Astier, J. P.; Boistelle, R.; Fiard, J. F.","Structure of linuron, 3-(3,4-dichlorophenyl)-1-methoxy-1-methylurea","Acta Crystallographica Section C","1993","49","6","1078","1080","10.1107/S0108270192012976","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001582","11.749","0.007","7.083","0.004","28.76","0.02","90","","97.15","0.06","90","","2375","3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H39 Cl N2 O3 -","- C24 H39 Cl N2 O3 -","- C96 H156 Cl4 N8 O12 -","4","1","KA1006","Kettmann, V.; Sivý, J.; Frešová, E.; Gregáň, F.","Structure of <i>cis</i>-1-{2-[(2-butoxy)phenylcarbamoyloxy]cycloheptylmethyl}piperidinium chloride","Acta Crystallographica Section C","1993","49","6","1080","1082","10.1107/S0108270192012939","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001583","25.744","0.003","7.889","0.001","7.442","0.001","90","","91.61","0.01","90","","1510.8","0.3","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C34 H20 N6 O12 -","- C34 H20 N6 O12 -","- C68 H40 N12 O24 -","2","0.5","CR1016","Zacharias, D. E.","Structures of three electron donor‒acceptor complexes of dibenz[<i>a</i>,<i>h</i>]anthracene (DBA)","Acta Crystallographica Section C","1993","49","6","1082","1087","10.1107/S0108270192013325","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2001584","20.784","0.002","7.357","0.001","7.524","0.001","90","","97.71","0.01","90","","1140.1","0.2","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32 H16 O6 -","- C32 H16 O6 -","- C64 H32 O12 -","2","0.5","CR1016","Zacharias, D. E.","Structures of three electron donor–acceptor complexes of dibenz[<i>a</i>,<i>h</i>]anthracene (DBA)","Acta Crystallographica Section C","1993","49","6","1082","1087","10.1107/S0108270192013325","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001585","19.991","0.004","8.324","0.002","7.821","0.002","90","","105.06","0.02","90","","1256.8","0.5","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","","","","","- C36 H18 O6 -","- C36 H18 O6 -","- C72 H36 O12 -","2","0.5","CR1016","Zacharias, D. E.","Structures of three electron donor‒acceptor complexes of dibenz[<i>a</i>,<i>h</i>]anthracene (DBA)","Acta Crystallographica Section C","1993","49","6","1082","1087","10.1107/S0108270192013325","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2001586","11.745","0.004","7.6","0.004","21.929","0.006","90","","118.36","0.04","90","","1722.5","1.3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C20 H15 N3 S -","- C20 H15 N3 S -","- C80 H60 N12 S4 -","4","1","HU1022","Cheung, K.-K.; Echevarria, A.; Galembeck, S.; Maciel, M. A. M.; Miller, J.; Rumjanek, V. M.; Simas, A. M.","Mesoionic compounds. 4. Structure of 1,4,5-triphenyl-1,2,4-triazolium-3-thiolate","Acta Crystallographica Section C","1993","49","6","1092","1094","10.1107/S0108270192012642","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001587","4.691","0.001","14.448","0.002","12.924","0.003","90","","97.63","0.01","90","","868.2","0.3","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H21 N3 O6 -","- C16 H17 N3 O7 -","- C32 H34 N6 O14 -","2","1","HL1026","Gulbis, J. M.; Mackay, M. F.; Holan, G.; Marcuccio, S. M.","Structure of a dideoxynucleoside active against the HIV (AIDS) virus","Acta Crystallographica Section C","1993","49","6","1095","1097","10.1107/S0108270193002094","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001588","8.44","0.001","11.723","0.002","13.016","0.002","67.17","0.01","76.08","0.1","71.4","0.01","1114.8","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","cis,syn,cis-tricyclo[6.4.0.0^2,7^]-dodecan-2,3,8-triol","","- C12 H20 O3 -","- C12 H20 O3 -","- C48 H80 O12 -","4","2","KA1008","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Brosse, N.; Caubère, P.","Structures of some methylenecyclobutanols and transposed derivatives","Acta Crystallographica Section C","1993","49","6","1098","1103","10.1107/S0108270192012927","","","1.54178","X-rayCuKαmean","","","0.0462","","","0.055","","","","","1.5653","1.5653","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001589","11.688","0.002","12.208","0.003","24.328","0.006","90","","90.98","0.01","90","","3470.8","1.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","cis,syn,cis-8-methoxy-2,3-dimethyl-sulfonyl-tricyclo[6.3.0.0^2,7^]-undecane","","- C14 H24 O7 S2 -","- C14 H24 O7 S2 -","- C112 H192 O56 S16 -","8","1","KA1008","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Brosse, N.; Caubère, P.","Structures of some methylenecyclobutanols and transposed derivatives","Acta Crystallographica Section C","1993","49","6","1098","1103","10.1107/S0108270192012927","","","1.54178","X-rayCuKαmean","","","0.061","","","0.0837","","","","","2.6338","2.6338","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2001590","14.317","0.002","12.02","0.002","6.49","0.001","90","","90","","90","","1116.9","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","cis,syn,cis-1-methoxy-tricyclo[6.3.0.0^2,6^]undecan-7-ol","","- C12 H20 O2 -","- C12 H20 O2 -","- C48 H80 O8 -","4","1","KA1008","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Brosse, N.; Caubère, P.","Structures of some methylenecyclobutanols and transposed derivatives","Acta Crystallographica Section C","1993","49","6","1098","1103","10.1107/S0108270192012927","","","1.54178","X-rayCuKαmean","","","0.0412","","","0.0534","","","","","0.6603","0.6603","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001591","18.805","0.002","6.318","0.001","9.988","0.001","90","","112.41","0.01","90","","1097.1","0.2","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C27 H26 O5 -","- C27 H26 O5 -","- C54 H52 O10 -","2","1","AB1039","Iversen, B. B.; Møller, E. R.; Krogh, L.; Holm, M. F.; Dynesen, E.; Larsen, F. K.; Hazell, R. G.","Two structures involved in the separation of the enantiomeric pair of 2,2'-spirobi[indan]-1,1'-dione","Acta Crystallographica Section C","1993","49","6","1104","1107","10.1107/S010827019300071X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001592","18.551","0.002","6.495","0.001","9.448","0.001","90","","96.521","0.009","90","","1131","0.2","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C27 H26 O5 -","- C27 H26 O5 -","- C54 H52 O10 -","2","1","AB1039","Iversen, B. B.; Møller, E. R.; Krogh, L.; Holm, M. F.; Dynesen, E.; Larsen, F. K.; Hazell, R. G.","Two structures involved in the separation of the enantiomeric pair of 2,2'-spirobi[indan]-1,1'-dione","Acta Crystallographica Section C","1993","49","6","1104","1107","10.1107/S010827019300071X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001593","4.118","0.002","6.274","0.004","34.672","0.002","90","","90.32","","90","","895.8","0.7","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 I O2 -","- C9 H6 I O2 -","- C36 H24 I4 O8 -","4","1","GR1002","Goud, B. S.; Pathaneni, S. S.; Desiraju, G. R.","Structure of 4-iodo-<i>trans</i>-cinnamic acid and a study of carboxyl group disorder","Acta Crystallographica Section C","1993","49","6","1107","1111","10.1107/S0108270192011168","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001594","14.508","0.008","6.095","0.004","9.532","0.005","90","","97.93","0.04","90","","834.8","0.8","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C4 H12 N O3 P S -","- C4 H12 N O3 P S -","- C16 H48 N4 O12 P4 S4 -","4","1","HA0067","Sawka-Dobrowolska, W.; Matczak-Jon, E.; Dembkowski, L.","Structure of 1-amino-3-(methylthio)propylphosphonic acid","Acta Crystallographica Section C","1993","49","6","1111","1113","10.1107/S0108270192003937","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001595","6.593","0.003","6.755","0.002","23.653","0.004","90","","90","","90","","1053.4","0.6","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C10 H16 N2 O2 -","- C10 H16 N2 O2 -","- C40 H64 N8 O8 -","4","1","MU1011","Verbruggen, M.; Lenstra, A. T. H.; Reyniers, F.; Borremans, F.","(3<i>R</i>,6<i>R</i>)-3,4-Dimethyl-1,4-diazabicyclo[4.4.0]decane-2,5-dione","Acta Crystallographica Section C","1993","49","6","1113","1116","10.1107/S010827019201059X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2001596","16.9","0.02","16.9","0.02","33.31","0.03","90","","90","","90","","9514","18","","","","","","","","","","","","5","I 41 c d","I 4bw -2c","110","","","","- C51.5 H44 Cl2 Ir2 N4 -","- C55 H40 Cl2 Ir2 N4 -","- C440 H320 Cl16 Ir16 N32 -","8","0.5","CR1031","Garces, F. O.; Dedeian, K.; Keder, N. L.; Watts, R. J.","Structures of <i>ortho</i>-metalated [2-(<i>p</i>-tolyl)pyridine]iridium(III) complexes","Acta Crystallographica Section C","1993","49","6","1117","1120","10.1107/S0108270193000836","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205964","2020-10-21","18:00:00",""
"2001597","15.0144","0.0007","15.0144","0.0007","25.829","0.001","90","","90","","120","","5042.6","0.4","","","","","","","","","","","","4","R 3 :H","R 3","146","","","","- C36 H30 Ir N3 -","- C18 H15 Ir0.5 N1.5 -","- C108 H90 Ir3 N9 -","6","0.666667","CR1031","Garces, F. O.; Dedeian, K.; Keder, N. L.; Watts, R. J.","Structures of <i>ortho</i>-metalated [2-(<i>p</i>-tolyl)pyridine]iridium(III) complexes","Acta Crystallographica Section C","1993","49","6","1117","1120","10.1107/S0108270193000836","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205963","2020-10-21","18:00:00",""
"2001598","6.62","0.01","9.99","0.01","10.4","0.01","118.4","0.1","95.3","0.1","102.8","0.1","574.1","1.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H16 Cu2 N8 O4 -","- C24 H16 Cu2 N8 O4 -","- C24 H16 Cu2 N8 O4 -","1","0.5","MU1023","Kabešová, M.; Jorík, V.; Dunaj-Jurčo, M.","Structure of bis[(bipyridyl)dicyanatocopper(II)](<i>Cu</i>–<i>Cu</i>)","Acta Crystallographica Section C","1993","49","6","1120","1121","10.1107/S0108270192012903","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001599","13.299","0.004","13.343","0.004","13.051","0.005","106.24","0.03","119.04","0.02","81.41","0.03","1943.7","1.2","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C84 H60 N2 Ni6 O12 P4 -","- C84 H60 N2 Ni6 O12 P4 -","- C84 H60 N2 Ni6 O12 P4 -","1","0.5","HH1042","Bachman, R. E.; Whitmire, K. H.","Bis[bis(triphenylphosphine)iminium] dodecacarbonylhexanickelate","Acta Crystallographica Section C","1993","49","6","1121","1123","10.1107/S0108270193001830","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001600","9.1267","0.0012","11.955","0.001","8.783","0.001","93.08","0.01","117.7","0.01","85.49","0.01","845.69","0.18","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C19 H22 O3 S -","- C19 H22 O3 S -","- C38 H44 O6 S2 -","2","1","AS0585","Okada, K.; Koyama, H.","Structure of 17β-acetoxy-18-methyl-1-thia-<i>A</i>-norestra-3,9(10),11-trien-2-one","Acta Crystallographica Section C","1993","49","6","1123","1125","10.1107/S0108270192011077","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001601","17.615","0.001","15.4","0.002","13.786","0.002","90","","90","","90","","3739.7","0.8","","","","","","","","","","","","5","P b c a","","","","","","- C20 H25 Cl N2 O3 -","- C20 H25 Cl N2 O3 -","- C160 H200 Cl8 N16 O24 -","8","1","AS0505","Okamoto, K.; Fujii, S.; Tomita, K.","1-[3-(3,4-Methylenedioxyphenoxy)propyl]-4-phenylpiperazine monohydrochloride","Acta Crystallographica Section C","1993","49","6","1125","1127","10.1107/S0108270193001763","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","190731","2020-10-21","18:00:00",""
"2001602","18.479","0.002","9.294","0.001","18.126","0.002","90","","99.41","0.01","90","","3071.1","0.6","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","","","","","- C31 H48 S2 -","- C31 H48 S2 -","- C124 H192 S8 -","4","0.5","SH1011","Hiller, W.; Rundel, W.","Structure of 2,2-bis(3,5-di-<i>tert</i>-butylphenyl)propane-2',2''-dithiol","Acta Crystallographica Section C","1993","49","6","1127","1128","10.1107/S0108270193001088","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001603","10.599","0.002","6.861","0.001","11.889","0.004","90","","100.6","0.2","90","","849.8","0.7","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C5 H6 O2 S3 Se -","- C5 H6 O2 S3 Se -","- C20 H24 O8 S12 Se4 -","4","1","NA1018","Molins, E.; Veciana, J.; Miravitlles, C.","Structure of 2-selenoxoperhydro-2<i>H</i>-thieno[3,4-<i>d</i>][1,3]dithiole 5,5-dioxide","Acta Crystallographica Section C","1993","49","6","1129","1130","10.1107/S0108270193001799","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001604","11.631","0.007","9.929","0.002","8.99","0.002","90","","97.63","0.04","90","","1029","0.7","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","distrontium nickel orthophosphate","","- Ni O8 P2 Sr2 -","- Ni O8 P2 Sr2 -","- Ni6 O48 P12 Sr12 -","6","1.5","HH1013","Elbali, B.; Boukhari, A.; Holt, E. M.; Aride, J.","Distrontium nickel orthophosphate","Acta Crystallographica Section C","1993","49","6","1131","1133","10.1107/S0108270192012599","","","0.71069","MoKα","","","0.062","","","0.084","","","","","0.42","0.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001605","9.118","0.001","9.118","0.001","3.3035","0.0009","90","","90","","120","","237.85","0.07","295","","","","","","","","","","","2","P 63/m","-P 6c","","","","","- S4 V3 -","- S4 V3 -","- S8 V6 -","2","0.166667","SH1019","Bensch, W.; Koy, J.","Structure of hexagonal V~3~S~4~ determined at three different temperatures","Acta Crystallographica Section C","1993","49","6","1133","1135","10.1107/S0108270192012368","","","0.71073","MoKα","","","0.028","","","0.0233","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001606","9.104","0.002","9.104","0.002","3.2973","0.0008","90","","90","","120","","236.68","0.09","170","","","","","","","","","","","2","P 63/m","-P 6c","","","","","- S4 V3 -","- S4 V3 -","- S8 V6 -","2","0.166667","SH1019","Bensch, W.; Koy, J.","Structure of hexagonal V~3~S~4~ determined at three different temperatures","Acta Crystallographica Section C","1993","49","6","1133","1135","10.1107/S0108270192012368","","","0.71073","MoKα","","","0.0294","","","0.0237","","","","","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001607","9.099","0.001","9.099","0.001","3.297","0.0008","90","","90","","120","","236.39","0.07","100","","","","","","","","","","","2","P 63/m","-P 6c","","","","","- S4 V3 -","- S4 V3 -","- S8 V6 -","2","0.166667","SH1019","Bensch, W.; Koy, J.","Structure of hexagonal V~3~S~4~ determined at three different temperatures","Acta Crystallographica Section C","1993","49","6","1133","1135","10.1107/S0108270192012368","","","0.71073","MoKα","","","0.0298","","","0.0213","","","","","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001608","21.957","0.005","6.147","0.003","19.925","0.004","90","","122.4","0.01","90","","2270.6","1.3","296","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","","","","","- I Nb4 Te12 -","- I Nb4 Te12 -","- I4 Nb16 Te48 -","4","0.5","AB1041","Deng, S.; Zhuang, H.; Lu, C.; Huang, Jinshun; Huang, Jingling","A new type of one-dimensional compound: structure of Nb~4~(Te~2~)~4~Te~4~I","Acta Crystallographica Section C","1993","49","6","1135","1137","10.1107/S010827019201285X","","","0.71073","Mo","","","0.052","","","0.062","","","","","1.26","1.26","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001609","9.914","0.003","30.95","0.01","18.145","0.005","90","","95.2139","0.0004","90","","5545","3","298","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C34 H36 Th -","- C34 H36 Th -","- C272 H288 Th8 -","8","2","MU1017","Spirlet, M. R.; Rebizant, J.; Bettonville, S.; Goffart, J.","Tris[(1,2,3-η)-1-ethylindenyl]methylthorium(IV)","Acta Crystallographica Section C","1993","49","6","1138","1140","10.1107/S0108270192012897","","","0.71069","MoKα","","","0.053","","","0.068","","","","","1.595","1.595","","","","","has coordinates","189071","2020-10-21","18:00:00",""
"2001610","9.025","0.004","10.093","0.004","11.987","0.006","110.6","0.03","94.22","0.04","103.47","0.03","979.3","0.8","197","","296","","","","","","","","","5","P -1","-P 1","2","","catena-Poly[(chlorocopper)‒bis-μ-{1,2-bis(dimethylphosphino)ethane-P:P'}- (chlorocopper)-μ-{1,2-bis(dimethylphosphino)ethane-P:P'}] bis(dichloromethane) solvate","","- C20 H52 Cl6 Cu2 P6 -","- C20 H52 Cl6 Cu2 P6 -","- C20 H52 Cl6 Cu2 P6 -","1","0.5","ST1042","Reibenspies, J. H.; Darensbourg, D. J.; Longridge, E. M.","Structure of [Cu~2~(dmpe)~3~Cl~2~]~<i>n~</i>.2CH~2~Cl~2~","Acta Crystallographica Section C","1993","49","6","1140","1142","10.1107/S0108270192013015","","","0.71073","MoKα","","0.1114","0.0614","","0.0789","0.0662","","","","","1.9137","1.9137","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001611","8.971","0.001","22.501","0.003","17.191","0.003","90","","102.97","","90","","3381.6","0.8","293","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","","","","","- C30 H15 Au O12 P Rh3 Ru -","- C30 H15 Au O12 P Rh3 Ru -","- C120 H60 Au4 O48 P4 Rh12 Ru4 -","4","1","AB1029","Pursiainen, J.; Pakkanen, T. A.; Ahlgrén, M.; Valkonen, J.","Structures of the monoclinic form of Ph~3~PAuRuRh~3~(CO)~12~ (I) and its cubic form with Ru~3~(CO)~12~ (II)","Acta Crystallographica Section C","1993","49","6","1142","1146","10.1107/S0108270192012575","","","0.71073","MoKα","","","0.027","","","0.027","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001612","20.647","0.003","20.647","0.003","20.647","0.003","90","","90","","90","","8802","2","293","","","","","","","","","","","7","P a -3","-P 2ac 2ab 3","205","","","","- C36 H15 Au O18 P Rh3 Ru3 -","- C36 H15 Au O18 P Rh3 Ru2.5 -","- C288 H120 Au8 O144 P8 Rh24 Ru20 -","8","0.333333","AB1029","Pursiainen, J.; Pakkanen, T. A.; Ahlgrén, M.; Valkonen, J.","Structures of the monoclinic form of Ph~3~PAuRuRh~3~(CO)~12~ (I) and its cubic form with Ru~3~(CO)~12~ (II)","Acta Crystallographica Section C","1993","49","6","1142","1146","10.1107/S0108270192012575","","","0.71073","MoKα","","","0.033","","","0.033","","","","","","","","","","","has coordinates","206079","2020-10-21","18:00:00",""
"2001613","12.158","0.002","12.689","0.002","13.822","0.001","86.67","0.01","65.15","0.01","78.65","0.01","1896.4","0.5","295","","","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H34 Cl3 O6 P2 Rh -","- C38 H34 Cl3 O6 P2 Rh -","- C76 H68 Cl6 O12 P4 Rh2 -","2","1","HU1027","Cross, R. J.; Kennedy, A. R.; Manojlović-Muir, L.; Muir, K. W.","Structure of <i>trans</i>-[Rh(PPh~3~)~2~(CO)(OH~2~)][ClO~4~].CH~2~Cl~2~","Acta Crystallographica Section C","1993","49","6","1146","1148","10.1107/S0108270192012666","","","0.71069","MoKα","","","0.0481","","","0.0617","","","","","2.91","2.91","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001614","14.904","0.005","23.169","0.007","9.262","0.003","90","","90","","90","","3198.3","1.8","178","","","","","","","","","","","6","P 1 1 2","P 2","3","","","","- C72 H60 Ag2 N2 O6 P4 -","- C36 H30 Ag N O3 P2 -","- C72 H60 Ag2 N2 O6 P4 -","2","1","HA1025","Jones, P. G.","Di-μ-nitrato-bis[bis(triphenylphosphine)silver(I)], [(Ph~3~P)~2~AgNO~3~]~2~, at 178 K","Acta Crystallographica Section C","1993","49","6","1148","1150","10.1107/S0108270192012484","","","0.71069","MoKα","","","0.04","","","0.035","","","","","1.1","1.1","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001615","7.2425","0.0006","8.676","0.001","10.592","0.001","90","","90","","90","","665.56","0.11","297","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C4 H7 Na O7 -","- C4 H7 Na O7 -","- C16 H28 Na4 O28 -","4","1","HL1015","Bott, R. C.; Sagatys, D. S.; Lynch, D. E.; Smith, G.; Kennard, C. H. L.","Structure of sodium hydrogen (+)-tartrate monohydrate","Acta Crystallographica Section C","1993","49","6","1150","1152","10.1107/S0108270192012605","","","0.71073","MoKα","","","0.021","","","0.024","","","","","0.94","0.94","","","","","has coordinates","213984","2020-10-21","18:00:00",""
"2001616","14.953","0.001","12.428","0.001","14.228","0.001","90","","91.778","0.007","90","","2642.8","0.3","298","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C22 H28 Cl2 N4 O8 Pt -","- C22 H28 Cl2 N4 O8 Pt -","- C88 H112 Cl8 N16 O32 Pt4 -","4","0.5","ST1033","Sommerer, S. O.; Abboud, K. A.","Structure of di-2-pyridyl ketone-hydrate platinum(II) chloride tetrahydrate","Acta Crystallographica Section C","1993","49","6","1152","1154","10.1107/S0108270192012496","","","0.71073","MoKα","","","0.035","","","0.033","","","","","1.37","1.37","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001617","9.17","0.002","4.83","0.001","22.584","0.009","90","","90.74","0.02","90","","1000.2","0.5","296","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C6 H10 Ge2 O7 -","- C6 H10 Ge2 O7 -","- C24 H40 Ge8 O28 -","4","0.5","AS1022","Xie, Z.-X.; Hu, S.-Z.; Chen, Z.-H.; Li, S.-A.; Shi, W.-P.","Redetermination of the structure of polymeric carboxyethylgermanium sesquioxide","Acta Crystallographica Section C","1993","49","6","1154","1156","10.1107/S0108270192012435","","","0.71073","MoKα","","","0.0513","","","0.0606","","","","","5.542","5.542","","","","","has coordinates","198852","2020-10-21","18:00:00",""
"2001618","16.24","0.002","7.272","0.001","7.987","0.002","90","","116.44","0.01","90","","844.6","0.3","296","","","","","","","","","","","6","C 1 2 1","C 2y","","","","","- C3 H7 Cd Cl2 N O2 -","- C3 Cd Cl2 N O2 -","- C12 Cd4 Cl8 N4 O8 -","4","1","ST1025","Schaffers, K. I.; Keszler, D. A.","Structure of CdCl~2~.C~3~H~7~NO~2~","Acta Crystallographica Section C","1993","49","6","1156","1158","10.1107/S0108270192011570","","","0.71069","MoKα","","","0.063","","","0.088","","","","","1.95","1.95","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001619","13.63","0.006","11.775","0.002","16.316","0.008","90","","108.26","0.03","90","","2486.7","1.7","295","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C44 H54 Cl5 Mn N8 O9 -","- C44 H36 Cl6 Mn N8 O8 -","- C88 H72 Cl12 Mn2 N16 O16 -","2","0.5","HE1001","Prince, S.; Körber, F.; Cooke, P. R.; Lindsay Smith, J. R.; Mazid, M. A.","Structure of monomeric hydrated manganese(III) tetra(4-<i>N</i>-methylpyridyl)porphyrin pentachloride","Acta Crystallographica Section C","1993","49","6","1158","1160","10.1107/S0108270193000447","","","0.71069","MoKα","","","0.047","","","0.053","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001620","11.624","0.001","17.244","0.002","18.877","0.001","79.884","0.008","84.812","0.006","75.398","0.009","3600.4","0.6","130","","130","","","","","","","","","5","P -1","-P 1","2","","(2,4-Pentanedionato-O,O')bis(phenyl 3,3',5,5'-tetra-tert-butyl-1,1'-biphenyl-2,2'-diyl phosphite-P)rhodium","","- C87 H113 O8 P2 Rh -","- C80 H105 O8 P2 Rh -","- C160 H210 O16 P4 Rh2 -","2","1","AB1032","Meetsma, A.; Jongsma, T.; Challa, G.; van Leeuwen, P. W. N. M.","Structure of (2,4-pentanedionato-<i>O</i>,<i>O</i>')bis(phenyl 3,3',5,5'-tetra-<i>tert</i>-butyl-1,1'-biphenyl-2,2'-diyl phosphite-<i>P</i>)rhodium","Acta Crystallographica Section C","1993","49","6","1160","1163","10.1107/S0108270192013246","","","0.71073","MoKα","","","0.042","","0.046","0.046","","","","","1.842","1.842","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2001621","8.552","0.001","8.552","0.001","17.064","0.002","90","","90","","120","","1080.8","0.2","293","","293","","","","","","","","","7","P 63 2 2","","","Cobalt(III)sepulchrate perchlorate thiosulphate","(1,3,6,8,10,13,16,19-octaazabicyclo[6.6.6]eicosane)cobalt(III)perchlorate thiosulphate","","- C12 H30 Cl Co N8 O7 S2 -","- C12 H30 Cl Co N8 O14 S3 -","- C24 H60 Cl2 Co2 N16 O28 S6 -","2","0.166667","AL1026","Bacchi, A.; Ferranti, F.; Pelizzi, G.","Structures of two cobalt(III) sepulchrate complexes","Acta Crystallographica Section C","1993","49","6","1163","1169","10.1107/S0108270192012265","","","0.7107","MoKα","","","0.0897","","","0.0968","","","","","2.49","2.49","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001622","15.143","0.003","18.277","0.004","15.191","0.003","90","","109.55","0.02","90","","3962","1.5","293","","293","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","Racemic Cobalt(III)sepulchrate trichloride monohydrate","(1,3,6,8,10,13,16,19-octaazabicyclo[6.6.6]eicosane)cobalt(III)trichloride monohydrate","","- C12 H32 Cl3 Co N8 O -","- C12 H32 Cl3 Co N8 O -","- C96 H256 Cl24 Co8 N64 O8 -","8","2","AL1026","Bacchi, A.; Ferranti, F.; Pelizzi, G.","Structures of two cobalt(III) sepulchrate complexes","Acta Crystallographica Section C","1993","49","6","1163","1169","10.1107/S0108270192012265","","","0.7107","MoKα","","","0.0405","","","0.0416","","","","","2.55","2.55","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001623","18.414","0.002","16.938","0.002","22.577","0.002","90","","96.966","0.007","90","","6989.7","1.3","291","","","","","","","","","","","8","C 1 2/c 1","-C 2yc","","","","","- C75 H70 B2 Cl2 F8 O3 P4 Pd2 -","- C75 H68 B2 Cl2 F8 O3 P4 Pd2 -","- C300 H272 B8 Cl8 F32 O12 P16 Pd8 -","4","0.5","AB1035","Ganguly, S.; Georgiev, E. M.; Mague, J. T.; Roundhill, D. M.","Structure of di-μ-chloro-bis[bis(triphenylphosphine)palladium(II)] bis(tetrafluoroborate) acetone solvate dihydrate","Acta Crystallographica Section C","1993","49","6","1169","1171","10.1107/S0108270192011855","","","0.71073","MoKα","","","0.067","","","0.081","","","","","1.452","1.452","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001624","8.909","0.002","19.847","0.004","7.602","0.002","90","","90.51","0.04","90","","1344.1","0.5","294","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C3 H17 Cl3 Ho N O8 -","- C3 H17 Cl3 Ho N O8 -","- C12 H68 Cl12 Ho4 N4 O32 -","4","2","SH1017","Głowiak, T.; Dao, C. N.","Structure of pentaaqua(<small>L</small>-serine)holmium(III) trichloride","Acta Crystallographica Section C","1993","49","6","1171","1173","10.1107/S0108270192012514","","","0.71069","MoKα","","","0.037","","","0.05","","","","","4.171","4.171","","","","","has coordinates","205896","2020-10-21","18:00:00",""
"2001625","8.402","0.004","14.28","0.01","7.498","0.004","90","","90","","90","","899.6","0.9","150","","","","","","","","","","","6","P n a 21","P 2c -2n","","","","","- C3 H10 Cd Cl2 O2 S -","- C3 H10 Cd Cl2 O2 S -","- C12 H40 Cd4 Cl8 O8 S4 -","4","1","MU1030","Nieuwenhuyzen, M.; Robinson, W. T.; Wilkins, C. J.","Structures of the cadmium halide complexes [{CdCl~2~(dmso)(MeOH)}~<i>n~</i>] and [{CdBr~2~(dmso)(MeOH)}~<i>n~</i>] with coordinated dimethyl sulfoxide and methanol","Acta Crystallographica Section C","1993","49","6","1173","1175","10.1107/S0108270192012150","","","0.71073","MoKα","","","0.0268","","","0.0336","","","","","0.97","0.97","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001626","14.52","0.006","10.692","0.004","14.124","0.005","90","","121.38","0.02","90","","1872","1.3","170","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C3 H10 Br2 Cd O2 S -","- C3 H9 Br2 Cd O2 S -","- C24 H72 Br16 Cd8 O16 S8 -","8","1","MU1030","Nieuwenhuyzen, M.; Robinson, W. T.; Wilkins, C. J.","Structures of the cadmium halide complexes [{CdCl~2~(dmso)(MeOH)}~<i>n~</i>] and [{CdBr~2~(dmso)(MeOH)}~<i>n~</i>] with coordinated dimethyl sulfoxide and methanol","Acta Crystallographica Section C","1993","49","6","1173","1175","10.1107/S0108270192012150","","","0.71073","MoKα","","","0.0563","","","0.0727","","","","","1.83","1.83","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001627","11.771","0.001","20.353","0.003","14.704","0.002","90","","109.719","0.008","90","","3316.1","0.7","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H49 Cl4 P2 Pt -","- C27 H48 Cl8 P2 Pt -","- C108 H192 Cl32 P8 Pt4 -","4","1","BR1017","Mague, J. T.; Fink, M. J.; Recatto, C. A.","Structure of <i>cis</i>-[1,2-bis(dicyclohexylphosphino)ethane-<i>P</i>,<i>P</i>']dichloroplatinum(II) chloroform solvate","Acta Crystallographica Section C","1993","49","6","1176","1178","10.1107/S0108270192011697","","","0.71073","MoKα","","","0.035","","","0.045","","","","","1.394","1.394","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001628","8.029","0.001","23.091","0.005","20.11","0.005","90","","90","","90","","3728.3","1.3","295","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C14 H18 N6 O S3 -","- C14 H18 N6 O S3 -","- C112 H144 N48 O8 S24 -","8","1","OH1007","Hu, N.-H.; Zhang, S.-L.","Interactions of thiamine with anions. Structure of thiamine dithiocyanate","Acta Crystallographica Section C","1993","49","6","1178","1180","10.1107/S0108270192012630","","","0.71069","MoKα","","","0.052","","","0.047","","","","","1.91","1.91","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001629","11.941","0.001","18.423","0.002","8.791","0.001","90","","90.49","0.02","90","","1933.9","0.3","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C22 H27 F O -","- C22 H27 F O -","- C88 H108 F4 O4 -","4","1","HA1029","Ravikumar, K.","Non-steroidal anti-inflammatory drugs. II. Structure of (<i>E</i>)-2,6-di-<i>tert</i>-butyl-4-[2-(4-fluorophenyl)ethenyl]phenol","Acta Crystallographica Section C","1993","49","6","1180","1182","10.1107/S0108270192013076","","","0.71063","MoKα","","","0.047","","","0.049","","","","","1.02","1.02","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001630","7.076","0.005","8.218","0.007","10.353","0.008","90","","105.2","0.04","90","","581","0.8","293","","","","","","","","","","","4","P 1 c 1","P -2yc","","","","","- C10 H18 N2 O7 -","- C10 H18 N2 O7 -","- C20 H36 N4 O14 -","2","1","KA1016","Kettmann, V.; Lokaj, J.; Ducamp-Sanguesa, C.; Figlarz, M.; Touboul, M.","Structure of <i>N</i>-(2-hydroxyethyl)ethylenediaminetriacetic acid","Acta Crystallographica Section C","1993","49","6","1182","1184","10.1107/S010827019201309X","","","0.71069","MoKα","","","0.034","","","0.042","","","","","0.86","0.86","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001631","7.681","0.001","14.758","0.002","16.377","0.004","79.46","0.02","87.6","0.05","79.92","0.04","1796.8","0.6","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C39 H23 N9 S4 -","- C39 H23 N9 S4 -","- C78 H46 N18 S8 -","2","1","PA1030","Triki, S.; Ouahab, L.; Grandjean, D.; Garin, J.; Uriel, S.; Fabre, J. M.","Structure of the bis(7,7,8,8-tetracyano-<i>p</i>-quinodimethane)–4-(benzylmethylaminomethyl)-2,2',5,5'-tetrathiafulvalene charge-transfer complex","Acta Crystallographica Section C","1993","49","6","1184","1187","10.1107/S0108270192013313","","","0.71073","MoKα","","","0.039","","","0.049","","","","","1.106","1.106","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001632","10.107","0.004","12.359","0.005","20.861","0.013","90","","90","","90","","2606","2","293","","","","","","","","","","","5","C m c e","-C 2ac 2","64","","","","- C8 H8 O4 Re S4 -","- C8 H8 O4 Re S4 -","- C64 H64 O32 Re8 S32 -","8","0.5","PA1033","Mhanni, A.; Ouahab, L.; Grandjean, D.; Amouroux, J.; Fabre, J. M.","Structures of 3,4-dimethyl-2,2',5,5'-tetrathiafulvalene perrhenate, (DMTTF)ReO~4~, and 3',4'-dimethyl-3,4-tetramethylene-2,5-dithia-2',5'-diselenafulvalene hexafluorophosphate, (CHDTDMDSF)PF~6~","Acta Crystallographica Section C","1993","49","6","1187","1189","10.1107/S0108270192013222","","","0.71073","MoKα","","","0.031","","","0.051","","","","","1.347","1.347","","","","","has coordinates","206165","2020-10-21","18:00:00",""
"2001633","9.682","0.014","9.698","0.004","9.926","0.002","81.95","0.03","80.84","0.05","68.36","0.07","851.9","1.4","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H14 F6 P S2 Se2 -","- C12 H12 F6 P S2 Se2 -","- C24 H24 F12 P2 S4 Se4 -","2","1","PA1033","Mhanni, A.; Ouahab, L.; Grandjean, D.; Amouroux, J.; Fabre, J. M.","Structures of 3,4-dimethyl-2,2',5,5'-tetrathiafulvalene perrhenate, (DMTTF)ReO~4~, and 3',4'-dimethyl-3,4-tetramethylene-2,5-dithia-2',5'-diselenafulvalene hexafluorophosphate, (CHDTDMDSF)PF~6~","Acta Crystallographica Section C","1993","49","6","1187","1189","10.1107/S0108270192013222","","","0.71073","MoKα","","","0.051","","","0.071","","","","","1.617","1.617","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001634","10.5","0.002","11.11","0.003","12.776","0.002","72.66","0.03","72.12","0.02","73.4","0.03","1322.6","0.6","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C58 H34 N10 O3 S6 -","- C58 H32 N10 O4 S6 -","- C58 H32 N10 O4 S6 -","1","0.5","PA1032","Triki, S.; Ouahab, L.; Lorcy, D.; Robert, A.","Structure of anthracenediylidene-bis(1,3-dithiole)–tetracyanoquinodimethane–bis(cyanoformyl)phenyl-malononitrile ylide monohydrate: (Ext-TTF^2+^).TCNQ.(Y^{–^})~2~.(H~2~O)","Acta Crystallographica Section C","1993","49","6","1189","1192","10.1107/S0108270192013283","","","0.71073","MoKα","","","0.05","","","0.066","","","","","1.769","1.769","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001635","7.736","0.002","10.941","0.002","26.445","0.005","90","","90","","90","","2238.3","0.8","178","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C27 H31 N O3 -","- C27 H31 N O3 -","- C108 H124 N4 O12 -","4","1","HA1020","Jones, P. G.; Döring, D.; Laue, T.; Hopf, H.","Structures of the 1:1 and 2:1 adducts of (+)-(<i>S</i>)-[2.2]paracyclophane-4-carboxylic acid and (‒)-ephedrine","Acta Crystallographica Section C","1993","49","6","1192","1195","10.1107/S0108270192013568","","","0.71069","MoKα","","","0.038","","","0.043","","","","","1.5","1.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001636","13.771","0.003","7.788","0.002","17.357","0.004","90","","106.39","0.02","90","","1785.9","0.8","178","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C44 H47 N O5 -","- C44 H47 N O5 -","- C88 H94 N2 O10 -","2","1","HA1020","Jones, P. G.; Döring, D.; Laue, T.; Hopf, H.","Structures of the 1:1 and 2:1 adducts of (+)-(<i>S</i>)-[2.2]paracyclophane-4-carboxylic acid and (‒)-ephedrine","Acta Crystallographica Section C","1993","49","6","1192","1195","10.1107/S0108270192013568","","","0.71069","MoKα","","","0.038","","","0.043","","","","","1.5","1.5","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001637","23.343","0.009","6.453","0.003","17.683","0.006","90","","128.48","0.03","90","","2085.2","1.7","178","","","","","","","","","","","4","C 1 2 1","C 2y","","","","","- C25 H27 N O2 -","- C25 H27 N O2 -","- C100 H108 N4 O8 -","4","1","MU1020","Jones, P. G.; Laue, T.; Hopf, H.","(‒)-(<i>S</i>)-α-Phenylethylammonium (‒)-(<i>R</i>)-[2.2]paracyclophane-4-carboxylate","Acta Crystallographica Section C","1993","49","6","1195","1197","10.1107/S0108270192010527","","","0.71069","MoKα","","","0.038","","","0.044","","","","","1.7","1.7","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001638","18.204","0.004","7.855","0.001","11.751","0.002","90","","91.77","0.02","90","","1679.5","0.5","150","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C4 Cl4 O2 S -","- C4 Cl4 O2 S -","- C32 Cl32 O16 S8 -","8","1","HA1035","Douglas, G.; Frampton, C. S.; Muir, K. W.","Structure of α-tetrachlorothiophene 1,1-dioxide at 150 K","Acta Crystallographica Section C","1993","49","6","1197","1199","10.1107/S0108270193000277","","","0.71069","MoKα","","","0.043","","","0.08","","","","","3.3","3.3","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2001639","9.098","0.004","9.798","0.005","10.815","0.005","92.73","0.04","105.81","0.03","92","0.04","925.4","0.8","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H25 N2 O P -","- C19 H25 N2 O P -","- C38 H50 N4 O2 P2 -","2","1","ST1036","Koeller, K. J.; Rath, N. P.; Spilling, C. D.","Structure of a chiral monocyclic phosphonamide","Acta Crystallographica Section C","1993","49","6","1199","1201","10.1107/S0108270192013003","","","0.71073","MoKα","","","0.0562","","","0.0628","","","","","1.33","1.33","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001640","16.43","0.004","10.819","0.001","15.536","0.004","90","","105.52","0.01","90","","2660.9","1","296.15","","296.15","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C26 H40 O5 Si -","- C26 H40 O5 Si -","- C104 H160 O20 Si4 -","4","1","AS1027","Kamei, S.; Uchida, A.; Ohashi, Y.; Seto, M.; Morihira, K.; Horiguchi, Y.; Kuwajima, I.","Structure of <i>endo</i>-(5<i>R</i>*,6<i>R</i>*,10<i>R</i>*,11<i>S</i>*)-10-(<i>tert</i>-butyldimethylsiloxy)-5,6,10,11-tetrahydro-5-hydroxy-4,11-dimethoxy-7,7,9-trimethyl-6,10-methano-(7<i>H</i>)-benzocyclononene-8-carbaldehyde","Acta Crystallographica Section C","1993","49","6","1201","1203","10.1107/S0108270192012915","","","1.54184","CuKα","","","0.064","","","0.079","","","","","1.01","1.01","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001641","7.671","0.003","8.621","0.002","28.191","0.008","90","","90","","90","","1864.3","1","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-ethoxycarbonyl-5-methyl-10-(2,4,6-trimethylphenyl)-1,2,9-triaza-8- oxabicyclo[5.3.0]-3,5,9-decatriene","","- C19 H23 N3 O3 -","- C19 H23 N3 O3 -","- C76 H92 N12 O12 -","4","1","NA1025","Beltrame, P.; Gelli, G.; Cadoni, E.; Carnasciali, M. M.; Pani, M.; Mugnoli, A.","Structure of a triazaoxabicyclodecatriene derivative","Acta Crystallographica Section C","1993","49","6","1203","1205","10.1107/S0108270192012940","","","0.7107","MoKα","","","0.0618","","","0.0841","","","","","1.667","1.667","","","","","has coordinates,has disorder","208466","2020-10-21","18:00:00",""
"2001642","21.778","0.003","16.707","0.002","12.367","0.002","90","","97.89","0.03","90","","4457.1","1.1","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C30 H22 N2 O3 -","- C30 H22 N2 O3 -","- C240 H176 N16 O24 -","8","2","NA1026","Millini, R.; Del Piero, G.; Allegrini, P.; Malatesta, V.; Castaldi, G.","Structure of photochromic spiroxazines. II. 1',3',3'-Trimethylspiro{anthra[2,1-<i>f</i>][1,4]benzoxazine-2,2'-indoline}-7,12-dione","Acta Crystallographica Section C","1993","49","6","1205","1207","10.1107/S010827019300006X","","","1.54178","CuKα","","","0.049","","","0.043","","","","","1.67","1.67","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001643","9.045","0.003","9.67","0.003","14.807","0.004","90","","90","","90","","1295.1","0.7","153","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C15 H18 O4 -","- C15 H18 O4 -","- C60 H72 O16 -","4","1","VS1002","Huipe-Nava, E.; Igonin, V. A.; Lindeman, S. V.; Struchkov, Yu. T.; Mendoza, V.; Garcia G., E.; Guzman, J. A.","β-Homopipitzolone","Acta Crystallographica Section C","1993","49","6","1207","1209","10.1107/S0108270192013374","","","0.71073","MoKα","","","0.033","","","0.032","","","","","0.52","0.52","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001644","7.333","0.001","8.339","0.001","15.616","0.004","95.68","0.01","103.2","0.02","107.62","0.02","871.4","0.3","289","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H12 F3 N3 O6 -","- C16 H12 F3 N3 O6 -","- C32 H24 F6 N6 O12 -","2","1","LI1038","Brown, D. M.; Lin, P. K. T.; Van Meervelt, L.","Structure of 4-nitrobenzyl <i>N</i>-(4-nitrobenzyloxy)trifluoroacetimidate","Acta Crystallographica Section C","1993","49","6","1209","1211","10.1107/S0108270192013271","","","1.54184","CuKα","","","0.0709","","","0.0637","","","","","1.02","1.02","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001645","14.597","0.005","13.153","0.005","6.584","0.003","90","","90","","90","","1264.1","0.9","298","","","","","","","","","","","4","I b a m","-I 2 2c","","","","","- C5 H4 N4 S -","- C5 H4 N4 S -","- C40 H32 N32 S8 -","8","0.5","CR1037","Singh, P.; Pedersen, L. G.","Orthorhombic form of thiopurinol: 1,5-dihydro-4<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidine-4-thione","Acta Crystallographica Section C","1993","49","6","1211","1215","10.1107/S0108270192013453","","","0.71073","MoKα","","","0.043","","","0.06","","","","","1.4","1.4","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001646","12.137","0.002","12.181","0.002","11.694","0.002","100.39","0.01","100.1","0.01","78.02","0.01","1646.3","0.5","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C6 Cl3 N3 O6 -","- C6 Cl3 N3 O6 -","- C36 Cl18 N18 O36 -","6","3","DU1015","Gerard, F.; Hardy, A.; Becuwe, A.","Structure of 1,3,5-trichloro-2,4,6-trinitrobenzene","Acta Crystallographica Section C","1993","49","6","1215","1218","10.1107/S0108270193000034","","","0.7093","MoKα","","","0.029","","","0.034","","","","","1.33","1.33","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001647","10.897","0.001","6.941","0.001","6.345","0.001","64.28","0.01","74.32","0.01","74.81","0.01","410.44","0.1","293","","293","","","","","","","","","3","P -1","-P 1","2","","cis-4-Cyclohexene-1,2-dicarboxylic Acid","","- C8 H10 O4 -","- C8 H10 O4 -","- C16 H20 O8 -","2","1","SH1025","Küppers, H.; Kim, S. A.","Structure of <i>cis</i>-4-cyclohexene-1,2-dicarboxylic acid","Acta Crystallographica Section C","1993","49","6","1218","1220","10.1107/S0108270193000095","","","0.7107","MolybdenumKα","","","0.066","","","0.049","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001648","21.953","0.005","8.961","0.003","13.588","0.003","90","","96.07","0.03","90","","2658.1","1.2","295","0.5","295","0.5","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,10-Dimethyl-4,7,13,16,21,24-hexaoxa-1,10-diazoniabicyclo[8.8.8]hexacosane diiodide","","- C20 H42 I2 N2 O6 -","- C20 H42 I2 N2 O6 -","- C80 H168 I8 N8 O24 -","4","0.5","SH1028","Korber, N.; Jansen, M.","<i>N</i>,<i>N</i>'-Dimethylcryptand[2.2.2] diiodide","Acta Crystallographica Section C","1993","49","6","1220","1222","10.1107/S0108270192012824","","","0.71069","MoKα","","0.032","0.0298","","0.0789","0.0772","","","","1.144","1.165","1.165","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001649","7.578","0.002","8.735","0.002","9.371","0.002","90","","90","","90","","620.3","0.3","296","1","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C4 H5 Br O4 -","- C4 H5 Br O4 -","- C16 H20 Br4 O16 -","4","1","BR1027","Britten, J. F.; Howard-Lock, H. E.; Leblanc, D.; Lock, C. J. L.","(<i>R</i>)-2-Bromo-1,4-butanedioic acid","Acta Crystallographica Section C","1993","49","6","1222","1224","10.1107/S0108270192013210","","","1.54178","CuKα","","","0.0424","","","0.0419","","","","","1.97","1.97","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001650","10.808","0.002","10.808","0.002","10.883","0.001","90","","90","","120","0.1","1101","1.2","295","","","","","","","","","","","3","P 31","P 31","","","","","- C20 H14 O2 -","- C20 H14 O2 -","- C60 H42 O6 -","3","1","OH1012","Mori, K.; Masuda, Y.; Kashino, S.","(+)-(<i>R</i>)- and racemic forms of 2,2'-dihydroxy-1,1'-binaphthyl","Acta Crystallographica Section C","1993","49","6","1224","1227","10.1107/S0108270193000083","","","1.54178","CuKα","","","0.03","","","0.039","","","","","1.357","1.357","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001651","15.696","0.002","21.617","0.002","8.6253","0.0006","90","","90","","90","","2926.6","0.5","295","","","","","","","","","","","3","I b a 2","I 2 -2c","","","","","- C20 H14 O2 -","- C20 H14 O2 -","- C160 H112 O16 -","8","1","OH1012","Mori, K.; Masuda, Y.; Kashino, S.","(+)-(<i>R</i>)- and racemic forms of 2,2'-dihydroxy-1,1'-binaphthyl","Acta Crystallographica Section C","1993","49","6","1224","1227","10.1107/S0108270193000083","","","1.54178","CuKα","","","0.034","","","0.039","","","","","1.214","1.214","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001652","19.979","0.002","24.115","0.003","8.998","0.0014","90","","90","","90","","4335.2","1","296","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C39 H73 N O14 -","- C39 H73 N O14 -","- C156 H292 N4 O56 -","4","1","OH1013","Iwasaki, H.; Sugawara, Y.; Adachi, T.; Morimoto, S.; Watanabe, Y.","Structure of 6-<i>O</i>-methylerythromycin A (clarithromycin)","Acta Crystallographica Section C","1993","49","6","1227","1230","10.1107/S0108270193000186","","","0.71073","MoKα","","","0.045","","","0.053","","","","","0.7823","0.7823","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001653","8.311","0.003","10.552","0.003","7.508","0.005","97.45","0.04","115.59","0.03","104.36","0.02","553.8","0.5","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H11 N O3 -","- C14 H11 N O3 -","- C28 H22 N2 O6 -","2","1","AL1004","Kakehi, A.; Kitajima, K.; Ito, S.; Takusagawa, N.","Structure of a pyrano[2,3-<i>b</i>]indolizine","Acta Crystallographica Section C","1993","49","6","1230","1232","10.1107/S0108270192012769","","","0.71069","MoKα","","","0.044","","","0.055","","","","","1.84","1.84","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001654","9.492","0.002","4.674","0.006","49.39","0.01","90","","93.65","0.02","90","","2187","3","221","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","","","","","- C22 H42 O2 -","- C22 H42 O2 -","- C88 H168 O8 -","4","1","OH1011","Kaneko, F.; Yamazaki, K.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Sato, K.; Suzuki, M.","Structure of the γ phase of erucic acid","Acta Crystallographica Section C","1993","49","6","1232","1234","10.1107/S0108270193000071","","","1.5418","CuKα","","","0.051","","","0.067","","","","","1.52","1.52","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001655","9.145","0.001","16.756","0.002","18.201","0.002","90","","90","","90","","2789","0.5","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C30 H36 O7 -","- C30 H36 O7 -","- C120 H144 O28 -","4","1","ST1038","Abboud, K. A.; Jiang, S.; Enholm, E. J.","Structure of a coupled carbohydrate and terpene","Acta Crystallographica Section C","1993","49","6","1234","1237","10.1107/S0108270193000113","","","0.71073","MoKα","","","0.0527","","","0.0503","","","","","1.6","1.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001656","6.4176","0.0009","12.296","0.002","12.215","0.002","90","","114.3","0.01","90","","878.5","0.2","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Hydrogenophosphate of piperazinium monohydrated","Hydrogenophosphate of piperazinium monohydrated","","- C4 H15 N2 O5 P -","- C4 H14 N2 O5 P -","- C16 H56 N8 O20 P4 -","4","1","DU1011","Riou, D.; Loiseau, T.; Ferey, G.","Structure determination of a monohydrated piperazinium hydrogenphosphate","Acta Crystallographica Section C","1993","49","6","1237","1238","10.1107/S0108270193000496","","","0.71069","MoKα","","","0.039","","","0.034","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001657","5.95","0.002","8.238","0.001","9.952","0.002","90","","102.82","0.02","90","","475.6","0.2","296","","296","","","","","","","","","4","P 1 21 1","","","","(4S,5S)-4-Methyl-5-phenyl-2-oxazolidinone","","- C10 H11 N O2 -","- C10 H11 N O2 -","- C20 H22 N2 O4 -","2","1","CR1047","Robinson, P. D.; Hua, D. H.; Good, L. A.; Wang, H.; Meyers, C. Y.","(4<i>S</i>,5<i>S</i>)-4-Methyl-5-phenyl-1,3-oxazolidin-2-one","Acta Crystallographica Section C","1993","49","6","1238","1240","10.1107/S0108270192013477","","","0.71069","MoKα","","","0.029","","","0.036","","","","","1.51","1.51","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001658","19.14","0.03","7.635","0.003","19.838","0.001","90","","99.84","0.04","90","","2856","5","293","","","","","","","","","","","3","I 1 2 1","I 2y","","","","","- C29 H52 O7 -","- C29 H52 O6.5 -","- C116 H208 O26 -","4","1","HA1010","Sivaraman, J.; Subramanian, K.; Velmurugan, D.; Subramanian, E.; Balakrishna, K.","Structure of vicogenin","Acta Crystallographica Section C","1993","49","6","1240","1242","10.1107/S0108270192013556","","","1.5418","CuKα","","","0.056","","","0.06","","","","","2.3","2.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001659","6.608","0.001","6.899","0.001","12.977","0.002","82.66","0.01","80.64","0.01","73.97","0.01","558.88","0.15","","","","","","","","","","","","4","P -1","-P 1","2","","","","- Eu2 H8 O11.5 P3 -","- Eu2 H3 O12 P3 -","- Eu4 H6 O24 P6 -","2","1","DU1019","Foulon, J.-D.; Tijani, N.; Durand, J.; Rafiq, M.; Cot, L.","Structure de Eu~2~(PO~3~H)~3~.2,5H~2~O","Acta Crystallographica Section C","1993","49","5","849","851","10.1107/S0108270192012587","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001660","9.73439","0.00009","9.73439","0.00009","11.892","0.0002","90","","90","","120","","975.89","0.02","","","","","","","","","","","","3","R -3 c","-R 3 2""c","","","","","- Ir O6 Sr4 -","- Ir O6 Sr4 -","- Ir6 O36 Sr24 -","6","","HU1016","Powell, A. V.; Battle, P. D.; Gore, J. G.","Structure of Sr~4~IrO~6~ by time-of-flight neutron powder diffraction","Acta Crystallographica Section C","1993","49","5","852","854","10.1107/S0108270192012721","","neutron","","Neutron","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001661","11.45","0.002","8.409","0.002","9.847","0.001","90","","95.28","0.01","90","","944.1","0.3","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 O19 Rb2 Si8 -","- Cu2 O19 Rb2 Si8 -","- Cu4 O38 Rb4 Si16 -","2","0.5","OH1000","Watanabe, I.; Kawahara, A.","Structure of a synthetic double-layer silicate, Rb~2~Cu~2~Si~8~O~19~","Acta Crystallographica Section C","1993","49","5","854","856","10.1107/S0108270192011892","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205956","2020-10-21","18:00:00",""
"2001662","13.126","0.002","16.274","0.007","11.756","0.004","96.77","0.02","90.04","0.02","77.77","0.02","2436.4","1.4","","","","","","","","","","","","4","P -1","-P 1","2","","","","- H17 K10 O50 W12 -","- H2 K10 O52 W12 -","- H4 K20 O104 W24 -","2","1","GR0197","Evans, Jnr, H. T.; Kortz, U.; Jameson, G. B.","Structure of potassium paradodecatungstate 71/2-hydrate","Acta Crystallographica Section C","1993","49","5","856","861","10.1107/S0108270192012010","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001663","8.686","0.001","12.483","0.002","12.933","0.002","73.09","0.01","73.65","0.01","70.87","0.01","1240.4","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H42 Cl14 N10 Ni5 -","- C28 H46 Cl14 N10 Ni5 -","- C28 H46 Cl14 N10 Ni5 -","1","0.5","ST0571","Bond, M. R.; Willett, R. D.","Structures of tetrakis(2-amino-6-methylpyridinium) <i>catena</i>-bis(acetonitrile)tetradeca-μ-chloro-pentanickelate(II) and bis(3-picolinium) <i>catena</i>-diaquaocta-μ-chloro-trinickelate(II)","Acta Crystallographica Section C","1993","49","5","861","865","10.1107/S0108270192009600","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001664","7.648","0.001","8.498","0.001","9.55","0.001","85.15","0.01","83.71","0.01","69.08","0.01","575.58","0.12","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H20 Cl8 N2 Ni3 O2 -","- C12 H20 Cl8 N2 Ni3 O2 -","- C12 H20 Cl8 N2 Ni3 O2 -","1","0.5","ST0571","Bond, M. R.; Willett, R. D.","Structures of tetrakis(2-amino-6-methylpyridinium) <i>catena</i>-bis(acetonitrile)tetradeca-μ-chloro-pentanickelate(II) and bis(3-picolinium) <i>catena</i>-diaquaocta-μ-chloro-trinickelate(II)","Acta Crystallographica Section C","1993","49","5","861","865","10.1107/S0108270192009600","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001665","8.294","0.001","10.981","0.003","11.934","0.003","90","","107.04","0.02","90","","1039.2","0.4","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C10 H28 Cl3 Er N2 O9 -","- C10 H18 Cl3 Er N2 O9 -","- C20 H36 Cl6 Er2 N4 O18 -","2","1","MU1025","Ma, A.-Z.; Li, L.-M.; Lin, Y.-H.; Xi, S.-Q.","Structure of an erbium coordination compound with <small>L</small>-proline, {[Er(Pro)~2~(H~2~O)~5~]Cl~3~}~<i>n~</i>","Acta Crystallographica Section C","1993","49","5","865","867","10.1107/S0108270192012113","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001666","7.597","0.005","12.951","0.003","13.131","0.005","90","","90","","90","","1291.9","1","","","","","","","","","","","","6","P n a m","-P 2c -2n","","","","","- C6 H10 K2 N O11 V -","- C6 H10 K2 N O11 V -","- C24 H40 K8 N4 O44 V4 -","4","0.5","AB1026","Lapshin, A. E.; Smolin, Y. I.; Shepelev, Y. F.; Sivák, M.; Gyepesová, D.","Structure of dipotassium (nitrilo-κ<i>N</i>-triacetato-κ^3^<i></i><i>O</i>,<i>O</i>'',<i>O</i>'''')oxoperoxovanadate(V)‒water (1/2)","Acta Crystallographica Section C","1993","49","5","867","870","10.1107/S0108270192011843","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001667","13.46","0.005","9.632","0.003","24.667","0.002","90","","107.79","0.06","90","","3045.1","1.8","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C38 H28 N6 O4 Zn -","- C38 H28 N6 O4 Zn -","- C152 H112 N24 O16 Zn4 -","4","1","MU0262","Sur, H.; Roychowdhuri, S.; Seth, S.","Structure of bis{2'-[α-(2-pyridyl)benzylidene]salicylohydrazido}zinc(II)","Acta Crystallographica Section C","1993","49","5","870","873","10.1107/S0108270192012319","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001668","17.152","0.014","7.146","0.005","21","0.03","90","","93","0.09","90","","2570","5","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C18 H34 N2 O2 S4 Sn -","- C18 H34 N2 O2 S4 Sn -","- C72 H136 N8 O8 S16 Sn4 -","4","0.5","DU1017","Vrábel, V.; Kellö, E.","Structure of di(<i>n</i>-butyl)bis(morpholinocarbodithioato-κ^2^<i>S,S'</i>)tin(IV)","Acta Crystallographica Section C","1993","49","5","873","875","10.1107/S0108270192013040","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001670","12.217","0.002","16.848","0.006","18.834","0.003","90","","100.37","0.02","90","","3813.3","1.6","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H63 B F15 O2 Ta -","- C39 H35 B F15 O2 Ta -","- C156 H140 B4 F60 O8 Ta4 -","4","1","HH0591","Schaefer, W. P.; Quan, R. W.; Bercaw, J. E.","Structure of hydroxo(methyl)bis(η^5^-pentamethylcyclopentadienyl)tantalum(V) hydroxotris(pentafluorophenyl)borate","Acta Crystallographica Section C","1993","49","5","878","881","10.1107/S0108270192003998","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","278324","2022-10-03","14:41:53",""
"2001671","7.473","0.001","7.779","0.002","9.787","0.002","109.46","0.03","98.56","0.03","98.29","0.03","518.9","0.2","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H20 N8 O8 P2 Pt -","- C12 H12 N8 O10 P2 Pt -","- C12 H12 N8 O10 P2 Pt -","1","0.5","BR1016","Britten, J. F.; Lock, C. J. L.; Wang, Z.","Bis[di(imidazol-2-yl)phosphinato-<i>N</i>^3^,<i>N</i>^3'^]platinum(II) tetrahydrate","Acta Crystallographica Section C","1993","49","5","881","884","10.1107/S0108270192013258","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001672","12.079","0.002","12.671","0.003","18.01","0.02","101.46","0.05","96.45","0.06","113.6","0.03","2418","3","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H46 Br4 N2 O13 Pb -","- C38 H46 Br4 N2 O13 Pb -","- C76 H92 Br8 N4 O26 Pb2 -","2","1","HU0410","García-Granda, S.; Díaz, M. R.; Gómez-Beltrán, F.; Blanco-Gomís, D.","Structure of (4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane)lead(II) eosin dihydrate","Acta Crystallographica Section C","1993","49","5","884","886","10.1107/S010827019200979X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001673","11.749","0.003","8.3","0.002","14.725","0.002","90","","103.97","0.02","90","","1393.5","0.5","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C8 H19 Cl O5 Sn -","- C8 H Cl O5 Sn -","- C32 H4 Cl4 O20 Sn4 -","4","1","BR1020","Lambert, J. B.; Kuhlmann, B.; Stern, C. L.","Structure of the dimer of dibutylhydroxystannyl perchlorate","Acta Crystallographica Section C","1993","49","5","887","890","10.1107/S0108270192011648","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001674","11.864","0.003","7.726","0.002","14.832","0.003","90","","102.17","0.02","90","","1329","0.6","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H26 Cu N4 O6 -","- C27 H26 Cu N4 O6 -","- C54 H52 Cu2 N8 O12 -","2","1","MU0252","Solans, X.; Ruíz-Ramírez, L.; Martínez, A.; Gasque, L.; Moreno-Esparza, R.","Mixed chelate complexes. II. Structures of <small>L</small>-alaninato(aqua)(4,7-diphenyl-1,10-phenanthroline)copper(II) nitrite monohydrate and aqua(4,7-dimethyl-1,10-phenanthroline)(glycinato)(nitrato)copper(II) monohydrate","Acta Crystallographica Section C","1993","49","5","890","893","10.1107/S0108270192000556","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001675","14.138","0.003","10.016","0.002","7.565","0.002","104.83","0.02","83.47","0.02","119.93","0.02","897.3","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H20 Cu N4 O7 -","- C16 H20 Cu N4 O7 -","- C32 H40 Cu2 N8 O14 -","2","1","MU0252","Solans, X.; Ruíz-Ramírez, L.; Martínez, A.; Gasque, L.; Moreno-Esparza, R.","Mixed chelate complexes. II. Structures of <small>L</small>-alaninato(aqua)(4,7-diphenyl-1,10-phenanthroline)copper(II) nitrite monohydrate and aqua(4,7-dimethyl-1,10-phenanthroline)(glycinato)(nitrato)copper(II) monohydrate","Acta Crystallographica Section C","1993","49","5","890","893","10.1107/S0108270192000556","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001676","12.2783","0.0008","21.5387","0.0006","41.9626","0.0002","90","","90","","90","","11097.4","0.8","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C58 H58 Cl4 P4 W2 -","- C58 H52 Cl4 P4 W2 -","- C464 H416 Cl32 P32 W16 -","8","1","HH1033","Cotton, F. A.; Eglin, J. L.; James, C. A.","Structural characterization of W^4^—WCl~4~(PMePh~2~)~4~","Acta Crystallographica Section C","1993","49","5","893","896","10.1107/S0108270193000666","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001677","12.032","0.004","10.724","0.004","9.502","0.003","90","","90","","90","","1226.1","0.7","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C11 H14 Cl N O3 -","- C11 H14 Cl N O3 -","- C44 H56 Cl4 N4 O12 -","4","1","MU1001","Hajjem, B.; Kallel, A.; Svoboda, I.; Baccar, B.","Structure of <i>N</i>-[(4-chlorophenyl)di(methoxy)methyl]acetamide","Acta Crystallographica Section C","1993","49","5","898","900","10.1107/S0108270192012046","","","0.71069","MO","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001678","8.959","0.001","14.137","0.001","13.934","0.001","90","","90","","90","","1764.8","0.3","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C21 H28 N2 -","- C21 H28 N2 -","- C84 H112 N8 -","4","1","HU1008","Katrusiak, A.","Structure of 15-phenyl-14-dehydrosparteine","Acta Crystallographica Section C","1993","49","5","900","902","10.1107/S0108270192012708","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001679","20.449","0.004","11.473","0.002","13.025","0.002","90","","108.91","0.01","90","","2890.9","0.9","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C20 H15 Cl -","- C20 H15 Cl -","- C160 H120 Cl8 -","8","2","CR0405","Carrell, H. L.","7-Chloromethyl-12-methylbenz[<i>a</i>]anthracene","Acta Crystallographica Section C","1993","49","5","902","905","10.1107/S0108270192008278","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001680","24.113","0.005","11.02","0.005","12.065","0.004","90","","100.07","0.02","90","","3156.6","1.9","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C30 H36 N3 O4 S3 -","- C33.5 H29 N3 O4 S3 -","- C134 H116 N12 O16 S12 -","4","1","AL1031","Evans, D. J.; Hughes, D. L.; Leigh, G. J.; Garcia, G.; Santana, M. D.","Structure of 4,7-bis(4-mercaptobenzoyl)-1-tosyl-1,4,7-triazacyclononane","Acta Crystallographica Section C","1993","49","5","905","908","10.1107/S0108270192012770","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001681","9.114","0.007","18.747","0.011","14.185","0.009","90","","104.57","0.06","90","","2346","3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H39 Cl N2 O3 -","- C24 H38 Cl N2 O3 -","- C96 H152 Cl4 N8 O12 -","4","1","DU0340","Kettmann, V.; Frešová, E.; Sivý, J.; Gregáň, F.","Structure of <i>trans</i>-1-{2-[(2-butoxy)phenylcarbamoyloxy]cycloheptylmethyl}piperidinium chloride","Acta Crystallographica Section C","1993","49","5","908","911","10.1107/S0108270192012459","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001682","8.756","0.004","12.373","0.006","8.426","0.005","102.99","0.03","115.79","0.03","98.06","0.03","770.9","0.8","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H16 N6 O4 -","- C17 H16 N6 O4 -","- C34 H32 N12 O8 -","2","1","AL1019","Agmon, I.; Ashkenazi, P.; Kaftory, M.","Structures of Diels–Alder reaction bis-adducts of 4-phenyl- or 4-methyl-1,2,4-triazoline-3,5-dione with 1,6-methano[10]annulene","Acta Crystallographica Section C","1993","49","5","911","914","10.1107/S0108270192012241","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001683","14.44","0.007","9.416","0.005","16.227","0.009","90","","98.42","0.03","90","","2183","2","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C27 H20 N6 O4 -","- C27 H20 N6 O4 -","- C108 H80 N24 O16 -","4","1","AL1019","Agmon, I.; Ashkenazi, P.; Kaftory, M.","Structures of Diels‒Alder reaction bis-adducts of 4-phenyl- or 4-methyl-1,2,4-triazoline-3,5-dione with 1,6-methano[10]annulene","Acta Crystallographica Section C","1993","49","5","911","914","10.1107/S0108270192012241","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001684","12.673","0.006","11.431","0.006","9.439","0.005","68.49","0.03","111.39","0.03","97.72","0.03","1184.5","1.1","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H23 N6 O5 -","- C28 H22 N6 O5 -","- C56 H44 N12 O10 -","2","1","AL1019","Agmon, I.; Ashkenazi, P.; Kaftory, M.","Structures of Diels–Alder reaction bis-adducts of 4-phenyl- or 4-methyl-1,2,4-triazoline-3,5-dione with 1,6-methano[10]annulene","Acta Crystallographica Section C","1993","49","5","911","914","10.1107/S0108270192012241","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001685","7.349","0.001","10.613","0.002","11.721","0.002","84.42","0.01","79.42","0.01","83.23","0.01","889.7","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H12 Cl4 N2 O3 -","- C16 H12 Cl4 N2 O3 -","- C32 H24 Cl8 N4 O6 -","2","1","GR0204","Toma, P. H.; Nguyen, D. N.; Byrn, S. R.","9-Chloro-2-ethoxy-6-nitroacridine","Acta Crystallographica Section C","1993","49","5","914","916","10.1107/S0108270192011909","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001686","5.322","0.002","10.531","0.003","12.939","0.002","90","","99.2","0.02","90","","715.9","0.4","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H16 N4 Se3 -","- C10 H16 N4 Se3 -","- C20 H32 N8 Se6 -","2","1","AB1012","Billing, D. G.; Ferg, E. E.; Lai, L.-L.; Levendis, D. C.; Reid, D. H.","Structures of 2,3-diethyl-6,7-dihydro-5<i>H</i>-2aλ^4^-selena-2,3,4a,7a-tetraazacyclopent[<i>cd</i>]indene-1(2<i>H</i>),4(3<i>H</i>)-diselone and 1,4-bis(ethylimino)-5,6-dihydro-2,2aλ^4^,3-triselena-4a,6a-diazacyclopenta[<i>cd</i>]pentalene","Acta Crystallographica Section C","1993","49","5","917","921","10.1107/S0108270192011582","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001687","8.005","0.001","13.717","0.002","11.95","0.001","90","","93.42","0.01","90","","1309.8","0.3","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C9 H14 N4 Se3 -","- C9 H14 N4 Se3 -","- C36 H56 N16 Se12 -","4","1","AB1012","Billing, D. G.; Ferg, E. E.; Lai, L.-L.; Levendis, D. C.; Reid, D. H.","Structures of 2,3-diethyl-6,7-dihydro-5<i>H</i>-2aλ^4^-selena-2,3,4a,7a-tetraazacyclopent[<i>cd</i>]indene-1(2<i>H</i>),4(3<i>H</i>)-diselone and 1,4-bis(ethylimino)-5,6-dihydro-2,2aλ^4^,3-triselena-4a,6a-diazacyclopenta[<i>cd</i>]pentalene","Acta Crystallographica Section C","1993","49","5","917","921","10.1107/S0108270192011582","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001688","5.659","0.002","15.097","0.003","17.138","0.005","90","","96.7","0.3","90","","1454.2","1.2","","","","","","","","","","","","4","P 1 21 1","","","","","","- C28 H33 N9 O10 -","- C28 H33 N9 O10 -","- C56 H66 N18 O20 -","2","1","GR1001","Bhat, B.; Wilson, S. R.; Leonard, N. J.","Structure of a covalently linked cross-section representative of a hydrogen-bonded dA^. ^dT base pair","Acta Crystallographica Section C","1993","49","5","921","924","10.1107/S0108270192012009","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","194481","2020-10-21","18:00:00",""
"2001689","10.0317","0.0001","5.8539","0.0001","4.6768","0.0001","90","","90","","90","","274.643","0.008","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Li Ni O4 P -","- Li Ni O4 P -","- Li4 Ni4 O16 P4 -","4","0.5","HA1024","Abrahams, I.; Easson, K. S.","Structure of lithium nickel phosphate","Acta Crystallographica Section C","1993","49","5","925","926","10.1107/S0108270192013064","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001690","6.334","0.001","14.204","0.001","14.215","0.001","90","","100.72","0.01","90","","1256.6","0.2","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C6 H10 Cl3 N5 O Zn -","- C6 H10 Cl3 N5 O Zn -","- C24 H40 Cl12 N20 O4 Zn4 -","4","1","LI1022","Maixner, J.; Zachová, J.","Structure of trichloro(9-methyladeninium)zinc(II) monohydrate","Acta Crystallographica Section C","1993","49","5","927","929","10.1107/S0108270192010837","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001691","15.427","0.002","8.323","0.003","11.772","0.005","90","","90","","90","","1511.5","0.9","","","","","","","","","","","","5","P c a 21","P 2c -2ac","","","","","- C16 H15 N S U -","- C16 H15 N S U -","- C64 H60 N4 S4 U4 -","4","1","MU1000","Spirlet, M. R.; Rebizant, J.; Apostolidis, C.; Kanellakopulos, B.","Structure of tris(η^5^-cyclopentadienyl)uranium thiocyanate","Acta Crystallographica Section C","1993","49","5","929","931","10.1107/S0108270192011211","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001692","11.813","0.004","8.353","0.005","12.297","0.004","90","","102.31","0.03","90","","1185.5","0.9","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C14 H14 Fe O2 -","- C14 H14 Fe O2 -","- C56 H56 Fe4 O8 -","4","1","HH0554","Zhu, Y.","Structure of 3-ferrocenyl-2-butenoic acid","Acta Crystallographica Section C","1993","49","5","931","932","10.1107/S0108270192006632","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001693","4.9016","0.0008","7.975","0.001","8.413","0.007","100.4","0.01","102.417","0.001","94.083","0.001","313.8","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C4 H10 Cl N O -","- C4 H10 Cl N O -","- C8 H20 Cl2 N2 O2 -","2","1","AB1008","Bentzen, S.; Nielsen, P. H.; Anthoni, U.; Christophersen, C.; Gajhede, M.","3-Methoxyazetidinium chloride","Acta Crystallographica Section C","1993","49","5","932","934","10.1107/S0108270192009314","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001694","7.732","0.002","9.533","0.003","14.725","0.005","90","","90","","90","","1085.4","0.6","","","","","","","","","","","","4","P 21 a b","P -2b 2a","","","","","- C9 H16 O2 S2 -","- C9 H16 O2 S2 -","- C36 H64 O8 S8 -","4","1","SE1014","Brunck, J.-S.; Voss, J.; Olbrich, F.; Viebrock, H.","Structure and configuration of the Michael adduct of 2-(methylthio)thiolane <i>S</i>-oxide and butenone at 173 K","Acta Crystallographica Section C","1993","49","5","934","936","10.1107/S0108270192013350","","","1.54051","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001695","17.32","0.002","17.32","0.002","16.963","0.002","90","","90","","120","","4406.9","0.9","","","","","","","","","","","","4","R 3 2 :H","R 3 2""","155","","","","- C10 H17 Cl N -","- C10 H17.5 Cl0.5 N -","- C180 H315 Cl9 N18 -","18","1","ST0476","Abboud, K. A.; Davis, R. E.; Chen, K.-M.; Whitesell, J. K.","Structure at 198 K of a chiral tricyclic aminochloride, C~10~H~17~N.0.5HCl","Acta Crystallographica Section C","1993","49","5","936","938","10.1107/S0108270192012502","","","0.71069","mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001696","6.023","0.002","8.007","0.003","20.877","0.009","90","","90","","90","","1006.8","0.7","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C12 H9 N Te -","- C12 H9 N Te -","- C48 H36 N4 Te4 -","4","1","ST1023","Junk, T.; Irgolic, K. J.; Reibenspies, J. H.; Meyers, E. A.","Structure of phenotellurazine","Acta Crystallographica Section C","1993","49","5","938","940","10.1107/S0108270192011004","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001697","11.423","0.002","12.193","0.002","6.601","0.005","81","0.03","104.04","0.03","103.052","0.012","863.8","0.7","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 N2 O2 S Si -","- C14 H22 N2 O2 S Si -","- C28 H44 N4 O4 S2 Si2 -","2","1","GR0202","Negron, A.; Barnes, C. L.; Soderquist, J. A.","1,1-Dimethyl-1-silacyclohexan-4-one tosylhydrazone","Acta Crystallographica Section C","1993","49","5","940","942","10.1107/S0108270192012034","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001698","9.696","0.003","11.322","0.004","7.076","0.003","100.68","0.04","93.4","0.03","107.04","0.04","724.5","0.5","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H18 Cl2 N2 O2 -","- C12 H18 Cl2 N2 O2 -","- C24 H36 Cl4 N4 O4 -","2","1","PA0264","Cousson, A.; Bachet, B.; Kokel, B.; Hubert-Habart, M.","Structure of <i>N</i>,<i>N</i>'-dimethyl-4,4'-bipyridylium dichloride dihydrate","Acta Crystallographica Section C","1993","49","5","942","943","10.1107/S0108270191015019","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001699","11.6918","0.0004","6.407","0.0002","6.6988","0.0002","90","","105.55","0.001","90","","483.44","0.03","300","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- Cl2 D4 O2 Sr -","- Cl2 D4 O2 Sr -","- Cl8 D16 O8 Sr4 -","4","0.5","SH1018","Möller, H.; Lutz, H. D.","Profile structure refinement of SrCl~2~.2D~2~O by neutron powder diffraction","Acta Crystallographica Section C","1993","49","5","944","946","10.1107/S0108270192011806","","neutron","1.2268","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001700","11.7008","0.0004","6.3697","0.0002","6.6477","0.0002","90","","105.978","0.002","90","","476.32","0.03","1.5","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- Cl2 D4 O2 Sr -","- Cl2 D4 O2 Sr -","- Cl8 D16 O8 Sr4 -","4","0.5","SH1018","Möller, H.; Lutz, H. D.","Profile structure refinement of SrCl~2~.2D~2~O by neutron powder diffraction","Acta Crystallographica Section C","1993","49","5","944","946","10.1107/S0108270192011806","","neutron","1.2268","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001701","7.2","0.002","7.477","0.002","9.144","0.003","90","","108.95","0.01","90","","465.6","0.2","291","1","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- Br4 K2 Zn -","- Br4 K2 Zn -","- Br8 K4 Zn2 -","2","0.5","AL9484","Fábry, J.; Breczewski, T.; Zúñiga, F. J.; Arnaiz, A. R.","Structure determination of K~2~ZnBr~4~ at 291 and 144 K","Acta Crystallographica Section C","1993","49","5","946","950","10.1107/S0108270192009508","","","1.54056","CuKαradiationforpowderdiffraction","","","0.0282","","","0.0315","","","","","1.123","1.123","","","","","has coordinates","205956","2020-10-21","18:00:00",""
"2001702","7.204","0.003","7.413","0.004","9.028","0.005","90","","108.67","0.03","90","","456.8","0.4","144","3","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- Br4 K2 Zn -","- Br4 K2 Zn -","- Br8 K4 Zn2 -","2","1","AL9484","Fábry, J.; Breczewski, T.; Zúñiga, F. J.; Arnaiz, A. R.","Structure determination of K~2~ZnBr~4~ at 291 and 144 K","Acta Crystallographica Section C","1993","49","5","946","950","10.1107/S0108270192009508","","","1.54056","CuKαradiationforpowderdiffraction","","","0.0493","","","0.0597","","","","","1.318","1.318","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001703","10.255","0.001","10.26","0.002","14.466","0.004","75.87","0.03","96.81","0.02","118.44","0.01","1297.9","0.5","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- K8 Mo6 O24 Th -","- K8 Mo6 O24 Th -","- K16 Mo12 O48 Th2 -","2","1","DU1012","Huyghe, M.; Lee, M.-R.; Jaulmes, S.; Quarton, M.","Structure de K~8~Th(MoO~4~)~6~","Acta Crystallographica Section C","1993","49","5","950","954","10.1107/S0108270192012204","","","0.71069","MoKα","","","0.068","","","0.064","","","","","1.89","1.89","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001704","14.863","0.003","15.751","0.003","11.94","0.003","90","","122.51","0.01","90","","2357.2","0.9","213","1","","","","","","","","","","4","C 1 c 1","C -2yc","","","","","- C26 H34 O2 Sn -","- C26 H34 O2 Sn -","- C104 H136 O8 Sn4 -","4","1","SH1008","Reuter, H.; Schröder, D.","Triphenyltin(IV) isobutoxide isobutanol solvate","Acta Crystallographica Section C","1993","49","5","954","956","10.1107/S0108270192011569","","","0.71","MoKα","","","0.023","","","0.062","","","","","1.029","1.029","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001705","9.146","0.004","8.65","0.004","6.622","0.003","109.05","0.04","71.05","0.04","109.03","0.05","453.9","0.4","295","2","","","","","","","","","","7","P -1","-P 1","2","","","","- C8 H10 Br2 Cl4 N6 O2 Pd -","- C8 H10 Br2 Cl4 N6 O2 Pd -","- C8 H10 Br2 Cl4 N6 O2 Pd -","1","0.5","NA1012","Casellato, U.; Ettorre, R.; Graziani, R.","Bis(5-bromocytosinium) tetrachloropalladate(II)","Acta Crystallographica Section C","1993","49","5","956","957","10.1107/S0108270192011429","","","0.7107","MoKα","","","0.031","","","0.031","","","","","0.777","0.777","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2001706","15.352","0.002","18.876","0.004","18.423","0.004","90","","103.71","0.01","90","","5186.6","1.7","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(η^2^-Dithioformato)-2-(triphenylphosphine)-1,7-dicarba-2-rhoda-closo- dodecaborane(12)","","- C22 H27 B9 P Rh S2 -","- C21 H27 B9 P Rh S2 -","- C168 H216 B72 P8 Rh8 S16 -","8","2","AB1043","Ferguson, G.; Couglan, S.; Spalding, T. R.","2-(η^2^-Dithioformato)-2-(triphenylphosphine)-1,7-dicarba-2-rhoda-<i>closo</i>-dodecaborane(12)","Acta Crystallographica Section C","1993","49","5","957","961","10.1107/S010827019201223X","","","0.7093","MolybdenumKα","","","0.027","","","0.038","","","","","1.44","1.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001707","9.822","0.005","13.676","0.007","13.998","0.004","90","","96.86","0.03","90","","1866.8","1.5","298","3","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H25 Cl2 N5 Ni O8 -","- C10 H25 Cl2 N5 Ni O9 -","- C40 H100 Cl8 N20 Ni4 O36 -","4","1","AS1020","Lu, T.-H.; Lan, W.-J.; Chung, C.-S.","Structure of (1,4,7,10,13-Pentaazacyclopentadecane-<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^10^,<i>N</i>^13^)(perchlorato-<i>O</i>)nickel(II) perchlorate","Acta Crystallographica Section C","1993","49","5","961","963","10.1107/S0108270192011405","","","0.7093","MoKα","","","0.066","","","0.074","","","","","2.03","2.03","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001708","8.7974","0.0005","11.8717","0.0007","10.779","0.0009","90","","108.212","0.005","90","","1069.37","0.13","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H24 F8 O4 S4 Zr2 -","- C8 H24 F8 O4 S4 Zr2 -","- C16 H48 F16 O8 S8 Zr4 -","2","0.5","DU1016","Gao, Y.; Guery, J.; Jacoboni, C.","Structures of [Zr~2~F~8~(dmso)~4~] and [ZrF~4~(dmso)(H~2~O)~2~].2H~2~O","Acta Crystallographica Section C","1993","49","5","963","965","10.1107/S0108270192012472","","","0.71073","MoKα","","","0.023","","","0.023","","","","","0.907","0.907","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001709","7.357","0.004","8.318","0.004","9.627","0.005","99.95","0.02","98.76","0.02","108.61","0.02","536.2","0.5","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C2 H14 F4 O5 S Zr -","- C2 H14 F4 O5 S Zr -","- C4 H28 F8 O10 S2 Zr2 -","2","1","DU1016","Gao, Y.; Guery, J.; Jacoboni, C.","Structures of [Zr~2~F~8~(dmso)~4~] and [ZrF~4~(dmso)(H~2~O)~2~].2H~2~O","Acta Crystallographica Section C","1993","49","5","963","965","10.1107/S0108270192012472","","","0.71073","MoKα","","","0.021","","","0.021","","","","","2.21","2.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001710","7.96","0.001","20.467","0.002","11.565","0.001","90","","125.06","0.01","90","","1542.3","0.3","301","","301","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","dichlorobis-μ-{1-[4-chloro-(2-oxido-1:2κ^2^O')-phenyliminomethyl]naphalen- 2-olato}-1κ^2^N,O;2κ^2^N,O-diiron(III)","","- C34 H20 Cl4 Fe2 N2 O4 -","- C34 H20 Cl4 Fe2 N2 O4 -","- C68 H40 Cl8 Fe4 N4 O8 -","2","0.5","SH1022","Elmali, A.; Elerman, Y.; Svoboda, I.; Fuess, H.","Structure of bis[chloro{1-[(4-chloro-2-hydroxyphenyl)iminomethyl]naphthalen-2-olato-<i>O</i>,<i>O</i>',<i>N</i>}iron(III)]","Acta Crystallographica Section C","1993","49","5","965","967","10.1107/S0108270192012228","","","0.71069","MoKα","","","0.0685","","","0.0489","","","","","","","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2001711","13.7594","0.0006","5.9786","0.0003","17.843","0.0012","90","","106.115","0.005","90","","1410.12","0.14","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1-Ferrocenyl-1-phenylethanol","racemic 1-Ferrocenyl-1-phenylethanol","","- C18 H18 Fe O -","- C18 H17.35 Fe O -","- C72 H69.4 Fe4 O4 -","4","1","LI1034","Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Zakaria, C. M.","Structures of 1-ferrocenyl-1-phenylethanol, ferrocenyl(diphenyl)methanol and ferrocene-1,1'-diylbis(diphenylmethanol)","Acta Crystallographica Section C","1993","49","5","967","971","10.1107/S0108270192011715","","","0.7093","MolybdenumKα","","0.04","0.025","","0.038","0.034","","","","","1.25","1.25","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2001712","7.8205","0.0004","11.0274","0.0004","11.7715","0.0006","105.707","0.004","106.128","0.005","102.403","0.004","891.45","0.09","293","","293","","","","","","","","","4","P -1","-P 1","2","Ferrocenyl(diphenyl)methanol","Ferrocenyl(diphenyl)methanol","","- C23 H20 Fe O -","- C23 H20 Fe O -","- C46 H40 Fe2 O2 -","2","1","LI1034","Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Zakaria, C. M.","Structures of 1-ferrocenyl-1-phenylethanol, ferrocenyl(diphenyl)methanol and ferrocene-1,1'-diylbis(diphenylmethanol)","Acta Crystallographica Section C","1993","49","5","967","971","10.1107/S0108270192011715","","","0.7093","MolybdenumKα","","0.039","0.03","","0.05","0.049","","","","","1.46","1.46","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001713","13.2841","0.0006","23.2856","0.0012","18.8106","0.0008","90","","105.482","0.004","90","","5607.5","0.5","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Ferrocene-1,1'-diylbis(diphenylmethanol)","Ferrocene-1,1'-diylbis(diphenylmethanol)","","- C36 H30 Fe O2 -","- C36 H30 Fe O2 -","- C288 H240 Fe8 O16 -","8","1","LI1034","Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Zakaria, C. M.","Structures of 1-ferrocenyl-1-phenylethanol, ferrocenyl(diphenyl)methanol and ferrocene-1,1'-diylbis(diphenylmethanol)","Acta Crystallographica Section C","1993","49","5","967","971","10.1107/S0108270192011715","","","0.7093","MolybdenumKα","","0.06","0.036","","0.055","0.049","","","","","1.37","1.37","","","","","has coordinates","191032","2020-10-21","18:00:00",""
"2001714","16.164","0.002","14.747","0.001","8.3073","0.0006","90.86","0.07","112.82","0.06","108.74","0.08","1706.2","1.4","294","","294","","","","","","","","","3","P -1","-P 1","2","","Dimethyl 9-methyl-9,10-dihydro-9,10-ethenoanthracene-11,12- dicarboxylate","","- C21 H18 O4 -","- C21 H18 O4 -","- C84 H72 O16 -","4","2","BR1025","Pokkuluri, P. R.; Trotter, J.","Structure of dimethyl 9-methyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate","Acta Crystallographica Section C","1993","49","5","971","973","10.1107/S0108270192012022","","","1.54056","CopperKα","","","0.066","","","0.084","","","","","3","3","","","","","has coordinates","296843","2024-12-11","14:15:26",""
"2001715","13.698","0.004","8.944","0.004","16.67","0.01","90","","112.02","0.04","90","","1893.3","1.6","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H21 Cl6 N3 Te -","- C7 H21 Cl6 N3 Te -","- C28 H84 Cl24 N12 Te4 -","4","1","CR1030","Herrara, C.; Zingaro, R. A.; Meyers, E. A.","Structure of dimethylammonium <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylformamidinium hexachlorotellurate(IV)","Acta Crystallographica Section C","1993","49","5","973","975","10.1107/S010827019201196X","","","0.71073","Mo","","","0.0766","","","0.0423","","","","","1.91","1.91","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001716","7.298","0.002","12.542","0.003","7.944","0.002","90","","116.05","0.02","90","","653.3","0.3","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C10 H6 Cl2 N2 Te2 -","- C10 H6 Cl2 N2 Te2 -","- C20 H12 Cl4 N4 Te4 -","2","0.5","CR1041","Junk, T.; Irgolic, K. J.; Meyers, E. A.","Bis(3-chloro-2-pyridyl) ditelluride","Acta Crystallographica Section C","1993","49","5","975","976","10.1107/S0108270192011983","","","0.71073","MoKα","","","0.0351","","","0.0577","","","","","1.76","1.76","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001717","11.086","0.002","11.086","0.002","14.367","0.004","90","","90","","120","","1529.1","0.6","","","","","","","","","","","","5","P 31 2 1","P 31 2""","","","","","- C21 H29 Cl N2 O -","- C21 H29 Cl N2 O -","- C63 H87 Cl3 N6 O3 -","3","0.5","LI1010","Marsh, R. E.","On the structure of 9-amino-2,7-di-<i>tert</i>-butylacridine","Acta Crystallographica Section C","1993","49","1","193","","10.1107/S0108270192005201","","","1.54178","CuKα","","","","","","","","","","","","","","","","","has coordinates","191091","2020-10-21","18:00:00",""
"2001718","6.104","0.001","8.933","0.003","16.062","0.003","90","","90","","90","","875.8","0.4","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C6 H11 N O5 S -","- C6 H11 N O5 S -","- C24 H44 N4 O20 S4 -","4","1","HE1003","Portalone, G.; Cassetta, A.; Pagani Zecchini, G.; Torrini, I.","(3<i>R</i>,5<i>R</i>)-Tetrahydro-2<i>H</i>-1,4-thiazine-3,5-dicarboxylic acid monohydrate","Acta Crystallographica Section C","1993","49","5","976","978","10.1107/S0108270192011181","","","1.54184","Cu","","","0.0511","","","0.069","","","","","0.214","0.214","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001719","10.745","0.005","11.435","0.005","13.003","0.006","90","","90","","90","","1597.7","1.3","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C19 H21 N O4 -","- C19 H21 N O4 -","- C76 H84 N4 O16 -","4","1","KA1013","Ribár, B.; Kapor, A.; Gašić, O.; Kanyó, I.; Engel, P.","Structure of sinoacutine","Acta Crystallographica Section C","1993","49","5","978","980","10.1107/S0108270192011417","","","0.7107","MoKα","","","0.057","","","","","","","","0.968","0.968","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001720","5.0846","0.0002","27.374","0.001","7.4008","0.0003","90","","109.528","0.003","90","","970.83","0.07","138","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C10 H13 N O3 -","- C10 H13 N O3 -","- C40 H52 N4 O12 -","4","1","ST1027","Xiao, G.; van der Helm, D.; Hider, R. C.; Dobbin, P. S.","3-[1-(Ethylamino)ethylidene]-6-methyl-3<i>H</i>-pyran-2,4-dione","Acta Crystallographica Section C","1993","49","5","980","982","10.1107/S0108270192010928","","","1.54178","CuKα","","","0.039","","","0.059","","","","","2.6","2.6","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001721","7.521","0.001","10.872","0.002","22.901","0.003","90","","90","","90","","1872.6","0.5","295","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C22 H24 N2 O4 -","- C22 H24 N2 O4 -","- C88 H96 N8 O16 -","4","1","LI1028","Priya, V.; Shamala, N.; Viswamitra, M. A.; Ravindran, T.; Jeyaraman, R.","Structure of 2,4-bis(4-methoxyphenyl)-3-nitroso-3-azabicyclo[3.3.1]nonan-9-one","Acta Crystallographica Section C","1993","49","5","983","985","10.1107/S0108270192011375","","","1.5418","CuKα","","","0.059","","","0.05","","","","","1.87","1.87","","","","","has coordinates","190560","2020-10-21","18:00:00",""
"2001722","7.742","0.002","8.886","0.002","13.101","0.003","97.39","0.02","94.35","0.02","91.42","0.02","890.7","0.4","105","","105","","","","","","","","","4","P -1","-P 1","2","Muscarine picrate","(±)-(2S,4R,5S)-tetrahydro-4-hydroxy-N,N,N,5-tetramethyl-2-furanaminium picrate","","- C15 H22 N4 O9 -","- C15 H22 N4 O9 -","- C30 H44 N8 O18 -","2","1","AB1045","Frydenvang, K.; Jensen, B.","Structures of muscarine picrate and muscarine tetraphenylborate","Acta Crystallographica Section C","1993","49","5","985","990","10.1107/S0108270192012198","","","0.71073","MoKα","","","0.033","","","0.042","","","","","1.484","1.484","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001723","9.936","0.002","30.21","0.005","9.771","0.001","90","","111.34","0.01","90","","2731.8","0.8","105","","105","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Muscarine tetraphenylborate","(±)-(2S,4R,5S)-tetrahydro-4-hydroxy-N,N,N,5-tetramethyl-2-furanaminium tetraphenylborate","","- C33 H40 B N O2 -","- C34 B N O2 -","- C136 B4 N4 O8 -","4","1","AB1045","Frydenvang, K.; Jensen, B.","Structures of muscarine picrate and muscarine tetraphenylborate","Acta Crystallographica Section C","1993","49","5","985","990","10.1107/S0108270192012198","","","0.71073","MoKα","","","0.13","","","0.127","","","","","2.885","2.885","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001724","8.054","0.003","16.013","0.01","7.48","0.003","90","","111.28","0.03","90","","898.9","0.8","293","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C7 H2 Br2 O4 -","- C7 H2 Br2 O4 -","- C28 H8 Br8 O16 -","4","1","MU1003","Kožíšek, J.; Dvorský, A.; Végh, D.; Jakubcová, M.; Ječný, J.","Structure of 4,9-dibromo-1,6-dioxaspiro[4.4]nona-3,8-diene-2,7-dione, C~7~H~2~Br~2~O~4~","Acta Crystallographica Section C","1993","49","5","990","992","10.1107/S0108270192011454","","","1.54178","CuKα","","","0.0525","","","0.0623","","","","","2.3","2.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001725","7.35","0.004","19.906","0.01","6.726","0.005","93.93","0.06","109.1","0.06","87.59","0.05","927.5","1","152","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C17 H21 Br O4 Si -","- C17 H21 Br O4 Si -","- C34 H42 Br2 O8 Si2 -","2","1","BR1021","Parvez, M.; Yu, S.; Keay, B. A.","<i>p</i>-Bromobenzoate derivative of 3-(<i>tert</i>-butyldimethylsilyl)-5-hydroxy-2(5<i>H</i>)-furanone","Acta Crystallographica Section C","1993","49","5","992","993","10.1107/S010827019201165X","","","0.71069","MoKα","","","0.048","","","0.033","","","","","3.49","3.49","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001726","11.962","0.002","20.917","0.004","7.624","0.002","90","","90","","90","","1907.6","0.7","288","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C18 H19 N3 O9 -","- C18 H19 N3 O9 -","- C72 H76 N12 O36 -","4","1","AS1024","Ogawa, T.; Matsumoto, K.; Yokoo, C.; Hatayama, K.; Kitamura, K.","Structure of methyl 2-(nitrooxy)ethyl 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate","Acta Crystallographica Section C","1993","49","5","993","996","10.1107/S0108270192012447","","","1.5418","CuKα","","","0.031","","","0.052","","","","","2.55","2.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001727","11.562","0.002","9.9784","0.0009","9.6781","0.0009","90","","90","","90","","1116.6","0.2","296","","","","","","","","","","","3","P c a 21","P 2c -2ac","","","","","- C13 H18 O3 -","- C13 H17 O3 -","- C52 H68 O12 -","4","1","CR1036","Mague, J. T.; Ensley, H. E.; Chen, G.","Structure of the epoxide of a tricyclic lactone","Acta Crystallographica Section C","1993","49","5","996","998","10.1107/S0108270192011971","","","0.71073","MoKα","","","0.039","","","0.048","","","","","1.53","1.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001728","21.693","0.006","5.762","0.002","16.404","0.004","90","","107.05","0.02","90","","1960.3","1","301","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C17 H24 N4 O4 -","- C17 H24 N4 O4 -","- C68 H96 N16 O16 -","4","1","HH1014","Newkome, G. R.; Weis, C. D.; Lin, X.; Fronczek, F. R.","5,5-Bis(4-cyano-2-oxabutyl)-1,9-dicyano-3,7-dioxanonane","Acta Crystallographica Section C","1993","49","5","998","1000","10.1107/S0108270192012307","","","1.54184","CuKα","","","0.067","","","0.081","","","","","3.504","3.504","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001729","17.696","0.004","10.36","0.002","8.733","0.001","90","","93.47","0.02","90","","1598.1","0.5","295","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C14 H20 O8 -","- C14 H19 O8 -","- C56 H76 O32 -","4","1","BR1022","Jiang, A.; Hong, L.; See, R. F.; Churchill, M. R.","Structure of a hexasubstituted 1,3-dioxane compound derived from Meldrum's acid: C~4~O~4~(CH~3~)~2~(CH~2~CO~2~C~2~H~5~)~2~","Acta Crystallographica Section C","1993","49","5","1000","1001","10.1107/S0108270192011703","","","0.71073","MoKα","","","","","","","","","","","1.6","1.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001730","10.205","0.001","10.205","0.001","32.229","0.01","90","","90","","90","","3356.4","1.1","297","","","","","","","","","","","2","I 4 1/a (origin at -1)","-I 4ad","","","","","- C22 H26 -","- C22 H26 -","- C176 H208 -","8","","AB1030","Zhang, D.; Xu, Y.; Koh, L. L.; Lam, Y. L.; Huang, H. H.","Structures of 1,1'-diphenyl-1,1'-bicyclopentyl, 1,1'-diphenyl-1,1'-bicyclohexyl and 1,1'-diphenyl-1,1'-bicycloheptyl","Acta Crystallographica Section C","1993","49","5","1002","1007","10.1107/S0108270192011314","","","0.71073","MoKα","","","0.599","","","0.485","","","","","1.53","1.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001731","17.306","0.009","6.499","0.003","16.596","0.011","90","","102.29","0.05","90","","1823.8","1.8","298","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","","","","","- C24 H30 -","- C24 H30 -","- C96 H120 -","4","0.5","AB1030","Zhang, D.; Xu, Y.; Koh, L. L.; Lam, Y. L.; Huang, H. H.","Structures of 1,1'-diphenyl-1,1'-bicyclopentyl, 1,1'-diphenyl-1,1'-bicyclohexyl and 1,1'-diphenyl-1,1'-bicycloheptyl","Acta Crystallographica Section C","1993","49","5","1002","1007","10.1107/S0108270192011314","","","0.71073","MoKα","","","0.0368","","","0.0438","","","","","0.64","0.64","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001732","20.841","0.013","20.805","0.016","19.27","0.02","90","","104.25","0.06","90","","8098","12","298","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","","","","","- C26 H34 -","- C26 H34 -","- C416 H544 -","16","2","AB1030","Zhang, D.; Xu, Y.; Koh, L. L.; Lam, Y. L.; Huang, H. H.","Structures of 1,1'-diphenyl-1,1'-bicyclopentyl, 1,1'-diphenyl-1,1'-bicyclohexyl and 1,1'-diphenyl-1,1'-bicycloheptyl","Acta Crystallographica Section C","1993","49","5","1002","1007","10.1107/S0108270192011314","","","0.71073","MoKα","","","0.0713","","","0.089","","","","","1.04","1.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001733","8.1456","0.0019","10.83","0.003","6.0122","0.001","103.99","0.019","97.88","0.013","80.76","0.013","505.3","0.2","293","","293","","","","","","","","","4","P -1","-P 1","2","","1,4-bis(4'-chlorobenzoyl)-2,3,5,6-tetramethylbenzene","","- C24 H20 Cl2 O2 -","- C24 H20 Cl2 O2 -","- C24 H20 Cl2 O2 -","1","0.5","MU1021","Ferguson, G.; Patterson, K. H.; Smith, D. M.","1,4-Bis(4-chlorobenzoyl)-2,3,5,6-tetramethylbenzene","Acta Crystallographica Section C","1993","49","1","190","192","10.1107/S0108270192010539","","","0.7093","MoKα","","0.052","0.04","","0.067","0.065","","","","","1.89","1.89","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001734","8.107","0.001","9.482","0.002","15.64","0.01","90","","90","","97.73","0.02","1191.3","0.3","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H14 N2 O2 -","- C6.5 H7 N O -","- C26 H28 N4 O4 -","4","2","PA0282","Jaulmes, S.; Dugué, J.; Agafonov, V.; Céolin, R.; Cense, J. M.; Lepage, F.","Structure of <i>N</i>-(2,6-dimethylphenyl)-5-methylisoxazole-3-carboxamide and molecular-orbital study of C‒H ... O bonded dimers","Acta Crystallographica Section C","1993","49","5","1007","1011","10.1107/S0108270192011338","","","0.7107","MoKα","","","0.044","","","0.042","","","","","1.84","1.84","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2001735","7.492","0.003","7.505","0.005","9.502","0.003","90","","109.02","0.03","90","","505.1","0.4","300","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C12 H12 N2 -","- C12 H12 N2 -","- C24 H24 N4 -","2","1","DU1007","Gourdon, A.","3,3'-Dimethyl-4,4'-bipyridine and 5,5'-dimethyl-4,4'-bipyrimidine","Acta Crystallographica Section C","1993","49","5","1011","1013","10.1107/S0108270192012460","","","0.71069","MoKα","","","0.051","","","0.043","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001736","7","0.004","16.853","0.009","3.8986","0.0007","90","","90","","90","","459.9","0.4","300","","","","","","","","","","","3","P 21 21 2","P 2 2ab","","","","","- C10 H10 N4 -","- C10 H10 N4 -","- C20 H20 N8 -","2","0.5","DU1007","Gourdon, A.","3,3'-Dimethyl-4,4'-bipyridine and 5,5'-dimethyl-4,4'-bipyrimidine","Acta Crystallographica Section C","1993","49","5","1011","1013","10.1107/S0108270192012460","","","0.71069","MoKα","","","0.026","","","0.026","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001737","11.953","0.003","7.116","0.001","17.626","0.004","90","","108.95","0.02","90","","1418","0.5","193","","193","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Benzylideneanthrone","","- C21 H14 O -","- C21 H14 O -","- C84 H56 O4 -","4","1","HH1020","Ghosh, R.; Lynch, V. M.; Simonsen, S. H.; Prasad, R. S.; Roberts, R. M.","Structure of an overcrowded molecule, benzylideneanthrone, at 193 K","Acta Crystallographica Section C","1993","49","5","1013","1015","10.1107/S0108270192012356","","","0.71073","MoKα","","0.1049","0.0541","","0.075","0.0592","","","","","1.18","1.18","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001738","12.135","0.002","13.572","0.001","8.75","0.001","90","","118.37","0.01","90","","1268","0.3","293","","","","","","","","","","","6","C 1 c 1","C -2yc","","","","","- C10 H10 Cl N3 O2 S -","- C10 H10 Cl N3 O2 S -","- C40 H40 Cl4 N12 O8 S4 -","4","1","LI1029","Iulek, J.; Zukerman-Schpector, J.; Barreiro, E. J.; Freitas, A. C. C.","Structures of pyrazole derivatives. II. A potential bioisoster of acetazolamide","Acta Crystallographica Section C","1993","49","5","1015","1017","10.1107/S0108270192011090","","","0.70926","MoKα","","","0.043","","","0.044","","","","","1.53","1.53","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001739","10.951","0.005","12.269","0.003","11.754","0.004","90","","90","","90","","1579.2","1","296","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C18 H16 Br P -","- C18 H16 Br P -","- C72 H64 Br4 P4 -","4","0.5","HA1023","Bricklebank, N.; Godfrey, S. M.; McAuliffe, C. A.; Pritchard, R. G.","Triphenylphosphonium bromide","Acta Crystallographica Section C","1993","49","5","1017","1018","10.1107/S0108270192013052","","","0.7107","MoKα","","","0.052","","","0.0562","","","","","1.278","1.278","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001740","5.2049","0.0009","23.375","0.004","13.155","0.003","90","","90","","90","","1600.5","0.5","122","","122","","","","","","","","","4","F d d 2","F 2 -2d","43","","1-Methyl-1-hydroxyurea","","- C2 H6 N2 O2 -","- C2 H6 N2 O S -","- C32 H96 N32 O16 S16 -","16","1","AB1049","Nielsen, B. B.; Frydenvang, K.; Larsen, I. K.","Structures of two ribonucleotide reductase inhibitors: 1-hydroxy-1-methylurea and 1-hydroxy-3-methylurea","Acta Crystallographica Section C","1993","49","5","1018","1022","10.1107/S0108270192012551","","","0.71073","MoKα","","","0.029","","","0.037","","","","","0.84","0.84","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001741","8.202","0.001","7.081","0.001","7.316","0.001","90","","101.378","0.009","90","","416.55","0.1","110","","110","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Methyl-1-hydroxyurea","","- C2 H6 N2 O2 -","- C2 H6 N2 O2 -","- C8 H24 N8 O8 -","4","1","AB1049","Nielsen, B. B.; Frydenvang, K.; Larsen, I. K.","Structures of two ribonucleotide reductase inhibitors: 1-hydroxy-1-methylurea and 1-hydroxy-3-methylurea","Acta Crystallographica Section C","1993","49","5","1018","1022","10.1107/S0108270192012551","","","1.5418","CopperKα","","","0.046","","","0.066","","","","","1.498","1.498","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001742","37.363","0.006","10.7689","0.0011","9.8091","0.0011","90","","95.929","0.011","90","","3925.7","0.9","295","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C48 H44 N4 O4 -","- C48 H44 N4 O4 -","- C192 H176 N16 O16 -","4","0.5","CD1021","Newkome, G. R.; Rogers, L. E.; Fronczek, F. R.","<i>N</i>,<i>N</i>'-Dibenzylethylenediamineterphthalate dimer","Acta Crystallographica Section C","1993","49","5","1022","1024","10.1107/S0108270192012964","","","1.54184","CuKα","","","0.072","","","0.06","","","","","2.046","2.046","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001743","7.7744","0.0006","9.1759","0.0006","10.429","0.0013","74.986","0.008","81.999","0.008","77.091","0.006","697.8","0.12","293","","293","","","","","","","","","4","P -1","-P 1","2","","2,6-bis(methanephosphonic acid)-4-methylphenol 'C9 H14 O7 P2 ,2H2 O '","","- C9 H18 O9 P2 -","- C9 H21 O9 P2 -","- C18 H42 O18 P4 -","2","1","BR1012","Ferguson, G.; Gallagher, J. F.; Vogt, W.; Phillips, J.; Williams, G. J. B.","4-Methyl-2,6-bis(phosphonomethyl)phenol dihydrate","Acta Crystallographica Section C","1993","49","5","1024","1026","10.1107/S0108270192011685","","","0.7093","MolybdenumKα","","0.047","0.045","","0.068","0.067","","","","","1.78","1.78","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001744","17.721","0.004","10.062","0.002","17.284","0.003","90","","93.19","0.02","90","","3077.1","1.1","153","1","153","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","8,8-Bis(2,4,6-tris(trifluoromethyl)thiophenolat) -3,5-trifluoromethyl-7-thia-benzocyclobutene","","- C27 H6 F24 S3 -","- C27 H6 F24 S3 -","- C108 H24 F96 S12 -","4","1","SH1032","Pohl, E.; Herbst-Irmer, R.; Sheldrick, G. M.","Structure of 4,6-bis(trifluoromethyl)-2,2-bis[2,4,6-tris(trifluoromethyl)phenylthio]-1-thiabenzocyclobutene","Acta Crystallographica Section C","1993","49","5","1026","1028","10.1107/S0108270192012526","","","0.71073","MoKα","","0.0602","0.0465","","0.1254","0.1061","","","","1.067","1.061","1.061","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2001745","9.028","0.001","11.069","0.002","23.465","0.002","90","","102.12","0.01","90","","2292.6","0.5","294","1","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22.5 H24 Br Cl O6 -","- C22.5 H24 Br Cl O6 -","- C90 H96 Br4 Cl4 O24 -","4","2","HU1024","Clark, G. R.","Structure of a bromine derivative of isostegane","Acta Crystallographica Section C","1993","49","5","1028","1031","10.1107/S0108270192012654","","","0.71069","Mo","","","0.063","","","0.067","","","","","3.06","3.06","","","","","has coordinates","202206","2020-10-21","18:00:00",""
"2001746","5.769","0.003","8.793","0.003","15.695","0.006","90","","90","","90","","796.2","0.6","193","","193","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-(2'-Thienyl)pyridine","","- C9 H7 N S -","- C9 H7 N S -","- C36 H28 N4 S4 -","4","1","ST1039","Ghosh, R.; Simonsen, S. H.","Structure of 2-(2'-thienyl)pyridine at 193 K","Acta Crystallographica Section C","1993","49","5","1031","1032","10.1107/S0108270192011867","","","0.71073","MoKα","","0.0381","0.0349","","0.0509","0.0499","","","","1.9195","1.9613","1.9613","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001747","7.059","0.001","7.436","0.002","24.572","0.007","86.25","0.02","88.85","0.02","88.62","0.02","1286.4","0.5","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H45 N O4 -","- C24 H45 N O4 -","- C48 H90 N2 O8 -","2","1","HL1018","Koh, L. L.; Xu, Y.; Gan, L. M.; Chew, C. H.; Lee, K. C.","Structures of tetradecyltrimethylammonium salicylate monohydrate (1) and hexadecyltrimethylammonium salicylate monohydrate (2)","Acta Crystallographica Section C","1993","49","5","1032","1035","10.1107/S0108270192012988","","","0.71073","MoKα","","","0.042","","","0.061","","","","","0.77","0.77","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001748","7.055","0.001","7.45","0.001","26.389","0.007","93.29","0.03","92.92","0.02","93.35","0.02","1380.3","0.5","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H49 N O4 -","- C26 H49 N O4 -","- C52 H98 N2 O8 -","2","1","HL1018","Koh, L. L.; Xu, Y.; Gan, L. M.; Chew, C. H.; Lee, K. C.","Structures of tetradecyltrimethylammonium salicylate monohydrate (1) and hexadecyltrimethylammonium salicylate monohydrate (2)","Acta Crystallographica Section C","1993","49","5","1032","1035","10.1107/S0108270192012988","","","0.71073","MoKα","","","0.059","","","0.067","","","","","1.6","1.6","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001749","13.885","0.002","5.8864","0.0006","21.624","0.002","90","","93.25","0.008","90","","1764.5","0.4","","","","","","","","","","","","6","I 1 2/a 1","-I 2ya","","","","","- C6 H8 Cd Cl O3 P -","- C6 H8 Cd Cl O3 P -","- C48 H64 Cd8 Cl8 O24 P8 -","8","1","HH1056","Du, J.-L.; Rettig, S. J.; Thompson, R. C.; Trotter, J.","Structure of a polymeric cadmium complex containing triply bridging monophenylphosphinate ligands","Acta Crystallographica Section C","1993","49","5","1035","1036","10.1107/S0108270193001234","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001750","13.576","0.004","9.077","0.004","5.543","0.003","90","0.02","91.47","0.01","90","0.01","682.8","0.5","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- B5 H2 Li O9 -","- B5 H2 Li O9 -","- B20 H8 Li4 O36 -","4","1","MU0290","Cárdenas, A.; Solans, J.; Byrappa, K.; Shekar, K. V. K.","Structure of lithium <i>catena</i>-poly[3,4-dihydroxopentaborate-1:5-μ-oxo]","Acta Crystallographica Section C","1993","49","4","645","647","10.1107/S0108270192008217","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001751","5.167","0.002","3.756","0.002","17.16","0.002","90","","98.12","0.02","90","","329.7","0.2","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- B2 Be Ca O5 -","- B2 Be Ca O5 -","- B8 Be4 Ca4 O20 -","4","1","ST0579","Schaffers, K. I.; Keszler, D. A.","Alkaline-earth beryllium borate CaBeB~2~O~5~","Acta Crystallographica Section C","1993","49","4","647","650","10.1107/S0108270192006371","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001752","6.0126","0.0002","6.2138","0.0002","8.6139","0.0003","90","","90.239","0.002","90","","321.822","0.019","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- O6 Sr3 U -","- O6 Sr3 U -","- O12 Sr6 U2 -","2","0.5","MU0289","IJdo, D. J. W.","Redetermination of tristrontium uranate(VI). A Rietveld refinement of neutron powder diffraction data","Acta Crystallographica Section C","1993","49","4","650","652","10.1107/S0108270192010849","","neutron","2.57155","Neutron","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001753","8.4562","0.0001","8.4562","0.0001","17.0002","0.0004","90","","90","","90","","1215.64","0.04","","","","","","","","","","","","4","I 4/m m m","","","","","","- Ba2 Ce O6 Sb -","- Ba2 Ce0.75 O6 Sb -","- Ba16 Ce6 O48 Sb8 -","8","0.25","MU0294","IJdo, D. J. W.; Helmholdt, R. B.","Ba~2~Ce~3/4~SbO~6~, a Rietveld refinement of neutron powder diffraction data","Acta Crystallographica Section C","1993","49","4","652","654","10.1107/S0108270192010850","","neutron","2.5717","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001754","28.459","0.001","8.379","0.0003","6.765","0.0003","90","","90","","90","","1613.17","0.11","","","","","","","","","","","","3","P m m n :1","P 2 2ab -1ab","59","","","","- O36 Pb3 U11 -","- O64 Pb8 U24 -","- O128 Pb16 U48 -","2","0.25","MU1002","IJdo, D. J. W.","Pb~3~U~11~O~36~, a Rietveld refinement of neutron powder diffraction data","Acta Crystallographica Section C","1993","49","4","654","656","10.1107/S0108270192010874","","","2.57","","","","","","","","","","","","","","","","","","has coordinates","176343","2020-10-21","18:00:00",""
"2001755","8.654","0.0003","8.6481","0.0003","12.2336","0.0005","90","","90","","90","","915.57","0.06","","","","","","","","","","","","4","P c a 21","P 2c -2ac","","","","","- B7 Fe3 I O13 -","- B7 Fe3 I O13 -","- B28 Fe12 I4 O52 -","4","1","SH0017","Kubel, F.; Janner, A.-M.","Structure of the fully ferroelectric/fully ferroelastic orthorhombic room-temperature phase of iron iodine boracite, Fe~3~B~7~O~13~I","Acta Crystallographica Section C","1993","49","4","657","659","10.1107/S0108270192010643","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001756","13.45","0.003","13.398","0.005","13.357","0.004","90","","99.92","0.01","90","","2371","1.3","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- Ce16 Mo21 O56 -","- Ce16 Mo21 O56 -","- Ce32 Mo42 O112 -","2","0.5","DU1018","Gall, P.; Gougeon, P.","Structure of Ce~16~Mo~21~O~56~ containing single Mo atoms and isolated Mo~10~ clusters","Acta Crystallographica Section C","1993","49","4","659","663","10.1107/S0108270192011533","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001757","11.085","0.001","15.647","0.001","15.167","0.002","90","","109.94","0.01","90","","2473","0.5","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H30 Cl4 O5 Ru2 S5 -","- C10 H30 Cl4 O5 Ru2 S5 -","- C40 H120 Cl16 O20 Ru8 S20 -","4","1","NA1015","Calligaris, M.; Faleschini, P.; Alessio, E.","Structure of [Ru~2~Cl~4~(Me~2~SO)~5~]","Acta Crystallographica Section C","1993","49","4","663","666","10.1107/S0108270192011557","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001758","7.161","0.003","18.945","0.003","13.949","0.004","90","","103.47","0.01","90","","1840.3","1","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C13 H23 Cl N4 Ni O6 -","- C13 H23 Cl N4 Ni O9 -","- C52 H92 Cl4 N16 Ni4 O36 -","4","1","AS1016","Lu, T.-H.; Tseng, F.; Luh, H.; Chung, C.-S.","Structure of a nickel(II) complex of the deprotonated anion of 3,6,6,9-tetramethyl-4,8-diaza-3,8-undecadiene-2,10-dione dioxime","Acta Crystallographica Section C","1993","49","4","666","668","10.1107/S0108270192009880","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001759","10.131","0.001","6.1431","0.0008","26.081","0.005","90","","98.01","0.01","90","","1607.3","0.4","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H24 Cl4 N2 Ni -","- C10 H24 Cl4 N2 Ni -","- C40 H96 Cl16 N8 Ni4 -","4","1","ST0567","Bond, M. R.; Willett, R. D.","Structure of dipiperidinium <i>catena</i>-poly[nickel-tri-μ-chloro(1–)] chloride","Acta Crystallographica Section C","1993","49","4","668","671","10.1107/S0108270192008837","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates,has disorder","278324","2022-10-03","14:41:53",""
"2001760","9.344","0.003","19.17","0.05","12.604","0.004","90","","90.13","0.02","90","","2258","6","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H15 I O4 P Re -","- C22 H15 I O4 P Re -","- C88 H60 I4 O16 P4 Re4 -","4","1","HU0414","Ingham, W. L.; Billing, D. G.; Levendis, D. C.; Coville, N. J.","Structure of <i>trans</i>-[Re(CO)~4~(PPh~3~)I]","Acta Crystallographica Section C","1993","49","4","671","674","10.1107/S010827019200934X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001761","11.01","0.003","10.791","0.003","8.356","0.002","83.56","0.02","86.11","0.02","64.67","0.02","891.4","0.4","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H14 Cl Cu N3 O6 -","- C17 H15 Cl Cu N3 O6 -","- C34 H30 Cl2 Cu2 N6 O12 -","2","1","AL0532","Muñoz, M. C.; Ruiz, R.; Julve, M.; Lloret, F.; Solans, X.","Synthesis and structure of (acetato-<i>O</i>,<i>O'</i>)(perchlorato-<i>O</i>)(2,2':6'2''-terpyridine-<i>N</i>,<i>N</i>',<i>N</i>'')copper(II)","Acta Crystallographica Section C","1993","49","4","674","677","10.1107/S0108270192004505","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001762","11.301","0.004","11.301","0.004","11.301","0.004","52.93","0.03","52.93","0.03","52.93","0.03","851.4","0.7","","","","","","","","","","","","4","R -3","-P 3*","","","","","- C26 H54 O6 W2 -","- C26 O6 W2 -","- C26 O6 W2 -","1","","CR0421","Gilbert, T. M.; Rogers, R. D.","Structure of [W~2~(μ-C~2~){OC(CH~3~)~3~}~6~]: a dimetallabutadiyne","Acta Crystallographica Section C","1993","49","4","677","680","10.1107/S0108270192010813","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001763","8.344","0.001","9.387","0.001","12.527","0.002","97.27","0.01","101.18","0.01","110.79","0.01","879.2","0.2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H19 Fe P -","- C22 H19 Fe P -","- C44 H38 Fe2 P2 -","2","1","AS1023","Adeleke, J. A.; Liu, L.-K.","Diphenylphosphinoferrocene","Acta Crystallographica Section C","1993","49","4","680","682","10.1107/S0108270192010436","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001764","9.972","0.001","8.308","0.001","17.01","0.002","90","","97.371","0.004","90","","1397.6","0.3","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C16 H15 Fe N3 -","- C16 H15 Fe N3 -","- C64 H60 Fe4 N12 -","4","1","HU1007","Houlton, A.; Ahmet, M. T.; Miller, J. R.; Silver, J.; Slade, E.","Structure of the 2-pyridylhydrazone of ferrocenecarbaldehyde","Acta Crystallographica Section C","1993","49","4","682","684","10.1107/S0108270192009363","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001765","10.59","0.007","17.606","0.006","8.493","0.003","90.1","0.03","102.22","0.05","106.85","0.04","1477.8","1.3","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C21 H30 Cl5 N O3 Pt Te2 -","- C21 H28 Cl5 N O3 Pt Te2 -","- C42 H56 Cl10 N2 O6 Pt2 Te4 -","2","1","BR1001","Drake, J. E.; Bailey, J. H. E.; Singh, A. K.; Srivastava, V.","{Bis[2-(4-ethoxyphenyltelluro)ethyl]amino-<i>N</i>,<i>Te</i>,<i>Te</i>'}chloroplatinum(II) chloride trichloromethane monohydrate","Acta Crystallographica Section C","1993","49","4","684","687","10.1107/S0108270192005961","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001766","11.463","0.003","18.641","0.006","15.762","0.005","90","","103.42","0.02","90","","3276.1","1.7","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H35 Cl2 P -","- C40 H35 Cl2 P -","- C160 H140 Cl8 P4 -","4","1","HU1004","Schumann, H.; Görlitz, F. H.; Schäfers, M.","Structure of dichloro(pentabenzylcyclopentadienyl)phosphine","Acta Crystallographica Section C","1993","49","4","688","690","10.1107/S0108270192009351","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001767","10.542","0.002","6.411","0.001","13.105","0.004","90","","106.47","0.02","90","","849.4","0.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H6 B N O6 -","- C7 H6 B N O6 -","- C28 H24 B4 N4 O24 -","4","1","ST0552","Soundararajan, S.; Duesler, E. N.; Hageman, J. H.","Structure of 4-carboxy-2-nitrobenzeneboronic acid","Acta Crystallographica Section C","1993","49","4","690","693","10.1107/S0108270192010916","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001768","6.9559","0.0004","9.913","0.0006","7.3045","0.0004","90","","119.41","0.04","90","","438.76","0.18","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C3 H3 N3 O2 -","- C3 H3 N3 O2 -","- C12 H12 N12 O8 -","4","1","HH1003","De Bondt, H. L.; Ragia, E.; Blaton, N. M.; Peeters, O. M.; De Ranter, C. J.","Structure of 4(5)-nitroimidazole at 100 K","Acta Crystallographica Section C","1993","49","4","693","695","10.1107/S0108270192011326","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001769","14.86","0.005","4.85","0.002","8.221","0.004","90","","105.58","0.04","90","","570.7","0.4","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C2 H5 O6 P -","- C2 H5 O6 P -","- C8 H20 O24 P4 -","4","1","MU1010","Lis, T.","Structure of phosphoglycolate (PG) in different ionization states. Structure of phosphoglycolic acid (H~3~PG) and its salts: KH~2~PG, NaH~2~PG, K~3~H~3~(PG)~2~, Na~2~HPG.0.5H~2~O, Na~5~H(PG)~2~.4H~2~O and Na~3~PG.4H~2~O","Acta Crystallographica Section C","1993","49","4","696","705","10.1107/S0108270192010758","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001770","10.57","0.006","4.588","0.003","7.935","0.004","90","","126.92","0.04","90","","307.6","0.3","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C2 H4 K O6 P -","- C2 H4 K O6 P -","- C4 H8 K2 O12 P2 -","2","1","MU1010","Lis, T.","Structure of phosphoglycolate (PG) in different ionization states. Structure of phosphoglycolic acid (H~3~PG) and its salts: KH~2~PG, NaH~2~PG, K~3~H~3~(PG)~2~, Na~2~HPG.0.5H~2~O, Na~5~H(PG)~2~.4H~2~O and Na~3~PG.4H~2~O","Acta Crystallographica Section C","1993","49","4","696","705","10.1107/S0108270192010758","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001771","9.782","0.006","5.366","0.003","11.175","0.009","90","","91.39","0.06","90","","586.4","0.7","","","","","","","","","","","","5","P 1 2/n 1","-P 2yac","","","","","- C2 H4 Na O6 P -","- C2 H4 Na O6 P -","- C8 H16 Na4 O24 P4 -","4","1","MU1010","Lis, T.","Structure of phosphoglycolate (PG) in different ionization states. Structure of phosphoglycolic acid (H~3~PG) and its salts: KH~2~PG, NaH~2~PG, K~3~H~3~(PG)~2~, Na~2~HPG.0.5H~2~O, Na~5~H(PG)~2~.4H~2~O and Na~3~PG.4H~2~O","Acta Crystallographica Section C","1993","49","4","696","705","10.1107/S0108270192010758","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001772","8.643","0.006","9.013","0.007","9.907","0.007","113.97","0.06","95.41","0.06","95.01","0.06","695.3","1","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C4 H7 K3 O12 P2 -","- C4 H7 K3 O12 P2 -","- C8 H14 K6 O24 P4 -","2","1","MU1010","Lis, T.","Structure of phosphoglycolate (PG) in different ionization states. Structure of phosphoglycolic acid (H~3~PG) and its salts: KH~2~PG, NaH~2~PG, K~3~H~3~(PG)~2~, Na~2~HPG.0.5H~2~O, Na~5~H(PG)~2~.4H~2~O and Na~3~PG.4H~2~O","Acta Crystallographica Section C","1993","49","4","696","705","10.1107/S0108270192010758","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001773","10.52","0.006","13.442","0.006","8.996","0.005","90","","90","","90","","1272.1","1.2","","","","","","","","","","","","5","P 21 21 2","P 2 2ab","","","","","- C2 H4 Na2 O7 P -","- C2 H4 Na2 O6.5 P -","- C16 H32 Na16 O52 P8 -","8","2","MU1010","Lis, T.","Structure of phosphoglycolate (PG) in different ionization states. Structure of phosphoglycolic acid (H~3~PG) and its salts: KH~2~PG, NaH~2~PG, K~3~H~3~(PG)~2~, Na~2~HPG.0.5H~2~O, Na~5~H(PG)~2~.4H~2~O and Na~3~PG.4H~2~O","Acta Crystallographica Section C","1993","49","4","696","705","10.1107/S0108270192010758","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001774","6.96","0.004","17.793","0.012","13.151","0.009","90","","96.88","0.05","90","","1616.9","1.8","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C4 H13 Na5 O16 P2 -","- C4 H13 Na5 O16 P2 -","- C16 H52 Na20 O64 P8 -","4","0.5","MU1010","Lis, T.","Structure of phosphoglycolate (PG) in different ionization states. Structure of phosphoglycolic acid (H~3~PG) and its salts: KH~2~PG, NaH~2~PG, K~3~H~3~(PG)~2~, Na~2~HPG.0.5H~2~O, Na~5~H(PG)~2~.4H~2~O and Na~3~PG.4H~2~O","Acta Crystallographica Section C","1993","49","4","696","705","10.1107/S0108270192010758","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001775","10.617","0.009","6.977","0.008","27.65","0.02","90","","90","","90","","2048","3","","","","","","","","","","","","5","P b c n","-P 2n 2ab","","","","","- C2 H10 Na3 O10 P -","- C2 H8 Na3 O11 P -","- C16 H64 Na24 O88 P8 -","8","1","MU1010","Lis, T.","Structure of phosphoglycolate (PG) in different ionization states. Structure of phosphoglycolic acid (H~3~PG) and its salts: KH~2~PG, NaH~2~PG, K~3~H~3~(PG)~2~, Na~2~HPG.0.5H~2~O, Na~5~H(PG)~2~.4H~2~O and Na~3~PG.4H~2~O","Acta Crystallographica Section C","1993","49","4","696","705","10.1107/S0108270192010758","","","1.5618","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001776","6.243","0.006","26.08","0.02","6.763","0.007","90","","115.29","0.09","90","","995.6","1.8","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C2 H10 Na3 O10 P -","- C2 H10 Na3 O10 P -","- C8 H40 Na12 O40 P4 -","4","1","MU1010","Lis, T.","Structure of phosphoglycolate (PG) in different ionization states. Structure of phosphoglycolic acid (H~3~PG) and its salts: KH~2~PG, NaH~2~PG, K~3~H~3~(PG)~2~, Na~2~HPG.0.5H~2~O, Na~5~H(PG)~2~.4H~2~O and Na~3~PG.4H~2~O","Acta Crystallographica Section C","1993","49","4","696","705","10.1107/S0108270192010758","","","1.54118","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001777","10.832","0.004","24.89","0.013","13.924","0.002","90","","111.88","0.02","90","","3484","2","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C14 H20 B10 -","- C14 H20 B10 -","- C112 H160 B80 -","8","2","MU1026","Lewis, Z. G.; Welch, A. J.","Structure of 1,2-diphenylcarbaborane, 1,2-Ph~2~-1,2-<i>closo</i>-C~2~B~10~H~10~","Acta Crystallographica Section C","1993","49","4","705","710","10.1107/S0108270192012125","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001778","11.014","0.004","11.03","0.007","12.333","0.006","67.83","0.05","80.78","0.04","60.2","0.05","1203.3","1.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H36 B9 N -","- C25 H20 B9 N -","- C50 H40 B18 N2 -","2","1","MU1027","Cowie, J.; Donohoe, D. J.; Douek, N. L.; Welch, A. J.","Structures of [HNEt~3~]^+^ and [Me~3~NCH~2~C~6~H~5~]^+^ salts of [7,8-Ph~2~-7,8-<i>nido</i>-C~2~B~9~H~10~]^{–^}","Acta Crystallographica Section C","1993","49","4","710","714","10.1107/S0108270192012137","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001779","10.751","0.004","21.662","0.004","11.975","0.003","90","","106.59","0.02","90","","2672.7","1.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H36 B9 N -","- C24 H36 B9 N -","- C96 H144 B36 N4 -","4","1","MU1027","Cowie, J.; Donohoe, D. J.; Douek, N. L.; Welch, A. J.","Structures of [HNEt~3~]^+^ and [Me~3~NCH~2~C~6~H~5~]^+^ salts of [7,8-Ph~2~-7,8-<i>nido</i>-C~2~B~9~H~10~]^{–^}","Acta Crystallographica Section C","1993","49","4","710","714","10.1107/S0108270192012137","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001780","10.9534","0.0015","13.274","0.003","11.5283","0.0017","90","","90.074","0.012","90","","1676.2","0.5","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C33 H36 B9 Cl2 Hg P -","- C33 H33 B9 Cl2 Hg P -","- C66 H66 B18 Cl4 Hg2 P2 -","2","1","MU1028","Lewis, Z. G.; Welch, A. J.","Structure of 7,8-Ph~2~-10-<i>endo</i>-PPh~3~Hg-7,8-<i>nido</i>-C~2~B~9~H~9~ methylene chloride solvate","Acta Crystallographica Section C","1993","49","4","715","718","10.1107/S0108270192012149","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001781","8.539","0.004","15.564","0.007","18.768","0.01","90.97","0.03","95.25","0.03","102.24","0.03","2426","2","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H21 Cl2 O4 P -","- C26 H21 Cl2 O4 P -","- C104 H84 Cl8 O16 P4 -","4","2","HL1016","Lynch, D. E.; Smith, G.; Byriel, K. A.; Kennard, C. H. L.","Molecular co-crystals of carboxylic acids. 11. Structure of the 1:1 adduct of triphenylphosphine oxide with (3,4-dichlorophenoxy)acetic acid","Acta Crystallographica Section C","1993","49","4","718","721","10.1107/S0108270192011193","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001782","8.654","0.002","6.428","0.001","21.032","0.003","90","","95.7","0.2","90","","1164.2","0.5","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H43 N O3 -","- C25 H43 N O3 -","- C50 H86 N2 O6 -","2","1","AB1023","Palmer, R. A.; Palmer, H. T.; Lisgarten, J. N.; Lancaster, R.","Polymorphism in dethoxyprone, a steroidal anaesthetic. I. Structure of 11α-dimethylamino-2β-ethoxy-3α-hydroxy-5α-pregnan-20-one (dethoxyprone form I)","Acta Crystallographica Section C","1993","49","4","721","723","10.1107/S0108270192009028","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001783","13.4077","0.0003","12.6064","0.0003","19.0523","0.0006","90","","98.392","0.002","90","","3185.79","0.15","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C11 H16 N2 -","- C11 H16 N2 -","- C132 H192 N24 -","12","6","AL1008","Llamas-Saiz, A. L.; Foces-Foces, C.; Sobrados, I.; Elguero, J.; Meutermans, W.","(4<i>S</i>,7<i>R</i>)-7,8,8-Trimethyl-4,5,6,7-tetrahydro-4,7-methano-1<i>H</i>(2<i>H</i>)-indazole (campho[2,3-<i>c</i>]pyrazole): comparison between the X-ray structure and carbon-13 NMR data in the solid state","Acta Crystallographica Section C","1993","49","4","724","729","10.1107/S0108270192010187","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001784","7.407","0.002","14.442","0.003","17.696","0.003","90","","90","","90","","1893","0.7","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C21 H34 O4 -","- C21 H34 O4 -","- C84 H136 O16 -","4","1","CD1002","Dias Rodrigues, A. M. G.; de Almeida Santos, R. H.; Lechat, J. R.","Structure of (4α)-13-hydroxykaur-16-en-18-oic acid (steviol) methanol solvate","Acta Crystallographica Section C","1993","49","4","729","731","10.1107/S0108270192009181","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","199444","2020-10-21","18:00:00",""
"2001785","8.5","0.004","14.271","0.007","12.758","0.006","90","","91.97","0.02","90","","1546.7","1.3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C19 H15 N3 O2 -","- C19 H15 N3 O2 -","- C76 H60 N12 O8 -","4","1","AL1020","Ashkenazi, P.; Kaftory, M.","Structures of Diels‒Alder mono-adducts of 4-phenyl- or 4-methyl-1,2,4-triazolidine-3,5-dione with 11-substituted-1,6-methano[10]annulene","Acta Crystallographica Section C","1993","49","4","731","735","10.1107/S0108270192012253","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001786","6.421","0.003","10.872","0.005","10.564","0.005","90","","91.05","0.02","90","","737.3","0.6","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H15 N3 O4 -","- C16 H15 N3 O4 -","- C32 H30 N6 O8 -","2","1","AL1020","Ashkenazi, P.; Kaftory, M.","Structures of Diels‒Alder mono-adducts of 4-phenyl- or 4-methyl-1,2,4-triazolidine-3,5-dione with 11-substituted-1,6-methano[10]annulene","Acta Crystallographica Section C","1993","49","4","731","735","10.1107/S0108270192012253","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001787","26.027","0.013","10.155","0.005","6.147","0.003","96.99","0.03","93.58","0.03","92.64","0.03","1607.1","1.4","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C19 H16 N4 O2 -","- C19 H16 N4 O2 -","- C76 H64 N16 O8 -","4","2","AL1020","Ashkenazi, P.; Kaftory, M.","Structures of Diels–Alder mono-adducts of 4-phenyl- or 4-methyl-1,2,4-triazolidine-3,5-dione with 11-substituted-1,6-methano[10]annulene","Acta Crystallographica Section C","1993","49","4","731","735","10.1107/S0108270192012253","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001788","9.808","0.004","8.78","0.005","17.248","0.006","90","","101.7","0.04","90","","1454.4","1.2","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C64 H64 N8 O8 -","4","1","DU1008","Reboul, J. P.; Pèpe, G.; Siri, D.; Oddon, Y.; Caranoni, C.; Rahal, H.; Soyfer, J. C.; Barbe, J.","2,2'-Bis(acetamido)biphenyl","Acta Crystallographica Section C","1993","49","4","735","738","10.1107/S0108270192009910","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001789","6.9196","0.0005","7.673","0.008","18.554","0.001","90","","92.547","0.006","90","","984.1","1","","","","","","","","","","","","4","P 1 21 1","","","","","","- C17 H19 N5 O8 -","- C17 H19 N5 O8 -","- C34 H38 N10 O16 -","2","1","CD0068","Metzger, R. M.; Atwood, J. L.; Lee, W.-J.; Rao, S. M.; Lal, R. B.; Loo, B. H.","Structure of MAP:MNA, the 1:1 adduct between (<i>R</i>)-methyl 2-(2,4-dinitroanilino)propanoate (MAP) and 2-methyl-4-nitroaniline (MNA), a new nonlinear optical crystal","Acta Crystallographica Section C","1993","49","4","738","741","10.1107/S0108270192004530","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001790","7.845","0.001","6.462","0.003","18.92","0.004","90","","93.18","0.02","90","","957.7","0.5","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H6 N4 O5 -","- C8 H6 N4 O5 -","- C32 H24 N16 O20 -","4","1","NA1016","Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.","Structure and crystal packing of the antibacterial drug 1-{[(5-nitro-2-furanyl)methylene]amino}-2,4-imidazolidinedione (nitrofurantoin)","Acta Crystallographica Section C","1993","49","4","741","744","10.1107/S010827019201062X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001791","7.426","0.001","28.301","0.001","5.227","0.001","92.58","0.01","99.18","0.01","92.56","0.01","1081.9","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H40 Cl N O -","- C21 H40 Cl N O -","- C42 H80 Cl2 N2 O2 -","2","1","SH1012","Paradies, H. H.; Habben, F.","Structure of <i>N</i>-hexadecylpyridinium chloride monohydrate","Acta Crystallographica Section C","1993","49","4","744","747","10.1107/S010827019201179X","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001792","9.564","0.002","11.305","0.001","20.389","0.003","90","","91.27","0.01","90","","2203.9","0.6","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C26 H22 N4 O2 -","- C26 H22 N4 O2 -","- C104 H88 N16 O8 -","4","1","HA1001","Akkurt, M.; Hiller, W.","Structure of 5-benzoyl-1-[4-(dimethylamino)phenylmethyleneamino]-4-phenyl-1<i>H</i>-pyrimidin-2-one","Acta Crystallographica Section C","1993","49","4","747","749","10.1107/S0108270192005651","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001793","9.12","0.005","9.157","0.005","17.505","0.004","90","","90","","123.98","0.03","1212.2","1.1","","","","","","","","","","","","7","P 1 1 21/a","-P 2ac","14","","","","- C4 H10 Br3 K O Pt S -","- C4 H10 Br3 K O Pt S -","- C16 H40 Br12 K4 O4 Pt4 S4 -","4","1","VS1000","Belsky, V. K.; Konovalov, V. E.; Kukushkin, V. Yu.","Structure of potassium tribromo(diethyl sulfoxide)platinate(II)","Acta Crystallographica Section C","1993","49","4","751","752","10.1107/S0108270192008308","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208448","2020-10-21","18:00:00",""
"2001794","7.984","0.002","16.019","0.002","10.172","0.002","90","","94.27","0.01","90","","1297.3","0.4","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H14 Cl2 O4 Sn -","- C8 H14 Cl2 O4 Sn -","- C32 H56 Cl8 O16 Sn4 -","4","1","OH1001","Ng, S. W.","Structure of bis(2-methoxycarbonylethyl-<i>C</i>',<i>O</i>)tin dichloride","Acta Crystallographica Section C","1993","49","4","753","754","10.1107/S0108270192008862","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001795","12.1759","0.0007","12.8661","0.0009","14.3293","0.0009","79.041","0.005","71.665","0.005","69.467","0.005","1987.4","0.2","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C86 H82 N2 O10 Sn4 -","- C86 H82 N2 O10 Sn4 -","- C86 H82 N2 O10 Sn4 -","1","0.5","OH1002","Ng, S. W.; Kumar Das, V. G.","Structure of bis(triphenyltin) succinate‒[bis(triphenyltin) succinate bis(<i>N</i>,<i>N</i>-dimethylformamide)] (1/1)","Acta Crystallographica Section C","1993","49","4","754","756","10.1107/S0108270192008874","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001796","16.28","0.003","17.204","0.003","17.738","0.004","90","","101.42","0.02","90","","4869.7","1.7","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C32 H72 Mo6 N2 O19 -","- C32 H72 Mo6 N2 O19 -","- C128 H288 Mo24 N8 O76 -","4","0.5","HH1016","Rheingold, A. L.; White, C. B.; Haggerty, B. S.; Maatta, E. A.","Bis(tetrabutylammonium) nonadecaoxohexamolybdenum(VI): a second polymorph","Acta Crystallographica Section C","1993","49","4","756","758","10.1107/S0108270192007765","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001797","10.099","0.002","11.4014","0.0008","15.682","0.003","95.145","0.009","92.72","0.02","98.29","0.01","1776.3","0.5","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C40 H36 As N O S Sn -","- C40 H36 As N O S Sn -","- C80 H72 As2 N2 O2 S2 Sn2 -","2","1","OH1003","Ng, S. W.; Kumar Das, V. G.","Structure of tribenzyl(thiocyanato-<i>N</i>)(triphenylarsine oxide-<i>O</i>)tin","Acta Crystallographica Section C","1993","49","4","758","760","10.1107/S0108270192009843","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001798","11.658","0.001","13.001","0.001","15.251","0.002","70.621","0.008","68.538","0.008","66.049","0.007","1919.8","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H25 Fe O2 Rh -","- C22 H25 Fe O2 Rh -","- C88 H100 Fe4 O8 Rh4 -","4","2","LI9126","Swarts, J. C.; Vosloo, T. G.; Leipoldt, J. G.; Lamprecht, G. J.","Structure of (η^4^-1,5-cyclooctadiene)(1-ferrocenyl-1,3-butanedionato-κ^2^<i>O</i>,<i>O</i>')rhodium(I)","Acta Crystallographica Section C","1993","49","4","760","763","10.1107/S0108270192009569","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001799","6.962","0.004","13.754","0.007","22.974","0.012","90","","90","","90","","2200","2","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C11 H12 N4 O2 -","- C11 H12 N4 O2 -","- C88 H96 N32 O16 -","8","1","GR1000","De Bondt, H. L.; Blaton, N. M.; Peeters, O. M.; De Ranter, C. J.","Structure of 5-benzylamino-1-methyl-4-nitroimidazole","Acta Crystallographica Section C","1993","49","4","763","765","10.1107/S0108270192009570","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001800","6.981","0.007","11.443","0.009","9.255","0.011","76.15","0.08","85.75","0.09","74.13","0.07","690.4","1.2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H17 Br N2 -","- C17 H17 Br N2 -","- C34 H34 Br2 N4 -","2","1","MU0296","Dunaj-Jurčo, M.; Mikloš, D.; Jendrichovský, J.","Structure of 11-(4-bromophenyl)-1,2,3,4,5,6-hexahydro-1,6-methano-1,6-benzodiazocine","Acta Crystallographica Section C","1993","49","4","765","766","10.1107/S0108270192007145","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001801","6.491","0.002","10.152","0.001","13.358","0.001","90","","100.74","0.01","90","","864.8","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H28 P2 S2 -","- C12 H28 P2 S2 -","- C24 H56 P4 S4 -","2","0.5","AL1010","Sillanpää, R.; Ergin, Ö.; Çelebi, S.","Tetra-<i>n</i>-propyl-1,2-dithioxodi-λ^5^-phosphane","Acta Crystallographica Section C","1993","49","4","767","768","10.1107/S0108270192007625","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001802","19.048","0.006","10.507","0.004","6.691","0.004","90","","90","","90","","1339.1","1","","","","","","","","","","","","4","P n a 21","","","","","","- C13 H14 N4 O3 -","- C13 H14 N4 O3 -","- C52 H56 N16 O12 -","4","1","HU1003","Bardi, R.; Piazzesi, A. M.; Del Pra, A.","Structure of ethyl 2-(3-methyl-1,2,4-oxadiazol-5-yl)-2-phenylhydrazonoethanoate","Acta Crystallographica Section C","1993","49","4","768","770","10.1107/S0108270192009806","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001803","6.628","0.004","12.604","0.006","20.774","0.011","90","","90","","90","","1735.4","1.6","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C20 H20 O5 -","- C20 O5 -","- C80 O20 -","4","1","GR0196","Galinis, D. L.; Swenson, D. C.; Wiemer, D. F.","Structure of a 2'-oxo-8.1'-neolignan","Acta Crystallographica Section C","1993","49","4","770","772","10.1107/S0108270192009557","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001804","40.88","0.01","6.733","0.004","30.16","0.01","90","","132.08","0.03","90","","6161","5","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H18 O Si -","- C8 H18 O Si -","- C192 H432 O24 Si24 -","24","3","GR0205","Negron, A.; Barnes, C. L.; Soderquist, J. A.","1,1,4-Trimethylsilacyclohexan-4-ol","Acta Crystallographica Section C","1993","49","4","772","774","10.1107/S010827019200965X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2001805","9.797","0.004","15.039","0.007","20.135","0.008","90","","90","","90","","2967","2","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C31 H46 Cl2 O7 -","- C31 H46 Cl3 O7 -","- C124 H184 Cl12 O28 -","4","1","HH0595","Toscano, R. A.; Ortega, A.; Maldonado, E.; Gaviño, R.; Lozoya, X.; Tortoriello, J.","Structure of galphimine B","Acta Crystallographica Section C","1993","49","4","774","776","10.1107/S0108270192006644","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001806","12.78","0.001","6.478","0.001","16.832","0.002","90","","93","0.01","90","","1391.6","0.3","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C30 H34 O7 -","- C30 H34 O7 -","- C60 H68 O14 -","2","1","ST1029","Abboud, K. A.; Jiang, S.; Enholm, E. J.","Structure of a coupled carbohydrate and terpene","Acta Crystallographica Section C","1993","49","4","776","778","10.1107/S0108270192010655","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001807","10.402","0.002","15.025","0.003","9.467","0.002","90","","96.24","0.03","90","","1470.8","0.5","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H6 N2 O2 -","- C8 H6 N2 O2 -","- C64 H48 N16 O16 -","8","2","NA1014","Benetollo, F.; Del Pra, A.","Structure of 1<i>H</i>-indazole-3-carboxylic acid","Acta Crystallographica Section C","1993","49","4","779","781","10.1107/S0108270192010618","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001808","10.075","0.001","8.257","0.001","7.482","0.001","90","","90","","90","","622.42","0.13","293","","293","1","","","","","","","","5","C m c m","-C 2c 2","63","","Dithallium pentafluoroaluminate hydrate","","- Al F5 H2 O Tl2 -","- Al F5 O Tl2 -","- Al4 F20 O4 Tl8 -","4","0.25","SE1018","Molinier, M.; Massa, W.","Refinement of the structure of Tl~2~AlF~5~.H~2~O","Acta Crystallographica Section C","1993","49","4","782","784","10.1107/S010827019201148X","","","0.71069","MoKα","","","0.0382","","","0.0301","","","","","2.47","2.47","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001809","10.0049","0.0011","11.7555","0.0012","6.5374","0.0005","90","","99.687","0.006","90","","757.92","0.13","298","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- As2 Hg3 O8 -","- As2 Hg3 O8 -","- As8 Hg12 O32 -","4","1","MU1008","Larsson, A.-K.; Lidin, S.; Stålhandske, C.; Albertsson, J.","Mercury(II) arsenate, a graphtonite-type structure","Acta Crystallographica Section C","1993","49","4","784","786","10.1107/S0108270192010588","","","0.71069","MoKα","","","0.0446","","","0.0531","","","","","1.48","1.48","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001810","9.45","0.001","9.45","0.001","19.068","0.009","90","","90","","90","","1702.8","0.8","300","","","","","","","","","","","3","P 4/m n c","-P 4 2n","","","","","- In Nb3 Se12 -","- In Nb3 Se12 -","- In4 Nb12 Se48 -","4","0.25","MU1022","Deng, S.; Zhuang, H.; Huang, Jinshun; Huang, Jingling","A new one-dimensional compound: synthesis and structure of InNb~3~(Se~2~)~6~","Acta Crystallographica Section C","1993","49","4","786","788","10.1107/S0108270192010904","","","0.71069","MoKα","","","0.045","","","0.051","","","","","1.15","1.15","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001811","8.88","0.001","10.594","0.001","16.387","0.002","71.2","0.01","89.85","0.01","77.74","0.01","1422.5","0.3","292","","292","","","","","","","","","6","P -1","-P 1","2","","1-Benzhydryl-4-(2-benzoylethyl)piperazonium Tetrachlorocuprate(II) Monohydrate","","- C26 H32 Cl4 Cu N2 O2 -","- C26 H30 Cl4 Cu N2 O2.33 -","- C52 H60 Cl8 Cu2 N4 O4.66 -","2","1","MU1015","Macíček, J.; Tcholakova, J.; Parvanova, M.","Structure of 1-benzhydryl-4-(2-benzoylethyl)piperazinium tetrachlorocuprate(II) hydrate","Acta Crystallographica Section C","1993","49","4","788","790","10.1107/S0108270192012058","","","0.71073","MoKα","","0.139","0.098","","0.084","0.076","","","","2.727","3.089","3.089","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001812","10.07","0.002","8.156","0.001","28.82","0.007","90","","92.49","0.02","90","","2364.8","0.8","230","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H33 B4 Fe N Pb Si -","- C19 H33 B4 Fe N Pb Si -","- C76 H132 B16 Fe4 N4 Pb4 Si4 -","4","1","CR1014","Zhang, H.; Jia, L.; Hosmane, N. S.","1-(<i>N</i>,<i>N</i>-Dimethylferrocenylmethylamine)-2-methyl-3-(trimethylsilyl)-2,3-dicarba-1-plumba-<i>closo</i>-heptaborane(6)","Acta Crystallographica Section C","1993","49","4","791","793","10.1107/S0108270192010576","","","0.71073","MoKα","","","0.039","","","0.042","","","","","1.04","1.04","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001813","13.409","0.003","20.196","0.005","16.517","0.004","90","","90","","90","","4472.9","1.8","295","","","","","","","","","","","6","P n a 21","P 2c -2n","","","","","- C43 H35 Cl3 N8 O13 Pt2 -","- C43 H34 Cl3 N8 O13 Pt2 -","- C172 H136 Cl12 N32 O52 Pt8 -","4","1","SP1005","Bailey, J. A.; Miskowski, V. M.; Gray, H. B.","A diphenylformamidinate-bridged terpyridineplatinum(II) dimer","Acta Crystallographica Section C","1993","49","4","793","796","10.1107/S0108270192010229","","","0.71073","MoKα","","","0.03","","","0.003","","","","","2.07","2.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001814","11.656","0.004","13.798","0.005","13.738","0.005","90","","92.45","0.03","90","","2207.5","1.4","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H23 Cl4 N5 Zn2 -","- C16 H23 Cl4 N5 Zn2 -","- C64 H92 Cl16 N20 Zn8 -","4","1","CR1007","Sosa-Torres, M. E.; Ugalde-Saldívar, V. M.; Rosales-Hoz, M. J.; Toscano, R. A.","Structure of [1,9-bis(2-pyridyl)-2,5,8-triazanonane]zinc(II) tetrachlorozincate(II)","Acta Crystallographica Section C","1993","49","4","796","799","10.1107/S0108270192010564","","","1.5418","CuKα","","","0.072","","","0.078","","","","","1.471","1.471","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001815","9.149","0.0009","19.371","0.003","13.7536","0.0014","90","","99.061","0.008","90","","2407.1","0.5","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Cl4 Cu2 N4 O4 -","- C20 H20 Cl4 Cu2 N4 O4 -","- C80 H80 Cl16 Cu8 N16 O16 -","4","1","HA1013","Blake, A. J.; Winpenny, R. E. P.","Tetrachlorobis(2-pyridone)-bis(μ~2~-2-pyridone)-dicopper","Acta Crystallographica Section C","1993","49","4","799","801","10.1107/S010827019201117X","","","0.71073","MoKα","","","0.0382","","","0.0417","","","","","1.051","1.051","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001816","7.5322","0.0007","12.652","0.002","17.985","0.004","90","","90","","90","","1713.9","0.5","298","3","","","","","","","","","","6","P n 21 a","P -2ac -2n","","","","","- C13 H21 Cu N5 O2 S -","- C14 H19 Cu N5 O2 S -","- C56 H76 Cu4 N20 O8 S4 -","4","1","AS1017","Tahirov, T. H.; Lu, T.-H.; Luh, H.; Chung, C.-S.","Structure of [3,10-dimethyl-4,9-diaza-3,9-dodecadiene-2,11-dione dioximato(1‒)](isothiocyanato)copper(II)","Acta Crystallographica Section C","1993","49","4","801","803","10.1107/S0108270192011089","","","0.7093","MoKα","","","0.034","","","0.036","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001817","12.274","0.002","14.358","0.002","10.798","0.002","92.68","0.01","96.73","0.01","82.36","0.01","1872.1","0.5","293","","","","","","","","","","","8","P -1","-P 1","2","","{N^2^-[2,2-Bis(diphenylphosphino)ethyl]-N^1^,N^1^-dimethylethane-1,2-diamine}- 1κ^2^P,P':2κ^2^N^1^,N^2^-tetracarbonyl-1κ^4^C-dichloro-2κ^2^Cl- molybdenumzinc(II)","","- C34 H34 Cl2 Mo N2 O4 P2 Zn -","- C34 H34 Cl2 Mo N2 O4 P2 Zn -","- C68 H68 Cl4 Mo2 N4 O8 P4 Zn2 -","2","1","SH1029","Flörke, U.; Haupt, H.-J.","{<i>N</i>^2^-[2,2-Bis(diphenylphosphino)ethyl]-<i>N</i>^1^,<i>N</i>^1^-dimethylethane-1,2-diamine}-1κ^2^<i>P</i>,<i>P</i>':2κ^2^<i>N</i>^1^,<i>N</i>^2^-tetracarbonyl-1κ^4^<i>C</i>-dichloro-2κ^2^<i>Cl</i>-molybdenumzinc(II), a bimetal complex with a hetero-bifunctional ligand","Acta Crystallographica Section C","1993","49","4","803","805","10.1107/S010827019201237X","","","0.71073","MoKα","","","0.033","","","0.031","","","","","1.854","1.854","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001818","11.47","0.002","12.645","0.003","13.027","0.003","118.18","0.01","90.26","0.02","92.37","0.02","1663.4","0.6","133","1","133","1","","","","","","","","5","P -1","-P 1","2","","η^3^-allylpalladium-μ-(η^1^:η^6^- diphenylmethyl)tricarbonylchromium","","- C19 H16 Cr O3 Pd -","- C19 H15 Cr O3 Pd -","- C76 H60 Cr4 O12 Pd4 -","4","2","MU1029","Kalinin, V. N.; Cherepanov, I. A.; Moiseev, S. K.; Dolgushin, F. M.; Yanovsky, A. I.; Struchkov, Yu. T.","2-η^3^-Allyl-1,1,1-tricarbonyl-μ-(η^1^:η^6^-diphenylmethyl)chromiumpalladium(<i>Pd</i>‒<i>Cr</i>) at 130 K","Acta Crystallographica Section C","1993","49","4","805","808","10.1107/S0108270192011223","","","0.71073","MoKα","","0.0302","0.03","","0.0623","0.063","","","","1.044","1.063","1.063","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2001819","7.705","0.011","9.664","0.01","11.285","0.014","82.17","0.09","70.42","0.09","71.75","0.09","751.4","1.7","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H42 Ba O10 -","- C22 H40 Ba O10 -","- C22 H40 Ba O10 -","1","0.5","CR1022","Rheingold, A. L.; White, C. B.; Haggerty, B. S.; Kirlin, P.; Gardiner, R. A.","Barium bis(trimethylacetate)–18-crown-6 (1/1)","Acta Crystallographica Section C","1993","49","4","808","810","10.1107/S0108270192010825","","","0.71073","MoKα","","","0.0561","","","0.0732","","","","","1.72","1.72","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001820","11.5961","0.0008","3.6323","0.0004","18.531","0.001","90","","94.02","0.006","90","","778.61","0.11","110","","110","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,4,5-trihydroxybenzohydroxamic acid, monohydrate","","- C7 H9 N O6 -","- C7 H9 N O6 -","- C28 H36 N4 O24 -","4","1","AB1042","Nielsen, B. B.; Larsen, I. K.","3,4,5-Trihydroxybenzohydroxamic acid monohydrate, a ribonucleotide reductase inhibitor","Acta Crystallographica Section C","1993","49","4","810","813","10.1107/S0108270192011442","","","1.5418","CopperKα","","","0.045","","","0.064","","","","","2.091","2.091","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001821","5.769","0.002","15.39","0.01","8.504","0.003","90","","109.43","0.03","90","","712","0.6","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Isopropylammonium-dihydrogen-monophosphate","","- C3 H12 N O4 P -","- C3 H12 N O4 P -","- C12 H48 N4 O16 P4 -","4","1","PA1023","Averbuch-Pouchot, M.-T.","Isopropylammonium dihydrogenmonophosphate and isopropylammonium monohydrogenphosphite","Acta Crystallographica Section C","1993","49","4","813","815","10.1107/S0108270192010898","","","0.7107","MoKα","","0.048","0.025","","","0.027","","","","","0.39","0.39","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001822","8.125","0.009","12.677","0.01","7.172","0.009","90","","90","","90","","738.7","1.4","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","isopropylammonium monohydrogen-phosphite","","- C3 H12 N O3 P -","- H12 P8 -","- H48 P32 -","4","1","PA1023","Averbuch-Pouchot, M.-T.","Isopropylammonium dihydrogenmonophosphate and isopropylammonium monohydrogenphosphite","Acta Crystallographica Section C","1993","49","4","813","815","10.1107/S0108270192010898","","","0.5608","AgKα","","0.043","0.043","","0.045","0.045","","","","0.536","0.536","0.536","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001823","9.792","0.001","8.487","0.001","7.411","0.002","90","","100.43","0.02","90","","605.71","0.19","295","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C2 H8 N O5 P -","- C2 H9 N O5 P -","- C8 H36 N4 O20 P4 -","4","1","PA1020","Averbuch-Pouchot, M.-T.","Structures of glycinium phosphite and glycylglycinium phosphite","Acta Crystallographica Section C","1993","49","4","815","818","10.1107/S0108270192010771","","","0.5608","AgKα","","","0.027","","","0.027","","","","","0.317","0.317","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001824","10.003","0.004","4.924","0.001","9.343","0.002","90","","90.88","0.02","90","","460.1","0.2","295","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C4 H11 N2 O6 P -","- C4 H11 N2 O6 P -","- C8 H22 N4 O12 P2 -","2","1","PA1020","Averbuch-Pouchot, M.-T.","Structures of glycinium phosphite and glycylglycinium phosphite","Acta Crystallographica Section C","1993","49","4","815","818","10.1107/S0108270192010771","","","0.5608","AgKα","","","0.028","","","0.03","","","","","0.231","0.231","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001825","12.01","0.003","6.681","0.005","42.09","0.008","90","","90","","90","","3377","3","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C31 H42 O9 S2 -","- C31 H42 O9 S2 -","- C124 H168 O36 S8 -","4","1","PA1024","Hamzaoui, F.; Lamiot, J.; Baert, F.","X-ray structure of a new pyrethroid, RU 52259","Acta Crystallographica Section C","1993","49","4","818","820","10.1107/S010827019201134X","","","1.5419","CuKα","","","0.062","","","0.062","","","","","7.4","7.4","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2001826","7.7305","0.0007","16.723","0.0015","26.668","0.003","90","","90","","90","","3447.6","0.6","293","","293","","","","","","","","","3","P c a b","-P 2bc 2ac","61","Tribenzylmethanol","Tribenzylmethanol","","- C22 H22 O -","- C22 H24 O -","- C176 H192 O8 -","8","1","LI1032","Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Liles, D. C.; Zakaria, C. M.","Structures of tribenzylmethanol and 1,2,3-triphenyl-2-propanol","Acta Crystallographica Section C","1993","49","4","820","824","10.1107/S0108270192011545","","","0.7093","MolybdenumKα","","0.106","0.032","","0.044","0.036","","","","","1.19","1.19","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001827","23.0194","0.0012","6.0483","0.0005","23.7136","0.0012","90","","98.012","0.004","90","","3269.4","0.4","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Dibenzylphenylmethanol","1,2,3-Triphenyl-2-propanol","","- C21 H20 O -","- C21 H20.5 O -","- C168 H164 O8 -","8","2","LI1032","Ferguson, G.; Gallagher, J. F.; Glidewell, C.; Liles, D. C.; Zakaria, C. M.","Structures of tribenzylmethanol and 1,2,3-triphenyl-2-propanol","Acta Crystallographica Section C","1993","49","4","820","824","10.1107/S0108270192011545","","","0.7093","MolybdenumKα","","0.129","0.05","","0.063","0.052","","","","","1.28","1.28","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001828","6.23","","10.701","","15.55","","90","","90","","90","","1036.68","","293","1","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C11 H12 N2 O2 -","- C11 H12 N2 O2 -","- C44 H48 N8 O8 -","4","1","PA1028","Coquerel, G.; Petit, M. N.; Robert, F.","Structure of (+)-(<i>S</i>)-5-phenyl-5-ethylhydantoin","Acta Crystallographica Section C","1993","49","4","824","825","10.1107/S0108270192011788","","","0.71069","MoKα","","","0.037","","","0.039","","","","","2.36","2.36","","","","","has coordinates","176340","2020-10-21","18:00:00",""
"2001829","7.799","0.001","9.872","0.001","11.77","0.001","109.638","0.004","100.339","0.006","97.756","0.006","820.77","0.16","130","","130","","","","","","","","","4","P -1","-P 1","2","","rac-1-methyl-3-nitro-{(1R,6S,8S)-6-phenyl-5,8-(tetramethylene)tricyclo [3.2.1.0^2.7^]oct-3-eno}[4,3-b]pyrrole","","- C21 H22 N2 O2 -","- C21 H22 N2 O2 -","- C42 H44 N4 O4 -","2","1","AB1037","Meetsma, A.; ten Have, R.; Leusink, F. R.; van Leusen, A. M.","Structure of a tricyclo[3.2.1.0^2,7^]octene derivative: a double bridged central ring in an octahydrobenz[<i>g</i>]-3-nitroindole","Acta Crystallographica Section C","1993","49","4","826","828","10.1107/S0108270192011156","","","0.71073","MoKα","","0.051","0.048","","0.059","0.058","","","","0.725","0.751","0.751","","","","","has coordinates","207946","2020-10-21","18:00:00",""
"2001830","5.648","0.002","26.369","0.008","11.868","0.004","90","","90.19","0.02","90","","1767.5","1","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S,3R)-2-amino-3-hydroxyl-3-(1,2:3,4-di-o-isopropylidène- α-D-galactopyranos-5-yl) propanoate de méthyle","","- C15 H25 N O8 -","- C15 H25 N O8 -","- C60 H100 N4 O32 -","4","2","PA1031","Chiaroni, A.; Riche, C.; El Hadrami, E. M.; Lavergne, J.-P.; Viallefont, P.","Structure du (2<i>S</i>,6'<i>R</i>)-2-amino-2-(1,2:3,4-di-<i>O</i>-isopropylidène-α-<small>D</small>-galactopyranos-6-yl)acétate de méthyle","Acta Crystallographica Section C","1993","49","4","828","830","10.1107/S0108270192011399","","","1.5418","CuKα","","","0.038","","","0.051","","","","","0.98","0.98","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001831","11.213","0.002","22.656","0.004","13.397","0.003","90","","110.7","0.01","90","","3183.7","1.1","289","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C38 H36 Si3 -","- C38 H36 Si3 -","- C152 H144 Si12 -","4","1","NA1013","Van Meervelt, L.","Structure of 1,3-bis(1-pyrenyl)hexamethyltrisilane","Acta Crystallographica Section C","1993","49","4","831","833","10.1107/S0108270192010606","","","1.54178","CuKα","","","0.0424","","","0.0451","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001832","27.729","0.005","5.0311","0.0007","6.105","0.001","90","","99.57","0.02","90","","839.8","0.2","295","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C9 H7 N O4 -","- C9 H7 N O4 -","- C36 H28 N4 O16 -","4","1","OH1006","Kageyama, Y.; Iwamoto, T.; Haisa, M.; Kashino, S.","Structure of the photostable form of <i>p</i>-nitrocinnamic acid","Acta Crystallographica Section C","1993","49","4","833","834","10.1107/S0108270192010886","","","1.54178","CuKα","","","0.045","","","0.055","","","","","2.91","2.91","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001833","16.861","0.007","11.539","0.003","11.146","0.005","90","","125.08","0.03","90","","1774.6","1.3","293","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C5 H8 N3 O5 P -","- C5 H8 N3 O5 P -","- C40 H64 N24 O40 P8 -","8","1","PA1015","Pecaut, J.; Bagieu-Beucher, M.","2-Amino-5-nitropyridinium monohydrogenphosphite","Acta Crystallographica Section C","1993","49","4","834","837","10.1107/S0108270192011302","","","0.71073","MoKα","","","0.04","","","0.042","","","","","0.489","0.489","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001834","9.848","0.003","10.636","0.003","23.216","0.004","90","","93.11","0.02","90","","2428.1","1.1","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H23 N7 O6 -","- C26 H23 N7 O6 -","- C104 H92 N28 O24 -","4","1","MU1035","Adam, D.; McCabe, P. H.; Sim, G. A.; Bouchemma, A.","A twist-boat 1,3,5-triaryl-1,3,5-triazacyclohexane: X-ray analysis of the inclusion compound formed between 1,3,5-tris(<i>p</i>-nitrophenyl)-1,3,5-triazacyclohexane and pyridine","Acta Crystallographica Section C","1993","49","4","837","841","10.1107/S0108270192012216","","","0.71069","MoKα","","","0.039","","","0.05","","","","","2.42","2.42","","","","","has coordinates","205824","2020-10-21","18:00:00",""
"2001835","8.35","0.002","8.769","0.003","10.1473","0.0006","103.11","0.01","94.98","0.02","96.45","0.03","714.2","0.3","294","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H13 I N2 O -","- C16 H13 I N2 O -","- C32 H26 I2 N4 O2 -","2","1","PA1025","Rodier, N.; Agafonov, V.; Cense, J. M.; Galinier, E.; Ombetta, J. E.; Frangin, Y.; Guilloteau, D.","5-(3-Iodophényl)-2,3-dihydro-5-hydroxy-5<i>H</i>-imidazo[2,1-<i>a</i>]isoindole","Acta Crystallographica Section C","1993","49","4","841","843","10.1107/S0108270192010540","","","1.5418","CuKα","","","0.047","","","0.065","","","","","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001836","10.633","0.004","11.648","0.006","17.236","0.007","76.3","0.03","83.16","0.03","64.95","0.03","1878.5","1.5","294","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H19 N O2 -","- C24 H19 N O2 -","- C96 H76 N4 O8 -","4","2","PA1018","Toupet, L.; Chekti, R.; Soufiaoui, M.; Carrie, R.","Etude de la regio et de la stéréospecificité de l'addition du phénylnitriloxyde au 3-methyl-2-benzylidene indan-1-one. Structure de l'adduit obtenu","Acta Crystallographica Section C","1993","49","4","844","846","10.1107/S0108270192011387","","","0.70926","MoKα","","","0.047","","","0.047","","","","","1.3","1.3","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001837","11.865","0.001","13.8","0.001","10.568","0.001","90","","104.25","0.01","90","","1677.1","0.3","294","","294","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Dimethyl 9-chloro-9,10-dihydro-9,10-ethenoanthracene-11,12- dicarboxylate","","- C20 H15 Cl O4 -","- C20 Cl O4 -","- C80 Cl4 O16 -","4","1","BR1019","Trotter, J.; Yee, V. C.","Structure of dimethyl 9-chloro-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate","Acta Crystallographica Section C","1993","49","4","846","848","10.1107/S0108270192011880","","","1.54056","CopperKα","","0.078","0.046","","0.058","0.058","","","","","2.2","2.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001838","8.233","0.005","6.34","0.02","6.241","0.005","102.6","0.1","103.89","0.07","96.7","0.1","303.7","1","","","","","","","","","","","","4","P -1","-P 1","2","","","","- Al As2 O7 Rb -","- Al As2 O7 Rb -","- Al2 As4 O14 Rb2 -","2","1","DU0330","Boughzala, H.; Driss, A.; Jouini, T.","Structure de RbAlAs~2~O~7~","Acta Crystallographica Section C","1993","49","3","425","427","10.1107/S0108270192006772","","","0.5608","Ag","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001839","9.4543","0.0005","9.4543","0.0005","83.2","0.01","90","","90","","120","","6440.4","0.9","","","","","","","","","","","","3","R -3 c","-R 3 2""c","","","","","- Cs4 Mo21 S25 -","- Cs4 Mo21 S25 -","- Cs24 Mo126 S150 -","6","","DU1004","Gougeon, P.; Potel, M.","Cs~4~Mo~21~S~25~: a new structure type containing Mo~9~ and Mo~12~ condensed clusters","Acta Crystallographica Section C","1993","49","3","427","430","10.1107/S0108270192006036","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001840","6.09","0.001","6.09","0.001","22.759","0.005","90","","90","","120","","731","0.2","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- H13 N3 O8 Se2 -","- H13 N3 O8 Se2 -","- H39 N9 O24 Se6 -","3","0.0833333","NA0025","Łukaszewicz, K.; Pietraszko, A.; Augustyniak, M. A.","Structure of (NH~4~)~3~H(SeO~4~)~2~ in high-temperature phases I and II","Acta Crystallographica Section C","1993","49","3","430","433","10.1107/S010827019200739X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206338","2020-10-21","18:00:00",""
"2001841","6.064","0.001","6.064","0.001","22.904","0.005","90","","90","","120","","729.4","0.2","","","","","","","","","","","","4","R -3 :H","-R 3","148","","","","- H13 N3 O8 Se2 -","- H13 N3 O8 Se2 -","- H39 N9 O24 Se6 -","3","0.166667","NA0025","Łukaszewicz, K.; Pietraszko, A.; Augustyniak, M. A.","Structure of (NH~4~)~3~H(SeO~4~)~2~ in high-temperature phases I and II","Acta Crystallographica Section C","1993","49","3","430","433","10.1107/S010827019200739X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","206338","2020-10-21","18:00:00",""
"2001842","3.8016","0.0004","3.8016","0.0004","6.7786","0.0008","90","","90","","90","","97.965","0.019","","","","","","","","","","","","2","I 4/m m m","-I 4 2","","","","","- Ba O2 -","- Ba O2 -","- Ba2 O4 -","2","0.0625","BR1011","VerNooy, P. D.","Redetermination of the structure of barium peroxide by single-crystal X-ray diffraction","Acta Crystallographica Section C","1993","49","3","433","434","10.1107/S0108270192008692","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2001843","9.429","0.002","15.824","0.003","7.931","0.001","90","","106.26","0.01","90","","1136","0.4","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- H24 Li2 N4 O22 P6 -","- H24 Li2 N4 O22 P6 -","- H48 Li4 N8 O44 P12 -","2","0.5","DU0331","Elmokhtar, O. S. M. M.; Rzaigui, M.; Jouini, A.","Structure of dilithium tetraammonium <i>cyclo</i>-hexaphosphate tetrahydrate","Acta Crystallographica Section C","1993","49","3","435","437","10.1107/S0108270192008023","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001844","16.142","0.003","12.222","0.003","11.047","0.003","90","","94.41","0.02","90","","2173","0.9","","","","","","","","","","","","6","C 1 2/c 1","","","","","","- C13 H23 Cl2 Mn N3 O12 -","- C13 H23 Cl2 Mn N3 O18 -","- C52 H92 Cl8 Mn4 N12 O72 -","4","0.5","MU0301","Brooker, S.; McKee, V.","Seven-coordinate manganese(II) complexes of 2,6-bis[1-(2-hydroxyethylimino)ethyl]pyridine","Acta Crystallographica Section C","1993","49","3","441","445","10.1107/S0108270192007157","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001845","9.902","0.002","12.581","0.002","15.203","0.003","90","","101.46","0.02","90","","1856.2","0.6","","","","","","","","","","","","6","I 1 2/a 1","","","","","","- C15 H19 Mn N5 O2 S2 -","- C15 H19 Mn N5 O2 S2 -","- C60 H76 Mn4 N20 O8 S8 -","4","0.5","MU0301","Brooker, S.; McKee, V.","Seven-coordinate manganese(II) complexes of 2,6-bis[1-(2-hydroxyethylimino)ethyl]pyridine","Acta Crystallographica Section C","1993","49","3","441","445","10.1107/S0108270192007157","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001846","18.643","0.007","12.616","0.003","7.127","0.003","90","","90","","90","","1676.3","1","","","","","","","","","","","","5","P b c n","","","","","","- C13 H19 Mn N9 O2 -","- C13 H19 Mn N9 O2 -","- C52 H76 Mn4 N36 O8 -","4","0.5","MU0301","Brooker, S.; McKee, V.","Seven-coordinate manganese(II) complexes of 2,6-bis[1-(2-hydroxyethylimino)ethyl]pyridine","Acta Crystallographica Section C","1993","49","3","441","445","10.1107/S0108270192007157","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001847","16.965","0.009","18.847","0.008","12.108","0.007","97.41","0.06","95.29","0.06","117.83","0.03","3343","3","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C59 H95 B N6 Ni3 O11 -","- C59 H95 B N6 Ni3 O11 -","- C118 H190 B2 N12 Ni6 O22 -","2","1","AS1009","Yamada, K.; Hori, K.; Fukuda, Y.","Structure of μ-carbonato-1κ^2^<i>O</i>^1^,<i>O</i>^2^:2κ^2^<i>O</i>^1^,<i>O</i>^3^-bis[(acetylacetonato)(<i>N</i>,<i>N</i>,<i>N'</i>,<i>N'</i>-tetramethylethylenediamine)nickel(II)] (acetylacetonato)aqua(methanol)(<i>N</i>,<i>N</i>,<i>N'</i>,<i>N'</i>-tetramethylethylenediamine)nickel(II) tetraphenylborate","Acta Crystallographica Section C","1993","49","3","445","448","10.1107/S0108270192007091","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001848","16.821","0.005","16.277","0.005","12.131","0.005","90","","90.41","0.03","90","","3321","2","","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","","","","","- C20 H48 B8 Cl Hf Li O2 Si2 -","- C20 H48 B8 Cl Hf Li O2 Si2 -","- C80 H192 B32 Cl4 Hf4 Li4 O8 Si8 -","4","1","CR1005","Zhang, H.; Jia, L.; Hosmane, N. S.","The first zwitterionic and bent-sandwiched hafnacarborane 4',5,5',6-Li(THF)-1,1'-<i>commo</i>-Hf(THF)Cl[2-(SiMe~3~)-3-(Me)-2,3-C~2~B~4~H~4~]~2~","Acta Crystallographica Section C","1993","49","3","453","456","10.1107/S0108270192008138","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","194546","2020-10-21","18:00:00",""
"2001849","23.284","0.01","20.923","0.007","21.822","0.008","90","","93.1","0.03","90","","10615","7","","","","","","","","","","","","5","C 2/n 1 1","-C 2yac","","","","","- C48 H83 B P4 Pt2 -","- C48 B P4 Pt6 -","- C384 B8 P32 Pt48 -","8","1","NA1006","Bachechi, F.","Structure of the dinuclear platinum monohydrido bridged complex [(PEt~3~)~2~HPt(μ-H)PtH(PEt~3~)~2~][BPh~4~]","Acta Crystallographica Section C","1993","49","3","460","464","10.1107/S0108270192007674","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001850","10.287","0.002","14.033","0.004","21.241","0.004","90","","99.24","0.02","90","","3026.5","1.2","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H88 Mo8 N4 O26 -","- C36 H88 Mo8 N4 O26 -","- C72 H176 Mo16 N8 O52 -","2","0.5","CR0415","Wang, Q.; Xu, X.; Wang, X.","Structure of bis(dimethylammonium) bis(tetrabutylammonium) β-octamolybdate","Acta Crystallographica Section C","1993","49","3","464","467","10.1107/S0108270192007868","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001851","7.301","0.004","8.216","0.004","10.709","0.005","91.407","0.001","98.247","0.001","114.242","0.003","577.2","0.5","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H26 Cu2 N2 O10 -","- C20 H24 Cu2 N2 O10 -","- C20 H24 Cu2 N2 O10 -","1","0.5","AL0509","Hoang, N. N.; Valach, F.; Melník, M.","Structure of tetrakis(μ-acetato)-bis(4-pyridylmethanol)dicopper(II)","Acta Crystallographica Section C","1993","49","3","467","469","10.1107/S010827019200386X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001852","18.392","0.003","12.723","0.003","22.183","0.003","90","","107.86","0.02","90","","4940.7","1.7","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C24 H66 Si6 Sn3 Te3 -","- C24 H66 Si6 Sn3 Te3 -","- C96 H264 Si24 Sn12 Te12 -","4","1","CD1004","Einstein, F. W. B.; Gay, I. D.; Jones, C. H. W.; Riesen, A.; Sharma, R. D.","Structure and solid-state tin-119 and tellurium-125 NMR spectra of 2,2,4,4,6,6-hexakis(trimethylsilylmethyl)cyclotristannatellurane","Acta Crystallographica Section C","1993","49","3","470","472","10.1107/S0108270192008400","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001853","9.927","0.001","20.086","0.005","17.5","0.005","90","","96.72","0.01","90","","3465.4","1.4","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C36 H30 Au F6 P3 -","- C36 H30 Au F10 P3 -","- C144 H120 Au4 F40 P12 -","4","1","BR1000","Staples, R. J.; King, C.; Khan, M. N. I.; Winpenny, R. E. P.; Fackler, Jnr, J. P.","Structures of bis(triphenylphosphine)gold(I) hexafluorophosphate, [Au(PPh~3~)~2~]PF~6~ (1), and bis(triphenylphosphine)gold(I) nitrate, [Au(PPh~3~)~2~]NO~3~ (2)","Acta Crystallographica Section C","1993","49","3","472","475","10.1107/S0108270192008680","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001854","17.502","0.005","11.02","0.001","18.012","0.003","90","","112.4","0.02","90","","3211.9","1.2","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H30 Au N O3 P2 -","- C36 H30 Au2 N2 O4 P2 -","- C144 H120 Au8 N8 O16 P8 -","4","1","BR1000","Staples, R. J.; King, C.; Khan, M. N. I.; Winpenny, R. E. P.; Fackler, Jnr, J. P.","Structures of bis(triphenylphosphine)gold(I) hexafluorophosphate, [Au(PPh~3~)~2~]PF~6~ (1), and bis(triphenylphosphine)gold(I) nitrate, [Au(PPh~3~)~2~]NO~3~ (2)","Acta Crystallographica Section C","1993","49","3","472","475","10.1107/S0108270192008680","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001855","11.674","0.001","11.74","0.003","10.863","0.003","128.34","0.02","91.93","0.01","97.18","0.02","1146.7","0.6","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H26 N2 O7 Pd -","- C22 H26 N2 O7 Pd -","- C44 H52 N4 O14 Pd2 -","2","1","AS0558","Yoneda, A.; Newkome, G. R.; Morimoto, Y.; Higuchi, Y.; Yasuoka, N.","Structures of {diethyl 2-[(8-hydroxy-κ<i>O</i>-2-quinolyl-κ<i>N</i>)methyl]malonato(2–)-κ<i>C</i>^2^}(pyridine)palladium(II) and the analogous ethyl complex","Acta Crystallographica Section C","1993","49","3","476","478","10.1107/S0108270192010801","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001856","19.349","0.002","7.544","0.002","14.826","0.002","90","","94.11","0.01","90","","2158.6","0.7","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 N2 O5 Pd -","- C23 H24 N2 O5 Pd -","- C92 H96 N8 O20 Pd4 -","4","1","AS0558","Yoneda, A.; Newkome, G. R.; Morimoto, Y.; Higuchi, Y.; Yasuoka, N.","Structures of {diethyl 2-[(8-hydroxy-κ<i>O</i>-2-quinolyl-κ<i>N</i>)methyl]malonato(2–)-κ<i>C</i>^2^}(pyridine)palladium(II) and the analogous ethyl complex","Acta Crystallographica Section C","1993","49","3","476","478","10.1107/S0108270192010801","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001857","8.897","0.003","8.213","0.002","15.334","0.004","90","","102.69","0.03","90","","1093.1","0.6","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H23 Br O7 S -","- C21 H23 Br O7 S -","- C42 H46 Br2 O14 S2 -","2","1","CR1012","Jedrzejas, M. J.; Baker, R. J.; Binkley, R. W.; Towns, R. L. R.; Adair, N.; Andras, M.; Anwari, F.; Chen, Z.; Huff, R.; Liu, X.; Martuch, R. A.; Skladany, M.","Structure of methyl 4-<i>O</i>-benzoyl-6-bromo-3-tosyl-2,6-dideoxy-β-<small>D</small>-<i>arabino</i>-hexopyranoside","Acta Crystallographica Section C","1993","49","3","481","483","10.1107/S0108270192008291","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001858","18.554","0.003","10.466","0.002","7.959","0.004","90","","91.78","0.03","90","","1544.8","0.9","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H17 Cl N2 O -","- C19 H17 Cl N2 O -","- C76 H68 Cl4 N8 O4 -","4","1","MU0287","Johnson, O.; Jones, D. W.","A chloride of a substituted heterocyclic analogue of chrysene: C~19~H~17~N~2~O^+^.Cl^{-^}","Acta Crystallographica Section C","1993","49","3","483","486","10.1107/S010827019200711X","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001859","31.201","0.012","13.789","0.006","11.62","0.005","90","","90","","90","","4999","4","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C48 H74 N2 O9 Si2 -","- C48 H74 N2 O9 Si2 -","- C192 H296 N8 O36 Si8 -","4","1","PA1002","Ginderow, D.; Teutsch, G.; Mornon, J.-P.","Structure du 11,11'-bi[3-éthylènedioxy-17β-cyano-5-hydroxy-17α-triméthylsiloxy-19-nor-5α-androst-9(10)-ène] monohydrate","Acta Crystallographica Section C","1993","49","3","486","489","10.1107/S0108270192006796","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","189073","2020-10-21","18:00:00",""
"2001860","21.493","0.007","11.721","0.004","8.345","0.001","90","","90","","90","","2102.3","1","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","","","","","- C18 H22 N4 O2 P2 S2 -","- C18 H22 N4 O2 P2 S2 -","- C72 H88 N16 O8 P8 S8 -","4","0.5","SE1011","Engelhardt, U.; Stromburg, B.","2,8-Diphenoxy-2,8-dithioxo-1,3,7,9-tetraaza-2λ^5^,8λ^5^-diphosphatricyclo[7.3.0.0^3,7^]dodekan","Acta Crystallographica Section C","1993","49","3","489","491","10.1107/S0108270192008679","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001861","8.106","0.003","18.786","0.004","7.076","0.003","90","","90","","90","","1077.5","0.6","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C7 H14 B Cl F4 N2 -","- C7 H14 B Cl F4 N2 -","- C28 H56 B4 Cl4 F16 N8 -","4","1","AL1015","Banks, R. E.; Sharif, I.; Pritchard, R. G.","Structure of the new electrophilic fluorinating agent 1-chloromethyl-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate) and two of its monoquaternary analogues","Acta Crystallographica Section C","1993","49","3","492","495","10.1107/S0108270192008588","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001862","19.877","0.007","8.769","0.003","7.138","0.002","90","","90","","90","","1244.2","0.7","","","","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C8 H14 Cl F3 N2 O3 S -","- C8 H20 Cl F3 N2 O3 S -","- C32 H80 Cl4 F12 N8 O12 S4 -","4","0.5","AL1015","Banks, R. E.; Sharif, I.; Pritchard, R. G.","Structure of the new electrophilic fluorinating agent 1-chloromethyl-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate) and two of its monoquaternary analogues","Acta Crystallographica Section C","1993","49","3","492","495","10.1107/S0108270192008588","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001863","12.599","0.006","7.653","0.003","14.094","0.007","90","","90","","90","","1358.9","1.1","","","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C7 H14 B2 Cl F9 N2 -","- C7 H20 B8 Cl F33 N2 -","- C28 H80 B32 Cl4 F132 N8 -","4","0.5","AL1015","Banks, R. E.; Sharif, I.; Pritchard, R. G.","Structure of the new electrophilic fluorinating agent 1-chloromethyl-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate) and two of its monoquaternary analogues","Acta Crystallographica Section C","1993","49","3","492","495","10.1107/S0108270192008588","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2001864","7.181","0.001","13.919","0.001","14.547","0.001","90","","90","","90","","1454","0.2","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C12 H20 N4 O5 -","- C12 H20 N4 O5 -","- C48 H80 N16 O20 -","4","1","AL1013","Campbell, J. A.; Freer, A. A.; Robins, D. J.","Structure of <i>N</i>-acetyl-<small>L</small>-homocarnosine monohydrate","Acta Crystallographica Section C","1993","49","3","495","497","10.1107/S0108270192009119","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001865","7.57","0.001","9.4313","0.0007","12.485","0.001","90","","102.21","0.01","90","","871.2","0.15","","","","","","","","","","","","3","P 1 21 1","","","","","","- C21 H28 N2 -","- C21 H28 N2 -","- C42 H56 N4 -","2","1","HU0408","Katrusiak, A.","Structure of 2-phenyl-2-dehydrosparteine","Acta Crystallographica Section C","1993","49","3","497","500","10.1107/S0108270192009338","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001866","22.833","0.006","9.37","0.003","11.434","0.004","90","","110.71","0.08","90","","2288.2","1.7","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C27 H33 N O3 -","- C27 H33 N O3 -","- C108 H132 N4 O12 -","4","1","GR0209","Hossain, M. B.; Symersky, J.; Neely, S. C.; van der Helm, D.; Magarian, R. A.","Structure of 1-{4-[2-(diethylamino)ethoxy]phenyl}-2-(4-methoxyphenyl)-1-phenylethan-1-ol, the non-steroidal antiestrogen MER25","Acta Crystallographica Section C","1993","49","3","500","504","10.1107/S0108270192007893","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2001867","7.542","0.002","7.542","0.002","33.266","0.002","90","","90","","90","","1892.2","0.7","","","","","","","","","","","","4","P 43","P 43","","","","","- C21 H21 N O6 -","- C21 H21 N O6 -","- C84 H84 N4 O24 -","4","1","HH0508","Rajnikant; Goswami, K. N.; Yadava, V. S.; Padmanabhan, V. M.; Banerjee, S. K.","Structure of (‒)-β-hydrastine","Acta Crystallographica Section C","1993","49","3","504","506","10.1107/S0108270192006620","","","1.5405","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001868","25.62","0.03","4.964","0.002","14.9","0.014","90","","107.15","0.04","90","","1811","3","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C7 H7 Cl N2 O3 -","- C7 H7 Cl N2 O3 -","- C56 H56 Cl8 N16 O24 -","8","1","GR1003","Horan, C. J.; Barnes, C. L.; Glaser, R.","2-Carboxybenzenediazonium chloride monohydrate","Acta Crystallographica Section C","1993","49","3","507","509","10.1107/S0108270192009673","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001869","13.215","0.003","9.321","0.001","15.6","0.004","90","","105.68","0.02","90","","1850.1","0.7","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 N2 O2 -","- C23 H22 N2 O2 -","- C92 H88 N8 O8 -","4","1","HA1012","Hu, A. T.; Wang, M.-S.; Wang, S.-L.","Structure of an organic photochromic compound. 6,7,8a,9-Tetrahydro-17,17-dimethylnaphtho[1'',2'':5',6'][1,4]oxazino[3',2':2,3][1,4]oxazino[4,3-<i>a</i>][3<i>H</i>]indole","Acta Crystallographica Section C","1993","49","3","509","511","10.1107/S0108270192008187","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001870","7.135","0.003","17.639","0.004","21.454","0.007","90","","90","","90","","2700.1","1.6","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C31 H50 O2 -","- C31 H50 O2 -","- C124 H200 O8 -","4","1","CD1003","Tinto, W. F.; Blair, L. C.; Lough, A. J.; McLean, S.; Reynolds, W. F.","Determination of the stereochemistry of oxandran-3-one; a novel methyltriterpene from <i>Oxandra asbeckii</i> (Annonaceae)","Acta Crystallographica Section C","1993","49","3","511","514","10.1107/S010827019200800X","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001871","7.8478","0.0004","20.0952","0.0009","13.3666","0.0003","90","","95.68","0.002","90","","2097.6","0.15","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C22 H28 O8 -","- C22 H28 O8 -","- C88 H112 O32 -","4","1","DU0312","Drouin, M.; Michel-Dewez, N.; Michel, A. G.","Functionalized hydrocarbons with condensed ring skeletons. XI. Tetramethyl tricyclo[8.4.0.0^2,7^]tetradeca-1,8-diene-5,5,12,12-tetracarboxylate and its corresponding tetradec-8-ene","Acta Crystallographica Section C","1993","49","3","514","517","10.1107/S0108270192008151","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","208449","2020-10-21","18:00:00",""
"2001872","6.0842","0.0002","12.7171","0.0007","27.8011","0.0016","90","","93.183","0.003","90","","2147.75","0.19","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 O8 -","- C22 H30 O8 -","- C88 H120 O32 -","4","1","DU0312","Drouin, M.; Michel-Dewez, N.; Michel, A. G.","Functionalized hydrocarbons with condensed ring skeletons. XI. Tetramethyl tricyclo[8.4.0.0^2,7^]tetradeca-1,8-diene-5,5,12,12-tetracarboxylate and its corresponding tetradec-8-ene","Acta Crystallographica Section C","1993","49","3","514","517","10.1107/S0108270192008151","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","208447","2020-10-21","18:00:00",""
"2001873","10.833","0.002","13.184","0.003","13.375","0.003","89.73","0.03","74.52","0.03","71.95","0.03","1744","0.8","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H19 N O6 -","- C20 H19 N O6 -","- C80 H76 N4 O24 -","4","2","SE1008","Dokurno, P.; Gdaniec, M.; Kosturkiewicz, Z.; Matecka, D.; Rozwadowska, M. D.","Structure of (±)-egenine","Acta Crystallographica Section C","1993","49","3","517","519","10.1107/S0108270192007509","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001874","9.511","0.002","15.741","0.003","11.467","0.002","90","","91.31","0.02","90","","1716.3","0.6","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H10 O2 Se -","- C8 H10 O2 Se -","- C64 H80 O16 Se8 -","8","2","ST1004","Hoier, H.; Carrell, H. L.; Glusker, J. P.; Spears, C. P.","Structure of ethyl phenyl selenone","Acta Crystallographica Section C","1993","49","3","520","523","10.1107/S0108270192008230","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001875","17.572","0.01","7.727","0.004","7.398","0.004","90","","101.9","0.04","90","","982.9","0.9","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","","","","","- C28 H14 O6 -","- C28 H14 O6 -","- C56 H28 O12 -","2","0.5","ST1003","Hoier, H.; Zacharias, D. E.; Carrell, H. L.; Glusker, J. P.","Structure of the molecular complex of anthracene with 1,8:4,5-naphthalenetetracarboxylic dianhydride","Acta Crystallographica Section C","1993","49","3","523","526","10.1107/S0108270192007388","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001876","13.293","0.003","8.099","0.002","13.815","0.003","90","","120.474","0.005","90","","1281.9","0.5","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C14 H10 N4 O -","- C14 H10 N4 O -","- C56 H40 N16 O4 -","4","1","MU0297","Kožíšek, J.; Paulus, H.; Marchalín, Š.; Ilavský, D.","Structure of 4-(5-cyano-2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile","Acta Crystallographica Section C","1993","49","3","526","528","10.1107/S0108270192010862","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001877","7.505","0.002","8.805","0.002","11.443","0.004","101.53","0.03","99.57","0.03","95.43","0.02","724.2","0.4","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C18 H20 O3 -","- C18 H20 O3 -","- C36 H40 O6 -","2","1","HU1012","Letcher, R. M.; Cheung, K.-K.; Yue, T.-Y.","Structure of 12b-hydroxy-5-methyl-1,2,3,4,4a,5,6,12b-octahydro-12<i>H</i>-benzo[<i>a</i>]xanthen-12-one","Acta Crystallographica Section C","1993","49","3","528","530","10.1107/S0108270192009132","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001878","10.13","0.002","7.39","0.008","20.77","0.003","90","","105.42","0.01","90","","1498.9","1.7","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 N2 -","- C18 H22 N2 -","- C72 H88 N8 -","4","1","CR0269","Prasad, S. M.; Narayan, S. P.; Mandal, D. K.; Gupta, S. C.","Structure of 5,6,11,12-tetrahydro-2,5,8,11-tetramethylphenomazine","Acta Crystallographica Section C","1993","49","3","531","533","10.1107/S0108270192004384","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001879","8.945","0.002","10.098","0.002","11.376","0.003","109.76","0.02","93.3","0.02","114.32","0.01","857.7","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H44 Mn2 O8 P2 -","- C32 Mn2 O8 P2 -","- C32 Mn2 O8 P2 -","1","0.5","SE0088","Flörke, U.; Haupt, H.-J.","Dimanganese octacarbonyl complexes with bridging phosphanido ligands","Acta Crystallographica Section C","1993","49","3","533","535","10.1107/S0108270192007443","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001880","6.848","0.001","8.72","0.002","10.805","0.002","100.16","0.01","99.43","0.01","106.22","0.01","594.1","0.2","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H12 Mn2 O8 P2 -","- C20 Mn2 O8 P2 -","- C20 Mn2 O8 P2 -","1","0.5","SE0088","Flörke, U.; Haupt, H.-J.","Dimanganese octacarbonyl complexes with bridging phosphanido ligands","Acta Crystallographica Section C","1993","49","3","533","535","10.1107/S0108270192007443","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001881","11.359","0.009","8.128","0.007","5.608","0.005","90","","75.42","0.05","90","","501.1","0.7","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","","","","","- C2 H12 N6 Ni S2 -","- C2 H12 N6 Ni S2 -","- C4 H24 N12 Ni2 S4 -","2","0.25","MU0288","Ďurčanská, E.; Kožíšek, J.; Ďurík, J.; Kettmann, V.","Redetermination of the structure of <i>trans</i>-tetraamminebis(thiocyanato-<i>N</i>)nickel(II)","Acta Crystallographica Section C","1993","49","3","535","536","10.1107/S0108270192007121","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001882","9.254","0.007","9.736","0.003","7.955","0.003","102.34","0.03","112.33","0.03","95.09","0.04","636.1","0.6","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H14 Br Cu N2 -","- C12 H14 Br Cu N2 -","- C24 H28 Br2 Cu2 N4 -","2","1","SP1000","Jedrzejas, M. J.; Martuch, R. A.; Towns, R. L. R.; Baker, R. J.; Duraj, S. A.; Hepp, A. F.","Structure of bis(4-methylpyridine-<i>N</i>)copper(I) bromide","Acta Crystallographica Section C","1993","49","3","536","538","10.1107/S0108270192006279","","","0.710326","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001883","15.18","0.006","14.431","0.005","15.269","0.006","90","","96.38","0.04","90","","3324","2","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C32 H30 Cu N4 O6 S2 -","- C32 H30 Cu N4 O6 S2 -","- C128 H120 Cu4 N16 O24 S8 -","4","0.5","SP1001","Jedrzejas, M. J.; Towns, R. L. R.; Baker, R. J.; Duraj, S. A.; Hepp, A. F.","Structure of bis(benzenesulfonato-<i>O</i>)tetrakis(pyridine-<i>N</i>)copper(II)","Acta Crystallographica Section C","1993","49","3","538","540","10.1107/S0108270192006280","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001884","8.831","0.004","14.27","0.008","6.774","0.008","91.98","0.08","99.33","0.09","85.13","0.05","839.1","1.2","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C11 H23 Cl2 N Si2 Ti -","- C11 H23 Cl2 N Si2 Ti -","- C22 H46 Cl4 N2 Si4 Ti2 -","2","1","PA1006","Laurent, F.; Legros, J.-P.","Structure of an allotropic form of [bis(trimethylsilyl)amido]dichloro(η^5^-cyclopentadienyl)titanium","Acta Crystallographica Section C","1993","49","3","540","542","10.1107/S0108270192007315","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001885","14.145","0.007","16.482","0.008","17.589","0.008","90","","90","","90","","4101","3","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C40 H60 N2 Ni S4 -","- C40 H60 N2 Ni S4 -","- C160 H240 N8 Ni4 S16 -","4","1","HH1015","Rheingold, A. L.; Beall, K. S.; Riggs, P. J.; Groh, S. E.","Bis(tetraethylammonium) nickel tetrakisthiophenolate: a new polymorph","Acta Crystallographica Section C","1993","49","3","542","543","10.1107/S0108270192007704","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001886","11.269","0.003","14.095","0.005","8.508","0.005","90","","100.01","0.06","90","","1330.8","1","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 Cl N O2 S -","- C14 H12 Cl N O2 S -","- C56 H48 Cl4 N4 O8 S4 -","4","1","GR0194","Rivero, B. E.; Bianchet, M. A.; Bravo, R. D.","Structure of 3-(<i>p</i>-chlorophenyl)-3,4-dihydro-1<i>H</i>-2,3-benzothiazine 2,2-dioxide","Acta Crystallographica Section C","1993","49","3","544","546","10.1107/S0108270192007881","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001887","10.86","0.002","9.849","0.009","9.36","0.003","90","","113","0.05","90","","921.6","1","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C8 H8 Cl N O2 S -","- C8 H8 Cl N O2 S -","- C32 H32 Cl4 N4 O8 S4 -","4","1","GR0195","Rivero, B. E.; Bianchet, M. A.; Bravo, R. D.","Structure of 6-chloro-3,4-dihydro-1<i>H</i>-2,3-benzothiazine 2,2-dioxide","Acta Crystallographica Section C","1993","49","3","546","548","10.1107/S0108270192007042","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001888","8.785","0.004","8.318","0.003","4.92","0.001","90","","103.62","0.03","90","","349.4","0.2","","","","","","","","","","","","4","C 1 m 1","","","","","","- C6 H8 Br N -","- C6 H7 Br N -","- C12 H14 Br2 N2 -","2","0.5","HH0618","Andras, M. T.; Hepp, A. F.; Fanwick, P. E.; Martuch, R. A.; Duraj, S. A.","Structure of 4-methylpyridinium bromide","Acta Crystallographica Section C","1993","49","3","548","550","10.1107/S0108270192006826","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001889","6.062","0.002","7.242","0.001","23.375","0.004","90","","90","","90","","1026.2","0.4","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H10 O3 -","- C13 H10 O3 -","- C52 H40 O12 -","4","1","ST1002","King, Jnr, J. A.; Bryant, Jnr, G. L.","Structure of diphenyl carbonate","Acta Crystallographica Section C","1993","49","3","550","551","10.1107/S0108270192007571","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001890","13.723","0.004","9.827","0.003","19.328","0.007","90","","96.57","0.03","90","","2589.4","1.4","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H30 B N O2 -","- C32 H30 B N O2 -","- C128 H120 B4 N4 O8 -","4","1","ST1001","Bryant, Jnr, G. L.; King, Jnr, J. A.","Structure of two polymorphic acylpyridinium salts","Acta Crystallographica Section C","1993","49","3","551","554","10.1107/S0108270192007583","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001891","10.09","0.004","14.762","0.006","18.057","0.007","90","","105.12","0.03","90","","2596.5","1.8","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 B N O2 -","- C32 H30 B N O2 -","- C128 H120 B4 N4 O8 -","4","1","ST1001","Bryant, Jnr, G. L.; King, Jnr, J. A.","Structure of two polymorphic acylpyridinium salts","Acta Crystallographica Section C","1993","49","3","551","554","10.1107/S0108270192007583","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001892","8.3925","0.0014","8.0054","0.0014","24.305","0.004","90","","98.518","0.006","90","","1614.9","0.5","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C31 H41 N2 O8 P S2 -","- C31 H23 N2 O8 P S2 -","- C62 H46 N4 O16 P2 S4 -","2","1","ST1007","Berkman, C. E.; Fernandez, E. J.; Thompson, C. M.; Pavkovic, S. F.","Structure of 19-methylstrychninium (<i>S</i>)-{<i>S</i>-[(<i>R</i>)-1,2-di(ethoxycarbonyl)ethyl] <i>O</i>-methyl phosphorodithioate}","Acta Crystallographica Section C","1993","49","3","554","556","10.1107/S0108270192007637","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001893","12.594","0.002","12.594","0.002","12.594","0.002","118.03","0.01","118.03","0.01","118.03","0.01","720","1","","","","","","","","","","","","4","R 3 :R","P 3*","146","","","","- C9 H16 N2 O2 -","- C9 H16 N2 O2 -","- C27 H48 N6 O6 -","3","1","HL1011","Mackay, M. F.; Banwell, M. G.; Richards, S. L.","Structure of (3aα,4α,7α,7aα)-2,2-dimethyl-3a,4,7,7a-tetrahydro-1,3-benzodioxolane-4,7-diamine","Acta Crystallographica Section C","1993","49","3","556","558","10.1107/S0108270192007819","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","199682","2020-10-21","18:00:00",""
"2001894","5.305","0.001","9.486","0.002","11.437","0.003","94.1","0.2","93.8","0.2","93.6","0.2","571.5","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H10 N2 O3 -","- C13 H10 N2 O3 -","- C26 H20 N4 O6 -","2","1","AB0276","Durruthy, O.; Pomés, R.; Fajardo, F.; Dago, A.","Structure of <i>N</i>-(2-furylmethyl)-α-cyano-2-furanacrylamide","Acta Crystallographica Section C","1993","49","3","558","559","10.1107/S010827019200698X","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001895","23.01","0.04","13.91","0.01","7.58","0.04","90","","90","","90","","2426","14","","","","","","","","","","","","4","P b c a","","","","","","- C9 H9 Cl3 O4 -","- C9 H9 Cl3 O4 -","- C72 H72 Cl24 O32 -","8","1","AB0277","Durruthy, O.; Pomés, R.; Fajardo, F.; Dago, A.","Structure of ethyl 5-(2,2,2-trichloro-1-hydroxyethyl)furan-2-carboxylate","Acta Crystallographica Section C","1993","49","3","559","560","10.1107/S0108270192006991","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001896","8.724","0.003","12.009","0.003","15.78","0.004","90","","91.81","0.03","90","","1652.4","0.8","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C17 H23 N O3 S -","- C17 H23 N O3 S -","- C68 H92 N4 O12 S4 -","4","1","HA1011","Feneau-Dupont, J.; Declercq, J.-P.; Vanwetswinkel, S.; Genicot, C.","8-(<i>N</i>-Methyl-<i>N</i>-tosylamino)bicyclo[4.2.0]octane-7-spiro-2'-oxacyclopropane","Acta Crystallographica Section C","1993","49","3","561","562","10.1107/S0108270192008175","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001897","12.104","0.003","26.712","0.005","7.138","0.001","90","","90","","90","","2307.9","0.8","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C25 H29 N O5 -","- C25 H29 N O5 -","- C100 H116 N4 O20 -","4","1","CR1009","Suh, I.-H.; Seo, B.-I.; Lewis, D. E.; Jensen, W. P.; Jacobson, R. A.","Structure of the <i>p</i>-nitrobenzoate ester of 3-<i>endo</i>-(<i>p</i>-methoxybenzyl)isoborneol","Acta Crystallographica Section C","1993","49","3","562","565","10.1107/S010827019200787X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001898","6.105","0.002","21.184","0.005","11.356","0.007","90","","91.14","0.03","90","","1468.4","1.1","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H17 N3 O2 -","- C14 H17 N3 O2 -","- C56 H68 N12 O8 -","4","1","HA1014","Feneau-Dupont, J.; Declercq, J.-P.; Labille, M. C.; Janousek, Z.; Viehe, H. G.","3-Cyano-3-dimethylamino-4-ethoxy-1-phenyl-2-azetidinone","Acta Crystallographica Section C","1993","49","3","567","569","10.1107/S0108270192008448","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001899","9.046","0.001","9.046","0.001","27.883","0.001","90","","90","","120","","1976","0.3","294","","","","","","","","","","","5","P 63/m c m","-P 6c 2","","","","","- Ca K7 Nb14 O47 Si4 -","- Ca3 K6 Nb14 O47 Si4 -","- Ca6 K12 Nb28 O94 Si8 -","2","0.0833333","PA1008","Borel, M. M.; Chardon, J.; Grandin, A.; Leclaire, A.; Raveau, B.","Structure of a new siliconiobate K~6.5~Ca~0.75~Nb~14~Si~4~O~47~","Acta Crystallographica Section C","1993","49","3","570","571","10.1107/S0108270192010254","","","0.71073","MoKα","","","0.028","","","0.027","","","","","1.004","1.004","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001900","7.268","0.004","7.342","0.004","19.553","0.011","94.43","0.06","90.31","0.06","90.9","0.06","1040.1","1","180","0.5","180","0.5","","","","","","","","3","P -1","-P 1","2","","2,5-diiodo-1,2,4,5-tetraphospha-3,6,7-trithiabicyclo[2.2.1]heptane","","- I2 P4 S3 -","- I2 P4 S3 -","- I8 P16 S12 -","4","2","MU1018","Tattershall, B. W.; Kendall, N. L.; McCamley, A.; Clegg, W.","Redetermination of the structure of α-tetraphosphorus trisulfide diiodide at 180 K","Acta Crystallographica Section C","1993","49","3","571","573","10.1107/S0108270192011466","","","0.71073","MoKα","","0.0403","0.0403","","0.1114","0.1112","","","","1.238","1.238","1.238","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2001901","10.2649","0.0014","12.1774","0.0018","12.952","0.002","114.19","0.01","96.47","0.01","75.09","0.01","1427.1","0.4","293","","293","","","","","","","","","7","P -1","-P 1","2","","Bis[1,2-bis(diphenylphosphino)ethane]platinum(II) iodide bis(deuteriochloroform) solvate","","- C54 H48 Cl6 D2 I2 P4 Pt -","- C54 H48 Cl6 D2 I2 P4 Pt -","- C54 H48 Cl6 D2 I2 P4 Pt -","1","0.5","BR1014","Ferguson, G.; Lough, A. J.; McAlees, A. J.; McCrindle, R.","Bis[1,2-bis(diphenylphosphino)ethane]platinum(II) iodide bis(deuteriochloroform) solvate","Acta Crystallographica Section C","1993","49","3","573","576","10.1107/S0108270192010217","","","0.7093","MolybdenumKα","","","0.033","","","0.037","","","","","1.31","1.31","","","","","has coordinates","191979","2020-10-21","18:00:00",""
"2001902","12.03","0.001","7.792","0.001","13.711","0.001","90","","108.94","0.01","90","","1215.7","0.2","297","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 Cd F10 -","- C12 Cd F10 -","- C48 Cd4 F40 -","4","1","SE1005","Strasdeit, H.; Büsching, I.; Duhme, A.-K.; Pohl, S.","Structure of the two-coordinate cadmium complex bis(pentafluorophenyl)cadmium(II), [Cd(C~6~F~5~)~2~]","Acta Crystallographica Section C","1993","49","3","576","578","10.1107/S010827019201014X","","","0.71069","MoKα","","","0.027","","","0.029","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001903","11.243","0.002","7.8935","0.0016","13.406","0.002","90","","99.435","0.015","90","","1173.6","0.4","294","","","","","","","","","","","5","C 1 2/m 1","-C 2y","","","","","- Cl10 H30 Ir2 N10 Pt -","- Cl10 H30 Ir2 N10 Pt -","- Cl20 H60 Ir4 N20 Pt2 -","2","0.25","DU1021","Garnier, E.","Structure of bis[pentaamminechloroiridium(III)] hexachloroplatinate(IV) dichloride","Acta Crystallographica Section C","1993","49","3","578","580","10.1107/S0108270192009909","","","0.71069","MoKα","","","0.029","","","0.0354","","","","","1.171","1.171","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001904","15.172","0.002","7.173","0.0008","18.619","0.001","90","","95.98","0.007","90","","2015.3","0.4","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Potassium Theobrominium Tetrakis(thiocyanato)palladate(II) Monohydrate","","- C11 H11 K N8 O3 Pd S4 -","- C11 H9 K N8 O3 Pd S4 -","- C44 H36 K4 N32 O12 Pd4 S16 -","4","1","HL1021","Giraldi, T.; Taylor, M. R.; Moreno-Vida, M. I.; Ruiz-Sanchez, J.; Salas-Peregrín, J. M.; Colacio, E.","Structure of potassium theobrominium tetrakis(thiocyanato)palladate(II) monohydrate","Acta Crystallographica Section C","1993","49","3","580","582","10.1107/S0108270192010990","","","0.71069","MoKα","","0.037","0.034","","0.029","0.029","","","","1.735","1.763","1.763","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001905","8.409","0.003","12.087","0.004","13.65","0.004","90","","92.23","0.02","90","","1386.3","0.8","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 Mo N2 O4 -","- C10 H15 Mo N2 O4 -","- C40 H60 Mo4 N8 O16 -","4","1","LI1027","Bakar, M. A.; Fun, H.-K.; Chinnakali, K.; Teoh, S.-G.; Shawkataly, O. B.; Lopez, F. M.","Structure of tetracarbonyl[<i>N</i>,<i>N</i>,<i>N'</i>,<i>N'</i>-tetramethylethylenediamine-<i>N</i>,<i>N'</i>]molybdenum(0)","Acta Crystallographica Section C","1993","49","3","582","584","10.1107/S0108270192010096","","","0.71069","MoKα","","","0.0296","","","0.0459","","","","","1","1","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001906","5.75","0.004","16.229","0.004","11.728","0.004","90","","102.23","0.01","90","","1069.6","0.9","295","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C16 H18 N4 O4 Pd S4 -","- C16 H18 N4 O4 Pd S4 -","- C32 H36 N8 O8 Pd2 S8 -","2","0.5","MU1013","Román, P.; Beitia, J. I.; Luque, A.","Structures of 2-amino-3-methylpyridinium bis(1,2‒dithiooxalato-<i>S</i>,<i>S'</i>)metallates(II) (<i>M</i> = Ni, Pd and Pt)","Acta Crystallographica Section C","1993","49","3","584","587","10.1107/S0108270192010503","","","0.71069","MoKα","","","0.05","","","0.064","","","","","1.102","1.102","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001907","9.688","0.003","10.669","0.003","12.447","0.005","69.62","0.02","67.58","0.02","78.86","0.04","1112.1","0.7","396","","23","","","","","","","","","6","P -1","-P 1","2","","[Bis(N-phenylsalicylideneaminato-O,N)chloride]manganese(III)","","- C26 H20 Cl Mn N2 O2 -","- C26 H20 Cl Mn N2 O2 -","- C52 H40 Cl2 Mn2 N4 O4 -","2","1","LI1035","McAuliffe, C. A.; Pritchard, R. G.; Luaces, L.; Garcia-Vazquez, J. A.; Romero, J.; Bermejo, M. R.; Sousa, A.","Chlorobis(<i>N</i>-phenylsalicylideneaminato-<i>O</i>,<i>N</i>)manganese(III): a manganese Schiff-base complex derived by an electrochemical route","Acta Crystallographica Section C","1993","49","3","587","589","10.1107/S010827019201120X","","","0.7107","MoKα","","","0.04","","","0.025","","","","","2.08","2.08","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001908","13.138","0.002","13.897","0.002","21.912","0.002","90","","91.77","0.02","90","","3998.8","0.9","296","","","","","","","","","","","4","C 1 c 1","C -2yc","","","","","- C24 H14 F6 O3 -","- C24 F6 O3 -","- C192 F48 O24 -","8","2","AL1014","Barlow, M. G.; Beagley, B.; Pritchard, R. G.; Tajammal, S.; Tipping, A. E.; Wright, A. P.","Structures of two (1:1) adducts of [α,α-bis(3,3,3-trifluoropropynyl)]benzyl benzoate and furan","Acta Crystallographica Section C","1993","49","3","595","598","10.1107/S0108270192010199","","","0.71069","MoKα","","","0.085","","","0.059","","","","","5.89","5.89","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001909","35.499","0.009","10.289","0.002","8.275","0.003","90","","90","","90","","3022.4","1.5","293","5","","","","","","","","","","2","P c a 21","P 2c -2ac","","","","","- C40 H36 -","- C40 H36 -","- C160 H144 -","4","1","HU1006","Schumann, H.; Görlitz, F. H.; Esser, L.","Structure of pentabenzylcyclopentadiene","Acta Crystallographica Section C","1993","49","3","598","600","10.1107/S0108270192009818","","","0.71073","MoKα","","","0.058","","","0.052","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001910","16.465","0.002","30.163","0.003","9.061","0.001","90","","90","","90","","4500","0.9","293","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C51 H48 N O8 P S -","- C51 H44 N O8 P S -","- C204 H176 N4 O32 P4 S4 -","4","1","AS1015","Hirayama, N.; Sugaya, T.; Tomioka, S.; Ohshima, E.; Obase, H.","(+)-2,2'-(1,1'-Binaphthyl)phosphate salt of methyl (11<i>R</i>)-11-{[2-(4-benzylpiperidino)ethyl]thio}-6,11-dihydrodibenz[<i>b</i>,<i>e</i>]oxepin-2-carboxylate","Acta Crystallographica Section C","1993","49","3","600","602","10.1107/S0108270192009090","","","1.54184","CuKα","","","0.06","","","0.085","","","","","2.4","2.4","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001911","12.971","0.003","12.971","0.003","25.74","0.012","90","","90","","120","","3750","2","293","","293","","","","","","","","","3","P 31 2 1","P 31 2""","152","","tetramethyl tert-butylcalix[4]arene tetraketone","","- C56 H72 O8 -","- C56 H72 O8 -","- C168 H216 O24 -","3","0.5","MU1016","Ferguson, G.; Gallagher, J. F.; McKervey, M. A.","Tetramethyl <i>tert</i>-butylcalix[4]arene tetraketone","Acta Crystallographica Section C","1993","49","3","602","604","10.1107/S0108270192010515","","","0.7093","MoKα","","0.08","0.048","","0.067","0.062","","","","","1.59","1.59","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001912","8.988","0.002","27.953","0.003","5.52","0.002","90","","90","","90","","1386.9","0.6","297","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C18 H13 N O2 -","- C18 H13 N O2 -","- C72 H52 N4 O8 -","4","1","AL1023","Kakehi, A.; Kitajima, K.; Ito, S.; Takusagawa, N.","Structures of furo[2,3-<i>b</i>]indolizine derivatives","Acta Crystallographica Section C","1993","49","3","604","607","10.1107/S0108270192010205","","","0.71069","MoKα","","","0.04","","","0.046","","","","","1.47","1.47","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001913","7.826","0.002","13.85","0.002","13.558","0.002","90","","96.85","0.01","90","","1459.1","0.5","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C20 H15 N O2 -","- C20 H15 N O2 -","- C80 H60 N4 O8 -","4","1","AL1023","Kakehi, A.; Kitajima, K.; Ito, S.; Takusagawa, N.","Structures of furo[2,3-<i>b</i>]indolizine derivatives","Acta Crystallographica Section C","1993","49","3","604","607","10.1107/S0108270192010205","","","0.71069","MoKα","","","0.043","","","0.047","","","","","1.38","1.38","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001914","8.859","0.003","10.075","0.004","21.189","0.007","90","","95.62","0.03","90","","1882.1","1.2","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","REL-(2R,3R,αS)-2-(α-acetoxy-4'-quinolinemethyl)-3-azabicyclo-[2.2.2]octane","","- C21 H24 N2 O4 -","- C21 H24 N2 O4 -","- C84 H96 N8 O16 -","4","1","ST1035","South, B. E.; Kashyap, R. P.; Minter, D. A.; Krawiec, M.; Watson, W. H.","Quinine model study: stereospecific aldol condensation/reduction","Acta Crystallographica Section C","1993","49","3","607","609","10.1107/S0108270192011016","","","0.71073","MolybdenumKα","","0.0995","0.0625","","0.0283","0.0267","","","","","1.639","1.639","","","","","has coordinates","205825","2020-10-21","18:00:00",""
"2001915","10.671","0.003","12.84","0.002","12.303","0.004","90","","97.74","0.03","90","","1670.3","0.8","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H6 N6 O12 -","- C13 H6 N6 O12 -","- C52 H24 N24 O48 -","4","1","PA1007","Cousson, A.; Lelièvre, J.; Chatrousse, A. P.; Terrier, F.; Farrell, P. G.","Hexanitrodiphenylmethane","Acta Crystallographica Section C","1993","49","3","609","612","10.1107/S0108270192006814","","","1.5418","CuKα","","","0.068","","","0.059","","","","","1.5","1.5","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001916","13.032","0.003","21.366","0.004","9.041","0.002","90","","100.77","0.02","90","","2473","0.9","293","1","293","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-[2-benzoyl-1-(benzoylmethyl)ethyl][2.2]paracyclophane","","- C33 H30 O2 -","- C33 H30 O2 -","- C132 H120 O8 -","4","1","NA1020","Kharitonov, V. G.; Antonov, D. Yu.; Rozenberg, V. I.; Nikanorov, V. A.; Yanovsky, A. I.; Struchkov, Yu. T.","4-[2-Benzoyl-1-(benzoylmethyl)ethyl][2.2]paracyclophane","Acta Crystallographica Section C","1993","49","3","612","615","10.1107/S010827019201076X","","","0.71073","MoKα","","0.1001","0.0458","","0.1432","0.0984","","","","1.022","1.084","1.084","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2001917","17.371","0.006","7.621","0.002","8.862","0.003","90","","94.03","0.02","90","","1170.3","0.6","298","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C12 F10 N2 -","- C12 F10 N2 -","- C48 F40 N8 -","4","0.5","LI1017","Chinnakali, K.; Fun, H.-K.; Shawkataly, O. B.; Teoh, S.-G.","Structure of <i>trans</i>-decafluoroazobenzene","Acta Crystallographica Section C","1993","49","3","615","616","10.1107/S0108270192009454","","","0.71069","MoKα","","","0.0317","","","0.0438","","","","","1.44","1.44","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2001918","17.002","0.002","18.399","0.002","10.056","0.001","90","","119.21","0.02","90","","2745.7","0.7","293","","","","","","","","","","","3","C 1 2 1","C 2y","","","","","- C30 H46 O4 -","- C30 O4 -","- C120 O16 -","4","1","LI1025","Sekar, K.; Parthasarathy, S.; Kundu, A. B.; Barik, B. R.","Structure of zizyberannalic acid","Acta Crystallographica Section C","1993","49","3","616","618","10.1107/S0108270192010047","","","1.5418","CuKα","","","0.056","","","0.061","","","","","1.918","1.918","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001919","9.4377","0.001","6.978","0.0011","18.559","0.003","90","","93.24","0.013","90","","1220.3","0.3","122","0.5","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C27 H42 O4 -","- C27 H21 O4 -","- C54 H42 O8 -","2","1","LI1021","Larsen, S.; Hansen, E. T.; Hoffmeyer, L.; Rastrup-Andersen, N.","Structure and absolute configuration of a monohydrate of calcipotriol, (1α,3β,5<i>Z</i>,7<i>E</i>,22<i>E</i>,24<i>S</i>)-24-cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1,3,24-triol","Acta Crystallographica Section C","1993","49","3","618","621","10.1107/S010827019201031X","","","1.54184","CuKα","","","0.05","","","0.064","","","","","1.56","1.56","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001920","8.789","0.002","8.789","0.002","21.245","0.008","90","","90","","120","","1421.2","0.7","298","","","","","","","","","","","3","P 32 2 1","P 32 2""","","","","","- C12 H30 O15 -","- C12 H38 O15 -","- C36 H114 O45 -","3","0.5","HL1014","Lee, C.-K.; Koh, L. L.","Structure of β,β-trehalose","Acta Crystallographica Section C","1993","49","3","621","624","10.1107/S010827019200982X","","","0.71069","MoKα","","","0.029","","","0.031","","","","","1.33","1.33","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001921","15.8","0.002","4.985","0.001","18.875","0.003","90","","111.21","0.01","90","","1385.9","0.4","289","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H11 F3 N2 O4 -","- C13 H11 F3 N2 O4 -","- C52 H44 F12 N8 O16 -","4","1","AB1028","Van Meervelt, L.","Structure of <i>N</i>-(3-phthalimidooxypropyl)trifluoroacetamide","Acta Crystallographica Section C","1993","49","3","624","626","10.1107/S0108270192010473","","","1.54178","CuKα","","","0.0459","","","0.0506","","","","","1.16","1.16","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001922","9.202","0.001","10.716","0.002","22.111","0.003","90","","90","","90","","2180.3","0.6","295","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C19 H20 N2 O10 S -","- C19 H17 N2 O10 S -","- C76 H68 N8 O40 S4 -","4","1","PA1010","Tomas, A.; Dung, Nguyen-Huy; Viossat, B.; Esanu, A.; Rolland, A.","An original linkage between arabinose and a pyranopyrimidine derivative <i>via</i> a sulfur atom","Acta Crystallographica Section C","1993","49","3","626","628","10.1107/S0108270192010448","","","0.7107","MoKα","","","0.044","","","0.047","","","","","2","2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001923","7.0123","0.0005","7.5297","0.0009","29.094","0.002","90","","90","","90","","1536","1","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(1S ; S~s~)-1-hydroxy-3-methoxy-1- phenyl-2-p-tolylsulfinylpropene","(1S ; S~s~)-1-hydroxy-3-methoxy-1- phenyl-2-p-tolylsulfinylpropene","","- C17 H18 O3 S -","- C17 H18 O3 S -","- C68 H72 O12 S4 -","4","1","PA1027","Retoux, R.; Guillot, C.; Maignan, C.","Structure determination of (1<i>S</i>;S~<i>s~</i>)-3-methoxy-1-phenyl-2-(<i>p</i>-tolylsulfinyl)-2-propen-1-ol (C~17~H~18~O~3~S)","Acta Crystallographica Section C","1993","49","3","629","630","10.1107/S0108270192011235","","","0.71069","MoKα","","","0.028","","","0.029","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001924","7.516","0.0002","10.536","0.002","8.342","0.002","90","","95.69","0.01","90","","657.3","0.2","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C2 H4 N4 O2 S2 -","- C2 H4 N4 O2 S2 -","- C8 H16 N16 O8 S8 -","4","1","LI1011","Pedregosa, J. C.; Alzuet, G.; Borrás, J.; Fustero, S.; García-Granda, S.; Díaz, M. R.","Structure of 5-amino-1,3,4-thiadiazole-2-sulfonamide, an inhibitor of the enzyme carbonic anhydrase","Acta Crystallographica Section C","1993","49","3","630","633","10.1107/S0108270192007467","","","0.71073","MoKα","","","0.032","","","0.035","","","","","9.04","9.04","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001925","5.6478","0.0006","5.232","0.002","41.641","0.006","90","","93.98","0.02","90","","1227.5","0.5","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 N2 O2 -","- C14 H14 N2 O2 -","- C56 H56 N8 O8 -","4","1","LI1023","Caracelli, I.; Zukerman-Schpector, J.; Barreiro, E. J.; Freitas, A. C. C.","Structures of pyrazole derivatives. I. A potential bioisoster of thromboxane synthetase inhibitors","Acta Crystallographica Section C","1993","49","3","633","635","10.1107/S0108270192008527","","","0.70926","MoKα","","","0.054","","","0.062","","","","","2.24","2.24","","","","","has coordinates","278317","2022-10-03","11:42:01",""
"2001926","7.902","0.002","12.009","0.003","7.474","0.002","90","","90","","90","","709.2","0.3","298","","","","","","","","","","","4","P b c 21","P 2c -2b","","","","","- C6 H10 N2 O2 -","- C6 H10 N2 O2 -","- C24 H40 N8 O8 -","4","1","VS0102","Streltsova, N. R.; Bel'sky, V. K.; Voloshin, Y. Z.","Structures of three alicyclic α-dioximes with a ring size of six to eight","Acta Crystallographica Section C","1993","49","3","635","639","10.1107/S0108270192011144","","","0.71069","MoKα","","","0.024","","","0.027","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001927","8.69","0.001","12.134","0.003","16.267","0.003","90","","90","","90","","1715.3","0.6","298","","","","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C7 H12 N2 O2 -","- C7 H12 N2 O2 -","- C56 H96 N16 O16 -","8","1","VS0102","Streltsova, N. R.; Bel'sky, V. K.; Voloshin, Y. Z.","Structures of three alicyclic α-dioximes with a ring size of six to eight","Acta Crystallographica Section C","1993","49","3","635","639","10.1107/S0108270192011144","","","0.71069","MoKα","","","0.032","","","0.037","","","","","2.43","2.43","","","","","has coordinates","205962","2020-10-21","18:00:00",""
"2001928","8.734","0.001","12.821","0.002","7.775","0.001","90","","90","","90","","870.6","0.2","298","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C8 H14 N2 O2 -","- C8 H14 N2 O2 -","- C32 H56 N8 O8 -","4","1","VS0102","Streltsova, N. R.; Bel'sky, V. K.; Voloshin, Y. Z.","Structures of three alicyclic α-dioximes with a ring size of six to eight","Acta Crystallographica Section C","1993","49","3","635","639","10.1107/S0108270192011144","","","0.71069","MoKα","","","0.029","","","0.038","","","","","0.89","0.89","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001929","12.79","0.001","12.79","0.001","12.493","0.002","90","","90","","90","","2043.7","0.4","288","","","","","","","","","","","3","P 4/n","-P 4a","","","","","- C47 H56 O4 -","- C51 H28 O4 -","- C102 H56 O8 -","2","","AS1013","Ohtsuchi, M.; Suzuki, K.; Armah, A. E.; Yamagata, Y.; Fujii, S.; Tomita, K.; Asfari, Z.; Vicens, J.","Structure of <i>p</i>-isopropylcalix[4]arene‒toluene (1/1) complex","Acta Crystallographica Section C","1993","49","3","639","641","10.1107/S0108270192008850","","","1.5418","CuKα","","","0.07","","","0.077","","","","","1.042","1.042","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001930","16.14","0.01","4.55","0.003","7.788","0.005","90","","100.07","0.01","90","","563","","293","0.1","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- As2 Mo O7 -","- As2 Mo O7 -","- As8 Mo4 O28 -","4","1","SE1012","Hums, E.; Burzlaff, H.; Rothammel, W.","Structure of MoAs~2~O~7~: corrigendum and addendum","Acta Crystallographica Section C","1993","49","3","641","642","10.1107/S0108270192008096","","","0.70926","MoKα~1~","","","0.033","","","0.021","","","","","2","2","","","","","has coordinates","282068","2023-03-26","10:12:03",""
"2001931","8.86","0.008","11.007","0.002","16.316","0.004","90","","90","","90","","1591.2","1.5","","","","","","","","","","","","5","P n n a","-P 2a 2bc","","","","","- C14 H11 Fe N2 O10 -","- C14 H11 Fe N2 O10 -","- C56 H44 Fe4 N8 O40 -","4","0.5","BU0317","Marsh, R. E.","On the crystal structure of bis(dipicolinato)ferrate(III) dihydrate","Acta Crystallographica Section C","1993","49","3","643","","10.1107/S0108270192011673","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001932","3.8284","0.0006","3.8284","0.0006","37.914","0.005","90","","90","","120","","481.24","0.12","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- Cr Fe Ga Se4 -","- Cr Ga2 Se4 -","- Cr3 Ga6 Se12 -","3","0.0833333","SH1004","Lutz, H. D.; Stingl, T.","A new layered ZnIn~2~S~4~-(III<i>a</i>) polytype: structure of FeCr~0.8~Ga~1.2~Se~4~","Acta Crystallographica Section C","1993","49","2","207","209","10.1107/S0108270192006486","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","203285","2020-10-21","18:00:00",""
"2001933","12.637","0.001","5.251","0.001","13.748","0.001","90","","116.94","0.01","90","","813.28","0.19","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- B4 In Li O10 Sr2 -","- B4 In Li O10 Sr2 -","- B16 In4 Li4 O40 Sr8 -","4","1","ST0580","Schaffers, K. I.; Keszler, D. A.","Structure of strontium lithium indium pyroborate, Sr~2~LiInB~4~O~10~","Acta Crystallographica Section C","1993","49","2","211","214","10.1107/S0108270192006383","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001934","5.68174","0.00015","5.68174","0.00015","12.7118","0.0004","90","","90","","90","","410.36","0.02","","","","","","","","","","","","3","I 41/a","-I 4ad","","","","","- K O4 Re -","- K O4 Re -","- K4 O16 Re4 -","4","","BR0017","Brown, R. J. C.; Powell, B. M.; Stuart, S. N.","Thermal effects in the structure of potassium perrhenate","Acta Crystallographica Section C","1993","49","2","214","216","10.1107/S0108270192003706","","neutron","1.49978","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001935","5.66115","0.00011","5.66115","0.00011","12.611","0.0003","90","","90","","90","","404.165","0.015","","","","","","","","","","","","3","I 41/a","-I 4ad","","","","","- K O4 Re -","- K2 O4 Re -","- K8 O16 Re4 -","4","","BR0017","Brown, R. J. C.; Powell, B. M.; Stuart, S. N.","Thermal effects in the structure of potassium perrhenate","Acta Crystallographica Section C","1993","49","2","214","216","10.1107/S0108270192003706","","neutron","1.49978","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001936","5.65029","0.00008","5.65029","0.00008","12.5556","0.0002","90","","90","","90","","400.847","0.01","","","","","","","","","","","","3","I 41/a","-I 4ad","","","","","- K O4 Re -","- K4 O16 Re4 -","- K4 O16 Re4 -","","","BR0017","Brown, R. J. C.; Powell, B. M.; Stuart, S. N.","Thermal effects in the structure of potassium perrhenate","Acta Crystallographica Section C","1993","49","2","214","216","10.1107/S0108270192003706","","neutron","1.49978","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001937","23.48","0.03","4.795","0.004","9.38","0.009","90","","90.08","0.09","90","","1056.1","1.9","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C8 H14 O4 Zn -","- C8 H14 O4 Zn2 -","- C32 H56 O16 Zn8 -","4","1","MU0285","Blair, J.; Howie, R. A.; Wardell, J. L.","Structure of monoclinic zinc <i>n</i>-butanoate","Acta Crystallographica Section C","1993","49","2","219","221","10.1107/S0108270192007108","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001938","13.624","0.003","13.943","0.003","8.205","0.002","101.29","0.01","90.08","0.01","69.14","0.02","1424.3","0.6","","","","","","","","","","","","8","P -1","-P 1","2","","","","- C12 H42 Cl2 Co2 N6 Ni O3 S6 -","- C12 H24 Cl3 Co2 N6 Ni O4 S6 -","- C24 H48 Cl6 Co4 N12 Ni2 O8 S12 -","2","1","AS1008","Konno, T.; Okamoto, K.; Hidaka, J.","Structure of bis[tris(2-aminoethanethiolato)cobalt(III)-μ-<i>S</i>,μ-<i>S'</i>,μ-<i>S''</i>]nickel(II) chloride trihydrate","Acta Crystallographica Section C","1993","49","2","222","224","10.1107/S010827019200622X","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001939","8.739","0.002","12.743","0.002","9.533","0.001","90","","91.32","0.01","90","","1061.3","0.3","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H32 Br2 Fe P4 -","- C12 H32 Br2 Fe P4 -","- C24 H64 Br4 Fe2 P8 -","2","0.5","HL1006","Field, L. D.; Hambley, T. W.; Yau, B. C. K.","Structure of <i>trans</i>-bis[1,2-bis(dimethylphosphino)ethane]dibromoiron(II)","Acta Crystallographica Section C","1993","49","2","224","226","10.1107/S0108270192004992","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001940","11.071","0.003","16.606","0.006","8.761","0.002","90","","90","","90","","1610.7","0.8","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","","","","","- C10 H20 Co N2 Na O11 -","- C10 H20 Co N2 Na O11 -","- C40 H80 Co4 N8 Na4 O44 -","4","1","AS1006","Yamasaki, Y.; Kurisaki, T.; Yamaguchi, T.; Wakita, H.","Determination of the absolute configuration of sodium (‒)~589~-bis(<i>N</i>-methyliminodiacetato)cobaltate(III) trihydate","Acta Crystallographica Section C","1993","49","2","229","231","10.1107/S0108270192006401","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","199703","2020-10-21","18:00:00",""
"2001941","12.76","0.002","12.76","0.002","12.76","0.002","90","","90","","90","","2077.6","0.6","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","","","","","- C8 H24 Cl6 N2 Re -","- C8 H24 Cl6 N2 Re -","- C32 H96 Cl24 N8 Re4 -","4","0.0208333","LI1000","Loris, R.; Maes, D.; Lisgarten, J. N.; Bettinelli, M.; Flint, C.","Structure of bis(tetramethylammonium) hexachlororhenate(IV)","Acta Crystallographica Section C","1993","49","2","231","233","10.1107/S0108270192005444","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001942","26.414","0.003","12.433","0.002","11.41","0.002","90","","98.63","0.02","90","","3704.7","1","","","","","","","","","","","","5","A 1 2/a 1","-A 2ya","15","","","","- C36 H34 Mn3 N4 O12 -","- C36 H34 Mn3 N4 O12 -","- C144 H136 Mn12 N16 O48 -","4","0.5","AS0573","Tsuneyoshi, K.; Kobayashi, H.; Miyamae, H.","Structure of hexa-μ-acetato-1κ^3^<i>O</i>:2κ^3^<i>O'</i>;2κ^3^<i>O</i>:3κ^3^<i>O'</i>-bis(1,10-phenanthroline)-1κ^2^<i>N</i>^1^,<i>N</i>^10^;2κ^2^<i>N</i>^1^,<i>N</i>^10^-trimanganese(II)","Acta Crystallographica Section C","1993","49","2","233","236","10.1107/S0108270192006395","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205830","2020-10-21","18:00:00",""
"2001943","9.918","0.002","15.395","0.003","13.453","0.002","90","","103.68","0.01","90","","1995.8","0.6","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C51 H36 Cl Mn N4 -","- C51 H36 Cl Mn N4 -","- C102 H72 Cl2 Mn2 N8 -","2","0.5","MU0291","Armstrong, R. S.; Foran, G. J.; Hambley, T. W.","Structure of chloro(α,β,γ,δ-tetraphenylporphinato)manganese(III) toluene solvate","Acta Crystallographica Section C","1993","49","2","236","238","10.1107/S0108270192007133","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205956","2020-10-21","18:00:00",""
"2001944","27.073","0.007","6.145","0.002","11.605","0.004","90","","107.24","0.03","90","","1843.9","1","","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C14 H30 N2 Ni O7 -","- C14 H30 N2 Ni O7 -","- C56 H120 N8 Ni4 O28 -","4","1","CD0088","Haendler, H. M.","<i>cis</i>-[Diaquabis(1-aminocyclohexanecarboxylato)nickel(II)]‒water (1/1)","Acta Crystallographica Section C","1993","49","2","238","241","10.1107/S0108270192005985","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208381","2020-10-21","18:00:00",""
"2001945","4.862","0.002","5.952","0.002","13.448","0.004","90","","95.91","0.02","90","","387.1","0.2","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H8 Ge O8 -","- C4 H8 Ge O8 -","- C8 H16 Ge2 O16 -","2","0.5","AS1003","Chiang, H.-C.; Wang, M.-H.; Ueng, C.-H.","Synthesis and structure of diaquabis(glycolato-<i>O</i>,<i>O''</i>)germanium(IV)","Acta Crystallographica Section C","1993","49","2","244","246","10.1107/S0108270192006218","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001946","9.901","0.005","12.664","0.01","10.998","0.005","90","","100.06","0.05","90","","1357.8","1.4","","","","","","","","","","","","5","P 1 21 1","","","","","","- C11 H15 Cl N2 O5 -","- C11 H15 Cl N2 O5 -","- C44 H60 Cl4 N8 O20 -","4","2","CD0082","Blanchard, H.; James, M. N. G.; Kumar, R.; Wiebe, L. I.; Knaus, E. E.","Structure of (+)-(5<i>R</i>,6<i>R</i>)-5-chloro-6-methoxy-5,6-dihydro-1-(2',3'-didehydro-2',3'-dideoxy-β-<small>D</small>-<i>glycero</i>-2-enopentofuranosyl)thymine","Acta Crystallographica Section C","1993","49","2","246","250","10.1107/S0108270192003470","","","1.5405","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001947","8.029","0.001","8.224","0.001","37.261","0.006","90","","90","","90","","2460.4","0.6","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C27 H28 O12 -","- C27 H28 O12 -","- C108 H112 O48 -","4","1","SE1002","Schmidt-Bäse, K.; Noltemeyer, M.; Egert, E.; Eigelt, E.; Zeeck, A.","Structure of the anthracycline antibiotic aranciamycin","Acta Crystallographica Section C","1993","49","2","250","253","10.1107/S0108270192005766","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001948","9.5616","0.0001","8.4696","0.0001","7.0568","0.0001","106.806","0.001","100.192","0.001","69.557","0.001","510.776","0.012","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C10 H6 O8 -","- C10 H6 O8 -","- C20 H12 O16 -","2","1","HU1002","Barrio, C.; García-Granda, S.; Gómez-Beltrán, F.","Structures of 1,2,3,4-benzenetetracarboxylic acid and 1,2,3,5-benzenetetracarboxylic acid dihydrate","Acta Crystallographica Section C","1993","49","2","253","257","10.1107/S0108270192006097","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001949","5.845","0.004","7.828","0.006","13.31","0.01","94.8","0.1","100.6","0.1","93.63","0.09","594.6","0.8","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C10 H10 O10 -","- C10 H10 O10 -","- C20 H20 O20 -","2","1","HU1002","Barrio, C.; García-Granda, S.; Gómez-Beltrán, F.","Structures of 1,2,3,4-benzenetetracarboxylic acid and 1,2,3,5-benzenetetracarboxylic acid dihydrate","Acta Crystallographica Section C","1993","49","2","253","257","10.1107/S0108270192006097","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001950","14.113","0.002","10.032","0.001","17.086","0.002","90","","103.55","0.01","90","","2351.7","0.5","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 O3 -","- C14 H18 O3 -","- C112 H144 O24 -","8","2","HH1005","Lloyd, B. A.; Ericson, C.; Arif, A. M.; Allred, E. L.","Ketone pyramidalization in a tetracyclic perpendicular enone derivative","Acta Crystallographica Section C","1993","49","2","257","261","10.1107/S0108270192006838","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001951","7.288","0.001","12.432","0.003","24.392","0.002","90","","90","","90","","2210","0.6","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","","","","","- C14 H18 O2 -","- C14 H18 O2 -","- C112 H144 O16 -","8","1","HH1006","Lloyd, B. A.; Arif, A. M.; Allred, E. L.; Patton, A.; Sharp, T. R.","A twisted pentacyclic ketone derivative","Acta Crystallographica Section C","1993","49","2","261","263","10.1107/S010827019200684X","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001952","7.0202","0.0005","8.789","0.003","9.548","0.001","68.807","0.002","80.34","0.008","78.087","0.014","534.6","0.2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H9 N O4 -","- C13 H9 N O4 -","- C26 H18 N2 O8 -","2","1","PA1004","Bideau, J. P.; Cotrait, M.; Buisson, J. P.; Demerseman, P.","Structure of a powerful mutagenic compound; 6-methoxy-2-nitronaphtho[1,8-<i>bc</i>]pyran","Acta Crystallographica Section C","1993","49","2","264","267","10.1107/S0108270192006875","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001953","10.975","0.002","19.937","0.003","8.742","0.004","90","","90.4","0.02","90","","1912.8","1","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C32 H22 Cl10 N2 S2 Te2 -","- C32 H22 Cl10 N2 S2 Te2 -","- C64 H44 Cl20 N4 S4 Te4 -","2","0.5","AS1004","Kozawa, K.; Uchida, T.","Structure of benzo[<i>a</i>]phenothiazine pentachlorotellurate(IV)","Acta Crystallographica Section C","1993","49","2","267","270","10.1107/S0108270192005602","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2001954","14.95","0.002","9.248","0.001","12.597","0.001","90","","100.98","0.01","90","","1709.7","0.3","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H25 N O4 -","- C19 H25 N O4 -","- C76 H100 N4 O16 -","4","2","KA0015","Ribár, B.; Stanković, S.; Mészáros, C.; Miljković, D.; Pejanović, V.; Petrović, J.","Structure of 3-methoxy-6α,17β-dihydroxyestra-1,3,5(10)-trien-7-one oxime","Acta Crystallographica Section C","1993","49","2","270","273","10.1107/S0108270192003007","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001955","9.211","0.001","13.201","0.001","16.031","0.001","90","","90","","90","","1949.3","0.3","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H32 O4 -","- C21 H31 O4 -","- C84 H124 O16 -","4","1","AL0521","Dastidar, P.; Joseph, T.; Madyastha, K. M.; Guru Row, T. N.","Structure of a steriod fungal metabolite","Acta Crystallographica Section C","1993","49","2","273","275","10.1107/S0108270192005134","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001956","6.025","0.001","15.99","0.005","17.921","0.002","90","","90","","90","","1726.5","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-(N,N-dibenzylamino)phenylacetonitrile","","- C22 H21 N2 -","- C22 H20 N2 -","- C88 H80 N8 -","4","1","KA1003","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Zouaoui, A.; Caubère, P.","Structure and conformation of 3-(dibenzylamino)phenylacetonitrile","Acta Crystallographica Section C","1993","49","2","278","282","10.1107/S0108270192007856","","","1.54178","X-rayCu-Kαmean","","","0.0332","","","0.0298","","","","","0.4815","0.4815","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001957","6.021","0.001","15.989","0.004","17.906","0.005","90","","90","","90","","1723.8","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-(N,N-dibenzylamino)phenylacetonitrile","","- C22 H20 N2 -","- C22 H20 N2 -","- C88 H80 N8 -","4","1","KA1003","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Zouaoui, A.; Caubère, P.","Structure and conformation of 3-(dibenzylamino)phenylacetonitrile","Acta Crystallographica Section C","1993","49","2","278","282","10.1107/S0108270192007856","","","0.71069","Mo-Kα","","","0.0257","","","0.0259","","","","","0.6665","0.6665","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001958","11.327","0.002","13.842","0.002","10.959","0.002","90.68","0.02","110.13","0.01","99.1","0.02","1588.9","0.5","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H20 Cl2 N4 -","- C14 H20 Cl2 N4 -","- C56 H80 Cl8 N16 -","4","2","HH1002","Shin, W.; Oh, D.","Structure of amprolium hydrochloride","Acta Crystallographica Section C","1993","49","2","282","285","10.1107/S0108270192006711","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001959","10.185","0.006","12.036","0.005","12.194","0.006","92.21","0.03","108.48","0.03","106.1","0.03","1349","1.2","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H18 Cl5 O4 P -","- C26 H18 Cl5 O4 P -","- C52 H36 Cl10 O8 P2 -","2","1","HL1007","Lynch, D. E.; Smith, G.; Byriel, K. A.; Kennard, C. H. L.","Molecular co-crystals of carboxylic acids. 10. Structure of the 1:1 adduct of triphenylphosphine oxide with (pentachlorophenoxy)acetic acid","Acta Crystallographica Section C","1993","49","2","285","288","10.1107/S0108270192005572","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001960","23.949","0.005","6.804","0.001","22.893","0.005","90","","117.66","0.02","90","","3304.1","1.3","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C18 H19 N3 O2 -","- C18 H19 N3 O2 -","- C144 H152 N24 O16 -","8","1","AB1013","Meetsma, A.; Boer, T. S.; Haitjema, H. J.; Tan, Y. Y.","Structure of 4-[4'-(dimethylamino)phenylazo]phenyl acrylate (1) and 4-[4'-(dimethylamino)phenylazo]phenyl methacrylate (2)","Acta Crystallographica Section C","1993","49","2","288","292","10.1107/S0108270192007029","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001961","23.345","0.002","40.671","0.004","6.561","0.001","90","","90","","90","","6229.4","1.2","","","","","","","","","","","","4","F d d 2","F 2 -2d","","","","","- C17 H17 N3 O2 -","- C17 N3 O2 -","- C272 N48 O32 -","16","1","AB1013","Meetsma, A.; Boer, T. S.; Haitjema, H. J.; Tan, Y. Y.","Structure of 4-[4'-(dimethylamino)phenylazo]phenyl acrylate (1) and 4-[4'-(dimethylamino)phenylazo]phenyl methacrylate (2)","Acta Crystallographica Section C","1993","49","2","288","292","10.1107/S0108270192007029","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001962","3.91","0.02","6.141","0.002","34.44","0.03","90","","91.79","0.05","90","","827","4","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H5 Br O2 -","- C9 H5 Br O2 -","- C36 H20 Br4 O8 -","4","1","GR0206","Goud, B. S.; Desiraju, G. R.","Structure of (4-bromophenyl)propiolic acid and its unusual hydrogen-bonding pattern","Acta Crystallographica Section C","1993","49","2","292","294","10.1107/S0108270192007807","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001963","16.822","0.005","18.556","0.006","14.429","0.005","90","","105.52","0.03","90","","4340","3","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H24 N4 O6.5 P S -","- C19 H25 N4 O7 P S -","- C152 H200 N32 O56 P8 S8 -","8","2","HH1007","Shin, W.; Cho, S. W.; Chae, C. H.","Structure of benfotiamine hemihydrate","Acta Crystallographica Section C","1993","49","2","294","298","10.1107/S0108270192006905","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001964","9.239","0.004","14.475","0.006","6.404","0.003","90","","91.19","0.05","90","","856.3","0.7","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H28 N O7 -","- C15 H28 N O7 -","- C30 H56 N2 O14 -","2","1","BR1005","Hempel, A.; Camerman, N.; Hamodrakas, S. J.; Ottensmeyer, F. P.; Troganis, A.; Stassinopoulou, C. I.; Camerman, A.","2,2,6,6-Tetramethylpiperidine-1-oxyl-4-yl α-<small>D</small>-glucopyranoside","Acta Crystallographica Section C","1993","49","2","298","300","10.1107/S0108270192006929","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001965","27.214","0.01","6.552","0.001","13.241","0.001","90","","113.35","0.02","90","","2167.6","0.9","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C20 H28 N6 O4 S -","- C20 H28 N6 O4 S -","- C80 H112 N24 O16 S4 -","4","0.5","LI1020","Bates, P. A.; Islam, S. A.; Sternberg, M. J. E.","Structure of debrisoquinium sulfate","Acta Crystallographica Section C","1993","49","2","300","303","10.1107/S010827019200893X","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001966","12.036","0.003","28.753","0.003","8.451","0.003","90","","90","","90","","2924.6","1.3","","","","","","","","","","","","3","P b c a","","","","","","- C18 H20 O3 -","- C18 H20 O3 -","- C144 H160 O24 -","8","1","CD0067","Alex, G.; Srinivasan, S.; Bakthavatchalam, R.; Ramadas, S. R.; Varghese, B.","Structures of derivatives of the Diels‒Alder adduct 1,4,4a,5,8,8a,9a,10a-octahydro-1,4:5,8-dimethano-9,10-anthraquinone","Acta Crystallographica Section C","1993","49","2","303","307","10.1107/S0108270192007996","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001967","8.741","0.001","20.477","0.002","9.89","0.001","90","","92.17","0.01","90","","1768.9","0.3","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 O5 -","- C18 H22 O5 -","- C72 H88 O20 -","4","1","CD0067","Alex, G.; Srinivasan, S.; Bakthavatchalam, R.; Ramadas, S. R.; Varghese, B.","Structures of derivatives of the Diels‒Alder adduct 1,4,4a,5,8,8a,9a,10a-octahydro-1,4:5,8-dimethano-9,10-anthraquinone","Acta Crystallographica Section C","1993","49","2","303","307","10.1107/S0108270192007996","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001968","8.588","0.001","11.7","0.001","18.13","0.002","90","","90","","90","","1821.7","0.3","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H26 Cl N O -","- C21 H2 Cl N O -","- C84 H8 Cl4 N4 O4 -","4","1","BX0563","Platzbecker, R.; Will, G.; Hümmer, K.; Weckert, E.; Lauktien, G.; Frahm, A. W.","The absolute configuration of (+)-2-benzyl-2-[<i>N</i>-(α-phenylethyl)amino]cyclohexanone hydrochloride","Acta Crystallographica Section C","1993","49","2","307","310","10.1107/S0108270192008965","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001969","11.724","0.001","10.265","0.001","11.35","0.002","90","","99.39","0.01","90","","1347.6","0.3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C9 H6 F12 O3 -","- C9 H6 F12 O3 -","- C36 H24 F48 O12 -","4","1","CD1006","Vittal, J. J.; Willis, C. J.","Structure of 1,1,1,7,7,7-hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-4-heptanone","Acta Crystallographica Section C","1993","49","2","310","313","10.1107/S0108270192008515","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001970","9.295","0.002","11.029","0.003","20.01","0.004","90","","90","","90","","2051.3","0.8","","","","","","","","","","","","4","C 2 2 21","C 2c 2","","","","","- H14 N6 O25 Y2 -","- H14 N6 O25 Y2 -","- H56 N24 O100 Y8 -","4","0.5","KA1002","Ribár, B.; Kapor, A.; Scott, B.; Willett, R. D.","Reinvestigation of the structure of [Y(H~2~O)~5~(NO~3~)~2~][Y(H~2~O)~2~(NO~3~)~4~]","Acta Crystallographica Section C","1993","49","2","314","316","10.1107/S0108270192005687","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","191093","2020-10-21","18:00:00",""
"2001972","10.342","0.001","13.51","0.001","8.693","0.001","90","","90","","90","","1214.6","0.2","","","","","","","","","","","","5","P 21 21 2","","","","","","- C8 H32 Bi Cl7 N4 -","- C8 H32 Bi Cl7 N4 -","- C16 H64 Bi2 Cl14 N8 -","2","0.5","SE1009","Herdtweck, E.; Kreusel, U.","Structure of tetrakis(dimethylammonium) chloride hexachlorobismuthate(III), {[(CH~3~)~2~NH~2~]^+^}~4~.Cl^{‒^}.[BiCl~6~]^3{‒^}","Acta Crystallographica Section C","1993","49","2","318","320","10.1107/S0108270192007017","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001973","20.897","0.002","20.897","0.002","20.897","0.002","90","","90","","90","","9125.4","1.5","","","","","","","","","","","","6","F 2 3","F 2 2 3","","","","","- C48 H96 Br12 Cu O24 Tl6 -","- C48 Br12 Cu O24 Tl6 -","- C192 Br48 Cu4 O96 Tl24 -","4","0.0833333","HH0592","Kahwa, I. A.; Miller, D.; Mitchel, M.; Fronczek, F. R.","Structure of the thallium-rich complex [(Tl18-crown-6)~4~CuBr~4~][TlBr~4~]~2~","Acta Crystallographica Section C","1993","49","2","320","321","10.1107/S0108270192007054","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001974","10.754","0.004","11.084","0.003","8.564","0.002","90","","90","","90","","1020.8","0.5","","","","","","","","","","","","6","P c a 21","P 2c -2ac","","","","","- C5 H16 Cl Co N4 O3 -","- C5 H16 Cl Co N4 O3 -","- C20 H64 Cl4 Co4 N16 O12 -","4","1","HU0389","García-Granda, S.; Calvo-Pérez, V.; Gómez-Beltrán, F.","Structure redetermination of carbonatobis(ethlenediamine)cobalt(III) chloride","Acta Crystallographica Section C","1993","49","2","322","324","10.1107/S0108270192006085","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001975","11.639","0.001","13.216","0.001","15.698","0.002","90","","107.48","0.01","90","","2303.2","0.4","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 Cl2 N2 Ni O10 S2 -","- C16 H24 Cl2 N2 Ni O10 S2 -","- C64 H96 Cl8 N8 Ni4 O40 S8 -","4","1","SH1005","Bermejo, E.; Castiñeiras, A.; Domínguez, R.; Strähle, J.; Hiller, W.","Structure of diaqua[1,8-bis(2-pyridyl)-3,6-dithiaoctane-<i>N</i>,<i>N'</i>,<i>S</i>,<i>S'</i>]nickel(II) diperchlorate at 243 K","Acta Crystallographica Section C","1993","49","2","324","326","10.1107/S0108270192006474","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001976","13","0.02","15.42","0.003","20.281","0.008","94.39","0.03","89.91","0.04","114.65","0.04","3682","6","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C82 H60 Mo2 N2 O10 P4 -","- C10 Mo2 O10 -","- C20 Mo4 O20 -","2","1","HH0598","Bachman, R. E.; Whitmire, K. H.","Bis[bis(triphenylphosphine)iminium] decacarbonyldimolybdenum(<i>Mo{–</i>Mo})","Acta Crystallographica Section C","1993","49","2","327","328","10.1107/S0108270192006498","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001977","10.977","0.002","12.894","0.002","31.135","0.006","90","","90","","90","","4406.8","1.4","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C22 H28 O14 -","- C22 H25 O12.5 -","- C176 H200 O100 -","8","2","HA0108","Soriano-García, M.; Iribe, R. V.; Mendoza-Díaz, S.; del Rayo Camacho, M.; Mata, R.","Structure of 4-(3,4-dihydroxyphenyl)-5-(<i>O</i>-β-<small>D</small>-galactopyranosyl)-7-methoxycoumarin trihydrate","Acta Crystallographica Section C","1993","49","2","329","330","10.1107/S0108270192003974","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001978","9.0383","0.001","9.3596","0.0009","11.855","0.003","68.207","0.013","74.837","0.014","59.858","0.009","801.8","0.3","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H54 Si6 -","- C22 H54 Si6 -","- C22 H54 Si6 -","1","0.5","HE0040","Fronczek, F. R.; Lickiss, P. D.","Structure of the highly crowded alkyne di[tris(trimethylsilyl)methyl]acetylene and the octasilane hexakis(trimethylsilyl)disilane","Acta Crystallographica Section C","1993","49","2","331","333","10.1107/S0108270192002737","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001979","16.154","0.002","16.154","0.002","22.859","0.003","90","","90","","120","","5165.9","1.1","","","","","","","","","","","","3","R -3 c","-R 3 2""c","","","","","- C18 H54 Si8 -","- C18 H54 Si8 -","- C108 H324 Si48 -","6","","HE0040","Fronczek, F. R.; Lickiss, P. D.","Structure of the highly crowded alkyne di[tris(trimethylsilyl)methyl]acetylene and the octasilane hexakis(trimethylsilyl)disilane","Acta Crystallographica Section C","1993","49","2","331","333","10.1107/S0108270192002737","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001980","25.269","0.002","23.347","0.002","8.306","0.002","90","","91.71","0.01","90","","4898","1.3","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C16 H11 N S -","- C16 H11 N S -","- C256 H176 N16 S16 -","16","4","AS0593","Yoshida, S.; Matsuzawa, H.; Kozawa, K.; Uchida, T.","Structures of benzo[<i>a</i>]phenothiazine and benzo[<i>c</i>]phenothiazine","Acta Crystallographica Section C","1993","49","2","333","336","10.1107/S0108270192005596","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001981","19.703","0.003","5.365","0.002","11.523","0.001","90","","95.48","0.01","90","","1212.5","0.5","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C16 H11 N S -","- C16 H11 N S -","- C64 H44 N4 S4 -","4","1","AS0593","Yoshida, S.; Matsuzawa, H.; Kozawa, K.; Uchida, T.","Structures of benzo[<i>a</i>]phenothiazine and benzo[<i>c</i>]phenothiazine","Acta Crystallographica Section C","1993","49","2","333","336","10.1107/S0108270192005596","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2001982","9.752","0.005","9.442","0.006","9.894","0.007","90","","99.24","0.05","90","","899.2","1","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H23 N O2 -","- C21 H23 N O2 -","- C42 H46 N2 O4 -","2","1","GR0191","Hardgrove, Jnr, G. L.; Clark, J. S.; Hanson, R. M.; Thieu, A. Q.","Structure of (<i>S</i>,<i>S</i>)-(<i>E</i>)-3-(2-butenoyl)-2,4-bis(phenylmethyl)oxazolidine","Acta Crystallographica Section C","1993","49","2","336","338","10.1107/S0108270192004761","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2001983","5.725","0.001","9.038","0.001","10.401","0.002","101.37","0.01","102.63","0.01","102.83","0.01","494.67","0.15","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C11 H11 N O3 -","- C11 H11 N O3 -","- C22 H22 N2 O6 -","2","1","ST1000","Maverick, E.; Chiefari, J.; Lightner, D. A.","Structure of 6-(3,3-dimethyl-2-oxo-2,3-dihydro-5-furanyl)-2-pyridone at 145 K","Acta Crystallographica Section C","1993","49","2","338","340","10.1107/S0108270192005675","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001984","13.633","0.003","9.102","0.002","10.153","0.002","90","","90","","90","","1259.9","0.5","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H16 O4 -","- C15 H16 O4 -","- C60 H64 O16 -","4","1","AS0584","Okada, K.; Koyama, H.","Structure of the germacrane furanosesquiterpenoid linderane","Acta Crystallographica Section C","1993","49","2","341","343","10.1107/S010827019200595X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2001985","6.782","0.002","18.496","0.003","12.439","0.003","90","","99.34","0.01","90","","1539.7","0.6","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H17 N O4 -","- C18 H17 N O4 -","- C72 H68 N4 O16 -","4","1","AB1004","Leban, I.; Kočevar, M.; Verček, B.","Structure of 3-benzoylamino-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydrocoumarin","Acta Crystallographica Section C","1993","49","2","343","345","10.1107/S010827019200444X","","","0.71069","MoKα","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2001986","16.192","0.003","12.382","0.002","19.353","0.003","90","","104.99","0.01","90","","3748","1.1","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C21 H22 O1.5 P -","- C21 H22 O1.5 P -","- C168 H176 O12 P8 -","8","1","BR1002","Churchill, M. R.; See, R. F.; Randall, S. L.; Atwood, J. D.","Structure of tri-<i>p</i>-tolylphosphine oxide hemihydrate, P(<i>p</i>-C~6~H~4~CH~3~)~3~O.1/2H~2~O","Acta Crystallographica Section C","1993","49","2","345","347","10.1107/S0108270192006073","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001987","6.3555","0.0007","11.615","0.004","12.365","0.004","111.44","0.03","100.06","0.02","96.38","0.02","821.2","0.5","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H23 N O4 -","- C17 H23 N O4 -","- C34 H46 N2 O8 -","2","1","HL1002","White, J. M.; Robertson, G. B.","Low-temperature structures of <i>cis</i>-4-<i>tert</i>-butylcyclohexyl <i>p</i>-nitrobenzoate (1) and <i>trans</i>-4-<i>tert</i>-butylcyclohexyl <i>p</i>-nitrobenzoate (2)","Acta Crystallographica Section C","1993","49","2","347","350","10.1107/S0108270192006024","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","200776","2020-10-21","18:00:00",""
"2001988","5.9963","0.0007","15.511","0.004","17.244","0.004","83.15","0.02","89.73","0.01","87.94","0.02","1591.4","0.6","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H23 N O4 -","- C17 H23 N O4 -","- C68 H92 N4 O16 -","4","2","HL1002","White, J. M.; Robertson, G. B.","Low-temperature structures of <i>cis</i>-4-<i>tert</i>-butylcyclohexyl <i>p</i>-nitrobenzoate (1) and <i>trans</i>-4-<i>tert</i>-butylcyclohexyl <i>p</i>-nitrobenzoate (2)","Acta Crystallographica Section C","1993","49","2","347","350","10.1107/S0108270192006024","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001989","8.006","0.002","9.548","0.002","14.647","0.012","80.34","0.02","80.3","0.02","77.98","0.02","1069.2","0.9","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H28 N2 O4 S -","- C23 H28 N2 O4 S -","- C46 H56 N4 O8 S2 -","2","1","CR0417","Bryant, Jnr, G. L.; Yakymyshyn, C. P.; Stewart, K. R.","Structure of 4'-dimethylamino-4-methyl-4-azastilbenium <i>p</i>-toluenesulfonate hydrate","Acta Crystallographica Section C","1993","49","2","350","351","10.1107/S0108270192005535","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2001990","8.303","0.014","8.733","0.001","12.998","0.002","90","","107.73","0.02","90","","897.7","1.5","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H12 N4 -","- C8 H12 N4 -","- C32 H48 N16 -","4","1","CR0398","Shoja, M.; Saba, S.","1,3-Dicyanomethylhexahydropyrimidine","Acta Crystallographica Section C","1993","49","2","354","355","10.1107/S0108270192005614","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2001991","29.085","0.015","9.149","0.004","11.266","0.005","90","","90","","90","","2998","2","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C18 H15 O P -","- C18 H15 O P -","- C144 H120 O8 P8 -","8","1","MU1009","Thomas, J. A.; Hamor, T. A.","Structure of orthorhombic triphenylphosphine oxide: a redetermination at room temperature","Acta Crystallographica Section C","1993","49","2","355","357","10.1107/S0108270192006176","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001992","7.768","0.001","26.621","0.003","7.467","0.001","90","","90","","90","","1544.1","0.3","","","","","","","","","","","","3","P n a 21","","","","","","- C18 H16 O7 -","- C18 H16 O7 -","- C72 H64 O28 -","4","1","CR1011","Wallet, J.-C.; Wojtczak, A.; Cody, V.; Galitsky, N.; Gaydou, E. M.","5,7-Dihydroxy-2-(2,3,4-trimethoxyphenyl)-4<i>H</i>-1-benzopyran-4-one (5,7-dihydroxy-2',3',4'-trimethoxyflavone)","Acta Crystallographica Section C","1993","49","2","357","359","10.1107/S010827019200670X","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001993","10.58","0.005","9.803","0.004","13.61","0.007","90","","104.57","0.04","90","","1366.2","1.1","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C18 H40 Cl2 N2 Si4 -","- C18 H40 Cl2 N2 Si4 -","- C36 H80 Cl4 N4 Si8 -","2","0.5","SH1006","Auner, N.; Herdtweck, E.; Penzenstadler, E.","Structure of 1,3-di-<i>tert</i>-butyl-2,4-dichloro-2,4-bis[1-(trimethylsilyl)vinyl]-1,3-diaza-2,4-disilacyclobutane","Acta Crystallographica Section C","1993","49","2","359","360","10.1107/S0108270192006899","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001994","15.146","0.006","11.049","0.006","12.189","0.006","117.15","0.04","109.72","0.04","90.54","0.04","1676","4","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- H42 N8 O32 P8 Te -","- H42 N8 O32 P8 Te -","- H84 N16 O64 P16 Te2 -","2","1","PA1019","Averbuch-Pouchot, M.-T.; Durif, A.","Ammonium <i>cyclo</i>-octaphosphate–telluric acid dihydrate adduct","Acta Crystallographica Section C","1993","49","2","361","363","10.1107/S0108270192009466","","","0.5608","AgKα","","","0.031","","","0.033","","","","","1.559","1.559","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2001995","27.558","0.005","5.55","0.002","20.855","0.003","90","","108.79","0.01","90","","3019.7","1.3","143","1","143","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","sodium thiosulphate 2/3-hydrate","","","- H Na2 O4 S2 -","- H1.33333 Na2 O3.66667 S2 -","- H32 Na48 O88 S48 -","24","3","SE1007","Hesse, W.; Leutner, B.; Böhn, K.-H.; Walker, N. P. C.","Structure of a new sodium thiosulfate hydrate","Acta Crystallographica Section C","1993","49","2","363","365","10.1107/S0108270192009399","","","1.54178","CuKα","","0.0323","0.0262","","0.0967","0.0699","","","","1.081","1.114","1.114","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001996","10.059","0.007","10.226","0.007","29.416","0.015","90","","90","","90","","3026","3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","bis(π-allylhimachalène) α,α-dichlorodipalladium","","- C30 H46 Cl2 Pd2 -","- C33 H36 Cl2 Pd2 -","- C132 H144 Cl8 Pd8 -","4","1","PA1026","Chiaroni, A.; Riche, C.; El Firdoussi, L.; Benharref, A.; Karim, A.","Structure du bis(π-allylhimachalène)-α,α-dichlorodipalladium","Acta Crystallographica Section C","1993","49","2","365","368","10.1107/S0108270192010552","","","0.7107","MoKα","","","0.051","","","0.064","","","","","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001997","11.137","0.003","16.016","0.003","11.765","0.003","90","","97.35","0.02","90","","2081.3","0.9","298","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C23 H21 N O S Sn -","- C23 H21 N O S Sn -","- C92 H84 N4 O4 S4 Sn4 -","4","1","LI1015","Okechukwu, R. C.; Fun, H.-K.; Teoh, S.-G.; Teo, S.-B.; Chinnakali, K.","Structure of [<i>N</i>-(2-mercaptophenyl)-4-oxo-2-pentylideneaminato-<i>N</i>,<i>O</i>,<i>S</i>]diphenyltin(IV)","Acta Crystallographica Section C","1993","49","2","368","370","10.1107/S0108270192008928","","","0.71069","MoKα","","","0.0229","","","0.0216","","","","","2.01","2.01","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001998","9.082","0.002","31.835","0.007","9","0.002","90","","119.44","0.01","90","","2266.1","0.9","130","","","","","","","","","","","4","C 1 c 1","C -2yc","","","","","- C11 H10 Cu N3 -","- C11 H10 Cu N3 -","- C88 H80 Cu8 N24 -","8","2","AL1021","Olmstead, M. M.; Speier, G.; Szabó, L.","Structure of [Cu(CN)(py)~2~]","Acta Crystallographica Section C","1993","49","2","370","372","10.1107/S0108270192009326","","","0.71073","MoKα","","","0.032","","","0.035","","","","","1.6","1.6","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001999","9.177","0.002","13.393","0.002","19.624","0.003","90","","102.09","","90","","2358.4","0.7","293","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 Cl2 N4 O9 Zn -","- C20 H18 Cl2 N4 O9 Zn -","- C80 H72 Cl8 N16 O36 Zn4 -","4","1","SP1002","Liu, M.; Arora, S. K.","Structure of aquabis(2,2'-bipyridyl)zinc(II) diperchlorate","Acta Crystallographica Section C","1993","49","2","372","374","10.1107/S0108270192009478","","","0.71069","MoKα","","","0.063","","","0.065","","","","","1.5","1.5","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002000","8.555","0.001","8.604","0.001","9.869","0.001","103.12","0.01","115.15","0.01","102.19","0.01","600.14","0.15","293","","","","","","","","","","","5","P -1","-P 1","2","","Bis(mu-cyclohexylphosphanido)-octacarbonyl-dimanganese","","- C20 H24 Mn2 O8 P2 -","- C20 H24 Mn2 O8 P2 -","- C20 H24 Mn2 O8 P2 -","1","0.5","NA1017","Flörke, U.; Haupt, H.-J.","Dimanganese octacarbonyl compounds with bridging cyclohexylphosphanes","Acta Crystallographica Section C","1993","49","2","374","376","10.1107/S0108270192010631","","","0.71073","MolybdenumKα","","","0.024","","","0.028","","","","","1.52","1.52","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2002001","8.668","0.004","23.157","0.011","8.961","0.004","90","0.01","107.03","0.04","90","0.01","1719.8","1.4","293","","","","","","","","","","","5","C 1 2/m 1","","","","Bis(mu-dicyclohexylphosphanido)-octacarbonyl-dimanganese","","- C32 H44 Mn2 O8 P2 -","- C32 H44 Mn2 O8 P2 -","- C64 H88 Mn4 O16 P4 -","2","0.25","NA1017","Flörke, U.; Haupt, H.-J.","Dimanganese octacarbonyl compounds with bridging cyclohexylphosphanes","Acta Crystallographica Section C","1993","49","2","374","376","10.1107/S0108270192010631","","","0.71073","MolybdenumKα","","","0.04","","","0.045","","","","","1.776","1.776","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002002","8.722","0.001","10.24","0.001","10.997","0.001","109.38","0.01","96.64","0.01","109.02","0.01","847.92","0.18","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H16 Cl2 Pt S2 -","- C16 H16 Cl2 Pt0.5 S2 -","- C32 H32 Cl4 Pt S4 -","2","1","BR1008","Parvez, M.; Fait, J. F.; Clark, P. D.; Jones, C. G.","<i>trans</i>-Dichlorobis(1,3-dihydrobenzo[<i>c</i>]thiophene-<i>S</i>)platinum(II)","Acta Crystallographica Section C","1993","49","2","376","377","10.1107/S0108270192009533","","","0.71069","MoKα","","","0.037","","","0.037","","","","","3.854","3.854","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002003","6.525","0.002","13.183","0.004","14.031","0.006","90","","99.16","0.04","90","","1191.5","0.7","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H8 Fe N2 O3 -","- C13 H8 Fe N2 O3 -","- C52 H32 Fe4 N8 O12 -","4","1","SH1001","Irngartinger, H.; Oeser, T.; Köhler, C.-M.","Two iron–tricarbonyl complexes with substituted bicyclo[2.2.2]octadienes","Acta Crystallographica Section C","1993","49","2","378","381","10.1107/S0108270192005924","","","0.71071","MoKα","","","0.028","","","0.036","","","","","1.64","1.64","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002004","8.18","0.001","8.097","0.001","23.059","0.004","90","","91.03","0.01","90","","1527","0.4","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C15 H14 Fe O7 -","- C15 H14 Fe O7 -","- C60 H56 Fe4 O28 -","4","1","SH1001","Irngartinger, H.; Oeser, T.; Köhler, C.-M.","Two iron‒tricarbonyl complexes with substituted bicyclo[2.2.2]octadienes","Acta Crystallographica Section C","1993","49","2","378","381","10.1107/S0108270192005924","","","0.71071","MoKα","","","0.029","","","0.038","","","","","1.8","1.8","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002005","7.959","0.001","11.488","0.004","11.559","0.002","91.58","0.02","101.69","0.01","91.62","0.02","1033.9","0.4","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- C19 H14 Cl Fe N O7 -","- C23 H18 Cl Fe N O7 -","- C46 H36 Cl2 Fe2 N2 O14 -","2","1","NA1009","Wang, J.-C.; Sun, C.-H.; Yang, G.-Z.; Fronczek, F. R.; Watkins, S. F.","Structure of [Fe(C~16~H~14~ClNO~4~)(CO)~3~]","Acta Crystallographica Section C","1993","49","2","381","383","10.1107/S0108270192009934","","","0.71073","MoKα","","","0.049","","","0.056","","","","","2.649","2.649","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002006","7.947","0.002","31.447","0.003","10.275","0.001","90","","109.57","0.01","90","","2419.5","0.7","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C24 H24 Cl3 Rh S3 -","- C24 H24 Cl3 Rh S3 -","- C96 H96 Cl12 Rh4 S12 -","4","1","BR1009","Parvez, M.; Fait, J. F.; Clark, P. D.; Jones, C. G.","<i>mer</i>-Trichlorotris(2,3-dihydrobenzo[<i>b</i>]thiophene-<i>S</i>)rhodium(III)","Acta Crystallographica Section C","1993","49","2","383","385","10.1107/S0108270192009545","","","0.71069","MoKα","","","0.046","","","0.03","","","","","2.377","2.377","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002007","6.61","0.005","11.272","0.003","10.738","0.003","90","","90","","90","","800.1","0.7","83","","","","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","1","LI1018","Zukerman-Schpector, J.; Boscaini, R. C.; Ferreira, J. T. B.; Marques, F. A.","Structure of 6-methyl-2-oxabicyclo[4.3.0]non-4-ene-3,8-dione","Acta Crystallographica Section C","1993","49","2","385","387","10.1107/S0108270192008497","","","0.70926","Mo","","","0.035","","","0.036","","","","","1.08","1.08","","","","","has coordinates","203418","2020-10-21","18:00:00",""
"2002008","7.387","0.001","10.719","0.002","12.325","0.002","90","","90","","90","","975.9","0.3","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C10 H11 N O3 -","- C10 H11 N O3 -","- C40 H44 N4 O12 -","4","1","CD1007","Boys, D.; Manríquez, V.; Cassels, B. K.","Structure of (<i>E</i>)-1-(4-methoxyphenyl)-2-nitropropene","Acta Crystallographica Section C","1993","49","2","387","388","10.1107/S0108270192009193","","","0.71073","MoKα","","","0.039","","","0.055","","","","","0.99","0.99","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002009","11.749","0.003","12.028","0.002","15.652","0.006","90","","93.26","0.03","90","","2208.3","1.1","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 I3 P -","- C20 H20 I3 P -","- C80 H80 I12 P4 -","4","1","CD1009","Bélanger, S.; Beauchamp, A. L.","Structure of ethyltriphenylphosphonium triiodide, [P(C~2~H~5~)(C~6~H~5~)~3~]I~3~","Acta Crystallographica Section C","1993","49","2","388","391","10.1107/S010827019200920X","","","1.54178","CuKα","","","0.049","","","0.048","","","","","1.73","1.73","","","","","has coordinates","203419","2020-10-21","18:00:00",""
"2002010","6.841","0.008","7.219","0.006","18.51","0.02","90","","90","","90","","914.1","1.6","298","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C8 H15 N O3 -","- C8 H15 N O3 -","- C32 H60 N4 O12 -","4","1","HL1013","Koh, L. L.; Lee, C.-K.; Sim, K. Y.; Zhu, J.","Structure of 1-deoxycastanospermine","Acta Crystallographica Section C","1993","49","2","391","392","10.1107/S0108270192009120","","","0.71069","MoKα","","","0.04","","","0.05","","","","","1.74","1.74","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002011","15.76","0.002","10.832","0.002","16.611","0.002","90","","116.34","0.01","90","","2541.3","0.7","296","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C31 H25 N3 P2 -","- C31 H25 N3 P2 -","- C124 H100 N12 P8 -","4","0.5","BR1015","Chandrasekhar, V.; Chivers, T.; Parvez, M.","Structure of 2,2,4,4,6-pentaphenyl-2,4,1,3,5-diphosphatriazine; a six-membered P~2~N~3~C ring","Acta Crystallographica Section C","1993","49","2","393","394","10.1107/S0108270192009715","","","0.71093","MoKα","","","0.049","","","0.04","","","","","1.77","1.77","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002012","7.815","0.002","7.07","0.001","14.475","0.003","90","","97.07","0.03","90","","793.7","0.3","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 N4 O4 -","- C16 H14 N4 O4 -","- C32 H28 N8 O8 -","2","0.5","SP1003","Hsu, L.-Y.; Nordman, C. E.; Kenny, D. H.","Structures of (<i>E</i>,<i>E</i>)-<i>o</i>-nitroacetophenone azine (I), (<i>E</i>,<i>Z</i>)-<i>o</i>-nitroacetophenone azine (II) and (<i>E</i>,<i>E</i>)-<i>o</i>-nitrobenzaldehyde azine (III)","Acta Crystallographica Section C","1993","49","2","394","398","10.1107/S0108270192009685","","","0.71069","MoKα","","","0.055","","","0.04","","","","","2.375","2.375","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002013","7.713","0.001","13.359","0.002","15.557","0.002","90","","99.85","0.01","90","","1579.3","0.4","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C16 H14 N4 O4 -","- C16 H14 N4 O4 -","- C64 H56 N16 O16 -","4","1","SP1003","Hsu, L.-Y.; Nordman, C. E.; Kenny, D. H.","Structures of (<i>E</i>,<i>E</i>)-<i>o</i>-nitroacetophenone azine (I), (<i>E</i>,<i>Z</i>)-<i>o</i>-nitroacetophenone azine (II) and (<i>E</i>,<i>E</i>)-<i>o</i>-nitrobenzaldehyde azine (III)","Acta Crystallographica Section C","1993","49","2","394","398","10.1107/S0108270192009685","","","0.71069","MoKα","","","0.044","","","0.033","","","","","2.661","2.661","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002014","11.905","0.003","6.274","0.001","9.176","0.001","90","","94.97","0.01","90","","682.8","0.2","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 N4 O4 -","- C14 H10 N4 O4 -","- C28 H20 N8 O8 -","2","0.5","SP1003","Hsu, L.-Y.; Nordman, C. E.; Kenny, D. H.","Structures of (<i>E</i>,<i>E</i>)-<i>o</i>-nitroacetophenone azine (I), (<i>E</i>,<i>Z</i>)-<i>o</i>-nitroacetophenone azine (II) and (<i>E</i>,<i>E</i>)-<i>o</i>-nitrobenzaldehyde azine (III)","Acta Crystallographica Section C","1993","49","2","394","398","10.1107/S0108270192009685","","","0.71069","MoKα","","","0.051","","","0.038","","","","","2.575","2.575","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002015","7.526","0.002","19.107","0.002","5.785","0.002","90","","90","","90","","831.9","0.4","173","2","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C12 D8 O -","- C24 D16 O2 -","- C96 D64 O8 -","4","0.5","ST1020","Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E.","Structure of dibenzofuran-<i>d</i>~8~, C~12~D~8~O, at 173 K","Acta Crystallographica Section C","1993","49","2","398","400","10.1107/S0108270192009375","","","0.71073","MoKα","","","0.051","","","0.064","","","","","2.11","2.11","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2002016","14.91","0.02","13.48","0.02","13.01","0.01","90","","90.47","0.07","90","","2615","6","293","1","293","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2,2,3,3,4,4,5-octamethyl-6,7,8-trioxabicyclo[3.2.1]octane","","- C13 H24 O3 -","- C13 H24 O3 -","- C104 H192 O24 -","8","2","AB1017","Jerzykiewicz, L. B.; Dziewońska-Baran, D.; Baran, J.; Lis, T.","Structure of 1,2,2,3,3,4,4,5-octamethyl-6,7,8-trioxabicyclo[3.2.1]octane","Acta Crystallographica Section C","1993","49","2","400","402","10.1107/S0108270192010175","","","1.5418","CuKα","","","0.037","","","0.035","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2002017","14.93","0.002","11.193","0.001","17.211","0.001","90","","99.896","0.005","90","","2833.4","0.5","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,3-Xylyl-(18-crown-5)-ammonium-catecholborate","","- C28 H36 B N O9 -","- C28 H36 B N O9 -","- C112 H144 B4 N4 O36 -","4","1","AB1034","Goddard, R.; Niemeyer, C. M.; Reetz, M. T.","Structure of 1,3-xylyl-(18-crown-5)‒ammonium catecholborate (1/1)","Acta Crystallographica Section C","1993","49","2","402","404","10.1107/S0108270192010485","","","0.71069","MoKα","","0.109","0.06","","","0.059","","","","","1.97","1.97","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002018","10.609","0.004","13.705","0.007","23.535","0.006","90","","90","","90","","3422","2","293","","","","","","","","","","","5","P b c n","-P 2n 2ab","","","","","- C38 H28 N3 O6 P3 -","- C38 H28 N3 O6 P3 -","- C152 H112 N12 O24 P12 -","4","0.5","AS1012","Kubono, K.; Asaka, N.; Isoda, S.; Kobayashi, T.; Taga, T.","Structure of 1:1 clathrate between tris(2,3-naphthalenedioxy)cyclotriphosphazene and <i>p</i>-xylene","Acta Crystallographica Section C","1993","49","2","404","406","10.1107/S0108270192009089","","","1.54178","CuKα","","","0.041","","","0.0484","","","","","2.24","2.24","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2002019","8.028","0.004","5.456","0.003","24.035","0.009","90","","90","","90","","1052.8","0.9","223","","","","","","","","","","","3","P c a 21","P 2c -2ac","","","","","- C14 H12 O -","- C14 H12 O -","- C56 H48 O4 -","4","1","BR1010","Rieker, T. P.; Haltiwanger, C.; Eidman, K.; Walba, D. W.; Clark, N. A.; Larson, A. C.","Structure of 2-phenylacetophenone","Acta Crystallographica Section C","1993","49","2","406","408","10.1107/S0108270192009442","","","0.7107","MoKα","","","0.033","","","0.037","","","","","2.79","2.79","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002020","8.518","0.001","23.151","0.003","7.112","0.001","90","","111.6","0.2","90","","1304","1.8","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H32 N3 O7 -","- C25 H31 N3 O7 -","- C50 H62 N6 O14 -","2","1","CD1012","Valle, G.; Formaggio, F.; Crisma, M.; Toniolo, C.; Kamphuis, J.","Structure of <i>Z</i>-<small>L</small>-(αMe)Phe-(<small>L</small>-Ala)~2~-OMe monohydrate","Acta Crystallographica Section C","1993","49","2","408","410","10.1107/S0108270192010023","","","0.7107","MoKα","","","0.065","","","0.075","","","","","1.48","1.48","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2002021","9.894","0.001","10.971","0.002","5.658","0.001","102.9","0.01","91.17","0.01","81.14","0.01","591.45","0.16","298","2","","","","","","","","","","3","P -1","-P 1","2","","","","- C14 H18 O2 -","- C14 H18 O2 -","- C28 H36 O4 -","2","1","AS1019","Kawata, T.; Okuda, M.; Ohba, S.; Umehara, M.; Honnami, H.; Hishida, S.","Tricyclo[9.3.0.0^3,7^]tetradec-3-ene-5,10-dione (I), tetracyclo[9.3.0.0^1,5^.0^5,9^]tetradecane-2,7-dione (II) and <i>cis</i>-<i>cisoid</i>-<i>cis</i>-2,9-epoxy-9-methyltricyclo[9.3.0.0^4,8^]tetradecan-2-ol (III)","Acta Crystallographica Section C","1993","49","2","410","413","10.1107/S0108270192009491","","","0.71073","MoKα","","","0.044","","","0.047","","","","","1.79","1.79","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002022","13.406","0.002","13.346","0.002","6.86","0.002","90","","104.61","0.02","90","","1187.7","0.4","293","2","","","","","","","","","","3","P 1 21/a 1","-P 2yab","","","","","- C14 H18 O2 -","- C14 H18 O2 -","- C56 H72 O8 -","4","1","AS1019","Kawata, T.; Okuda, M.; Ohba, S.; Umehara, M.; Honnami, H.; Hishida, S.","Tricyclo[9.3.0.0^3,7^]tetradec-3-ene-5,10-dione (I), tetracyclo[9.3.0.0^1,5^.0^5,9^]tetradecane-2,7-dione (II) and <i>cis</i>-<i>cisoid</i>-<i>cis</i>-2,9-epoxy-9-methyltricyclo[9.3.0.0^4,8^]tetradecan-2-ol (III)","Acta Crystallographica Section C","1993","49","2","410","413","10.1107/S0108270192009491","","","0.71073","MoKα","","","0.05","","","0.046","","","","","1.54","1.54","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002023","12.109","0.002","10.649","0.002","10.407","0.001","90","","98.3","0.01","90","","1327.9","0.4","298","2","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H24 O2 -","- C15 H24 O2 -","- C60 H96 O8 -","4","1","AS1019","Kawata, T.; Okuda, M.; Ohba, S.; Umehara, M.; Honnami, H.; Hishida, S.","Tricyclo[9.3.0.0^3,7^]tetradec-3-ene-5,10-dione (I), tetracyclo[9.3.0.0^1,5^.0^5,9^]tetradecane-2,7-dione (II) and <i>cis</i>-<i>cisoid</i>-<i>cis</i>-2,9-epoxy-9-methyltricyclo[9.3.0.0^4,8^]tetradecan-2-ol (III)","Acta Crystallographica Section C","1993","49","2","410","413","10.1107/S0108270192009491","","","0.71073","MoKα","","","0.048","","","0.05","","","","","1.87","1.87","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002024","22.805","0.001","15.156","0.001","8.004","0.002","90","","91.66","0.01","90","","2765.3","0.7","296","1","","","","","","","","","","4","C 1 2 1","C 2y","","","","","- C20 H23 N5 O10 -","- C20 H23 N5 O10 -","- C80 H92 N20 O40 -","4","1","HU1015","Beddoes, R. L.; Russell, J. R.; Garner, C. D.; Joule, J. A.","Structure of a 6-(tetrahydroxybutyl)-substituted pteridine","Acta Crystallographica Section C","1993","49","2","413","416","10.1107/S0108270192009831","","","1.54178","CuKα","","","0.075","","","0.091","","","","","4.005","4.005","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002025","9.62","0.002","8.005","0.001","13.119","0.002","90","","109.98","0.01","90","","949.5","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- H5 O10 P3 Pr2 -","- H5 O10 P3 Pr2 -","- H20 O40 P12 Pr8 -","4","1","DU0341","Foulon, J.-D.; Tijani, N.; Durand, J.; Rafiq, M.; Cot, L.","Structure de Ln~2~(PO~3~H)~3~.H~2~O (Ln = Pr, Nd)","Acta Crystallographica Section C","1993","49","1","1","4","10.1107/S0108270192004050","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002026","9.581","0.002","7.98","0.002","13.056","0.003","90","","108.95","0.01","90","","944.1","0.4","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- H5 Nd2 O10 P3 -","- H5 Nd2 O10 P3 -","- H20 Nd8 O40 P12 -","4","1","DU0341","Foulon, J.-D.; Tijani, N.; Durand, J.; Rafiq, M.; Cot, L.","Structure de Ln~2~(PO~3~H)~3~.H~2~O (Ln = Pr, Nd)","Acta Crystallographica Section C","1993","49","1","1","4","10.1107/S0108270192004050","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002027","7.407","0.004","3.625","0.003","9.966","0.003","90","","109.16","0.03","90","","252.8","0.3","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- Fe Ta Te3 -","- Fe Ta Te3 -","- Fe2 Ta2 Te6 -","2","1","HE0023","Liu, S.-X.; Cai, G.-L.; Huang, J.-L.","Structure of a new ternary chalcogenide: FeTa(μ~4~-Te)(μ~3~-Te)~2~","Acta Crystallographica Section C","1993","49","1","4","7","10.1107/S010827019200355X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2002028","7.5214","0.0005","7.5214","0.0005","9.261","0.001","90","","90","","90","","523.91","0.08","","","","","","","","","","","","3","P -4 21 c","P -4 2n","114","","","","- F2 O5 S2 -","- F2 O5 S2 -","- F8 O20 S8 -","4","0.5","HA0109","Blake, A. J.; Žák, Z.","Structure of disulfuryl difluoride at 100 K","Acta Crystallographica Section C","1993","49","1","7","9","10.1107/S0108270192005547","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","207412","2020-10-21","18:00:00",""
"2002029","10.28","0.001","13.905","0.002","14.533","0.002","90","","90.3","0.01","90","","2077.4","0.5","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C7 H28 Cl3 Co N6 O13 -","- C7 H26 Cl3 Co N6 O15 -","- C28 H104 Cl12 Co4 N24 O60 -","4","1","AS0569","Searle, G. H.; Tiekink, E. R. T.; Atkinson, I. M.; Keene, F. R.","Structure of the stable isomer of the bis(ethane-1,2-diamine)(<i>N</i>-methylethane-1,2-diamine)cobalt(III) cation, [Co(meen)(en)~2~]^3+^","Acta Crystallographica Section C","1993","49","1","13","16","10.1107/S0108270192005092","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002030","10.891","0.003","8.312","0.002","20.507","0.006","90","","97.21","0.02","90","","1841.7","0.9","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 N2 O20 U -","- C28 H44 N2 O20 U -","- C56 H88 N4 O40 U2 -","2","0.5","DU0322","Deshayes, L.; Keller, N.; Lance, M.; Nierlich, M.; Vigner, D.","Complexes between uranyl nitrate and benzo-15-crown-5: structures of the (2/1) and (1/1) complexes of benzo-15-crown-5–diaquadinitratodioxouranium(VI)","Acta Crystallographica Section C","1993","49","1","16","19","10.1107/S0108270192004980","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002031","8.477","0.002","8.809","0.002","16.7","0.003","105.18","0.02","82.42","0.02","110.08","0.02","1129.2","0.5","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H24 N2 O15 -","- C14 H24 N2 O15 U -","- C28 H48 N4 O30 U2 -","2","1","DU0322","Deshayes, L.; Keller, N.; Lance, M.; Nierlich, M.; Vigner, D.","Complexes between uranyl nitrate and benzo-15-crown-5: structures of the (2/1) and (1/1) complexes of benzo-15-crown-5–diaquadinitratodioxouranium(VI)","Acta Crystallographica Section C","1993","49","1","16","19","10.1107/S0108270192004980","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002032","22.503","0.005","7.491","0.002","17.367","0.002","90","","110.76","0.01","90","","2737.5","1","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C20 H32 Cu2 N6 O10 S2 -","- C20 H32 Cu2 N6 O10 S2 -","- C80 H128 Cu8 N24 O40 S8 -","4","0.5","DU0311","Gutiérrez, J. N.; Garcia, E. A.; Viossat, B.; Dung, Nguyen-Huy; Busnot, A.; Hemidy, J. F.","Structure of μ-[cystamine-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetraacetato(4‒)]-bis(5-methylimidazole)dicopper(II) dihydrate","Acta Crystallographica Section C","1993","49","1","19","22","10.1107/S0108270192004682","","","0.1707","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002033","10.002","0.002","10.639","0.001","15.616","0.004","90","","102.05","0.02","90","","1625.1","0.6","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H42 Cl6 N4 Sn -","- C24 Cl6 N4 Sn -","- C48 Cl12 N8 Sn2 -","2","0.5","GE0308","Caira, M. R.; Nassimbeni, L. R.; Stephen, A. M.; Van Schalkwyk, T. G. D.","Geometry of the iminium moiety. III. Structures of a chiral form of bis[4,5-dihydro-3,5,5-trimethyl-1-(3'-methylcyclopentylidene)pyrazolium] hexachlorostannate and the racemate","Acta Crystallographica Section C","1993","49","1","22","26","10.1107/S0108270192005158","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002034","9.998","0.002","10.649","0.001","15.637","0.004","90","","102.03","0.02","90","","1628.3","0.6","","","","","","","","","","","","5","P 1 21 1","","","","","","- C24 H42 Cl6 N4 Sn -","- C25 Cl6 N4 Sn -","- C50 Cl12 N8 Sn2 -","2","1","GE0308","Caira, M. R.; Nassimbeni, L. R.; Stephen, A. M.; Van Schalkwyk, T. G. D.","Geometry of the iminium moiety. III. Structures of a chiral form of bis[4,5-dihydro-3,5,5-trimethyl-1-(3'-methylcyclopentylidene)pyrazolium] hexachlorostannate and the racemate","Acta Crystallographica Section C","1993","49","1","22","26","10.1107/S0108270192005158","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002035","10.788","0.001","18.56","0.001","8.158","0.001","90","","96.18","0.01","90","","1623.9","0.3","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C6 H17 Cl5 N2 O2 Sn -","- C6 H17 Cl5 N2 O2 Sn -","- C24 H68 Cl20 N8 O8 Sn4 -","4","1","GE0302","Caira, M. R.; Nassimbeni, L. R.; Stephen, A. M.; Van Schalkwyk, T. G. D.","Geometry of the iminium moiety. IV. Structure of 4,5-dihydro-3,5,5-trimethylpyrazolium aquapentachlorostannate monohydrate","Acta Crystallographica Section C","1993","49","1","26","30","10.1107/S0108270192005146","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002036","8.276","0.001","12.032","0.002","12.987","0.002","90","","97.11","0.01","90","","1283.3","0.3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C13 H14 Cl2 Ti -","- C18 H18 Cl2 Ti -","- C72 H72 Cl8 Ti4 -","4","1","CD0086","Gelmini, L.; Puddephatt, R. J.; Vittal, J. J.","Structure of dichloro(η^5^-cyclopentadienyl)(2-propenyl-η^5^-cyclopentadienyl)titanium(IV)","Acta Crystallographica Section C","1993","49","1","30","33","10.1107/S0108270192004281","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002037","12.284","0.007","14.509","0.004","19.308","0.007","90","","93.33","0.04","90","","3435","3","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C38 H35 Br2 O2 P2 Re -","- C40 H40 Br2 O2 P2 Re -","- C160 H160 Br8 O8 P8 Re4 -","4","0.5","CD0087","Lebuis, A.-M.; Roux, C.; Beauchamp, A. L.","Structure of <i>trans</i>-dibromo(ethoxo)oxobis(triphenylphosphine)rhenium(V)","Acta Crystallographica Section C","1993","49","1","33","36","10.1107/S0108270192004748","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002038","6.891","0.002","9.674","0.002","6.946","0.001","90","","100.07","0.02","90","","455.91","0.18","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C4 H4 N2 O2 -","- C4 H4 N2 O2 -","- C16 H16 N8 O8 -","4","1","HU0409","Katrusiak, A.","A new polymorph of maleic hydrazide","Acta Crystallographica Section C","1993","49","1","36","39","10.1107/S0108270192004918","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002039","11.831","0.002","11.831","0.002","19.948","0.007","90","","90","","120","","2418.1","1","","","","","","","","","","","","4","P 32 2 1","P 32 2""","","","","","- C14 H25 N O5 -","- C14 H25 N O5 -","- C84 H150 N6 O30 -","6","1","AL1005","Gallagher, T.; Giles, M. E.; Mahon, M. F.; Molloy, K. C.; Hadley, M. S.","Structure of 1,2,4-trideoxy-1,4-imino-3,5;6,7-di-<i>O</i>-isopropylidene-<small>L</small>-<i>glycero</i>-<small>D</small>-<i>gluco</i>-octitol: a key intermediate in the enantioselective synthesis of 8-epicastanospermine","Acta Crystallographica Section C","1993","49","1","40","42","10.1107/S0108270192004517","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002040","8.291","0.002","10.759","0.003","13.169","0.003","108.42","0.02","93.28","0.02","100.3","0.3","1088.4","1.4","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C19 H23 Cl2 N5 O3 S -","- C19 H23 Cl2 N5 O3 S -","- C38 H46 Cl4 N10 O6 S2 -","2","1","HA0106","Prout, K.; Burns, K.; Watkin, D. J.; Durant, G. J.; Brown, T. H.","Structure of oxmetidine dihydrochloride (SKF 92994)","Acta Crystallographica Section C","1993","49","1","44","46","10.1107/S0108270192003548","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2002041","7.057","0.002","13.017","0.003","13.982","0.003","90","","92.57","0.04","90","","1283.1","0.5","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C10 H16 Cl2 N2 O2 -","- C10 H16 Cl2 N2 O2 -","- C40 H64 Cl8 N8 O8 -","4","1","CD0059","Zhan, Y.; Barton, R. J.; Robertson, B. E.","Structure of 2,3-naphthalenediamine dihydrochloride dihydrate","Acta Crystallographica Section C","1993","49","1","46","48","10.1107/S0108270192004736","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002042","5.945","0.001","10.941","0.002","18.277","0.004","90","","90","","90","","1188.8","0.4","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H10 N4 O4 -","- C11 H10 N4 O4 -","- C44 H40 N16 O16 -","4","1","CR0389","Cheer, C. J.; Kavounis, C. A.; Bozopoulos, A. P.; Rentzeperis, P. J.; Theocharis, A. B.","Structure of 1-(4-nitrobenzoyloxy)-4,5-dimethyl-1,2,3-triazole","Acta Crystallographica Section C","1993","49","1","49","52","10.1107/S0108270192005195","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208466","2020-10-21","18:00:00",""
"2002043","7.611","0.003","9.427","0.005","18.603","0.014","90","","90","","90","","1334.7","1.3","","","","","","","","","","","","3","C m c e","-C 2ac 2","64","","","","- C7 F5 N -","- C7 F5 N -","- C56 F40 N8 -","8","0.5","SH1000","Lentz, D.; Preugschat, D.","Structure of pentafluorophenyl isocyanide at 115 K","Acta Crystallographica Section C","1993","49","1","52","54","10.1107/S0108270192006462","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","206165","2020-10-21","18:00:00",""
"2002044","23.073","0.001","17.34","0.003","7.299","0.001","90","","90","","90","","2920.2","0.7","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C17 H18 O3 S -","- C17 H18 O3 S -","- C136 H144 O24 S8 -","8","1","AS0338","Thinapong, P.; Pohmakotr, M.; Skelton, B.; White, A. H.","Structures of two diastereomers of 1-(α-hydroxy-<i>m</i>-methoxybenzyl)-1-(phenylsulfinyl)cyclopropane","Acta Crystallographica Section C","1993","49","1","54","57","10.1107/S0108270192004529","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002045","9.873","0.009","10.009","0.005","11.024","0.007","56.67","0.03","55.68","0.05","69.65","0.05","750.6","1","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H18 O3 S -","- C17 H18 O3 S -","- C34 H36 O6 S2 -","2","1","AS0338","Thinapong, P.; Pohmakotr, M.; Skelton, B.; White, A. H.","Structures of two diastereomers of 1-(α-hydroxy-<i>m</i>-methoxybenzyl)-1-(phenylsulfinyl)cyclopropane","Acta Crystallographica Section C","1993","49","1","54","57","10.1107/S0108270192004529","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002046","11.213","0.002","6.168","0.001","15.268","0.003","90","","95.07","0.01","90","","1051.8","0.3","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C12 H17 N O -","- C12 H17 N O -","- C48 H68 N4 O4 -","4","1","SH1003","Siemund, V.; Irngartinger, H.; Sigwart, C.; Kissler, B.; Gleiter, R.","Structures of four tricyclo[3.3.0.0^3,7^]octanes and a 4-oxatetracyclo[4.2.1.0 ^2,5^.0^3,7^]nonane derivative","Acta Crystallographica Section C","1993","49","1","57","62","10.1107/S0108270192005936","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002047","9.532","0.001","9.218","0.001","13.496","0.002","90","","97.57","0.01","90","","1175.5","0.3","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 O -","- C14 H18 O -","- C56 H72 O4 -","4","1","SH1003","Siemund, V.; Irngartinger, H.; Sigwart, C.; Kissler, B.; Gleiter, R.","Structures of four tricyclo[3.3.0.0^3,7^]octanes and a 4-oxatetracyclo[4.2.1.0 ^2,5^.0^3,7^]nonane derivative","Acta Crystallographica Section C","1993","49","1","57","62","10.1107/S0108270192005936","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002048","8.618","0.001","22.054","0.005","7.871","0.001","90","","93.24","0.01","90","","1493.6","0.4","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C17 H24 O -","- C17 H24 O -","- C68 H96 O4 -","4","1","SH1003","Siemund, V.; Irngartinger, H.; Sigwart, C.; Kissler, B.; Gleiter, R.","Structures of four tricyclo[3.3.0.0^3,7^]octanes and a 4-oxatetracyclo[4.2.1.0 ^2,5^.0^3,7^]nonane derivative","Acta Crystallographica Section C","1993","49","1","57","62","10.1107/S0108270192005936","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002049","11.796","0.003","11.483","0.002","11.312","0.002","90","","96.1","0.02","90","","1523.6","0.5","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C18 H24 O -","- C18 H24 O -","- C72 H96 O4 -","4","1","SH1003","Siemund, V.; Irngartinger, H.; Sigwart, C.; Kissler, B.; Gleiter, R.","Structures of four tricyclo[3.3.0.0^3,7^]octanes and a 4-oxatetracyclo[4.2.1.0 ^2,5^.0^3,7^]nonane derivative","Acta Crystallographica Section C","1993","49","1","57","62","10.1107/S0108270192005936","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002050","9.675","0.002","12.997","0.002","6.454","0.001","91.14","0.02","100.51","0.02","70.34","0.02","750.7","0.3","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C17 H24 O -","- C17 H24 O -","- C34 H48 O2 -","2","1","SH1003","Siemund, V.; Irngartinger, H.; Sigwart, C.; Kissler, B.; Gleiter, R.","Structures of four tricyclo[3.3.0.0^3,7^]octanes and a 4-oxatetracyclo[4.2.1.0 ^2,5^.0^3,7^]nonane derivative","Acta Crystallographica Section C","1993","49","1","57","62","10.1107/S0108270192005936","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002051","7.136","0.001","12.342","0.001","20.049","0.003","90","","90","","90","","1765.8","0.4","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H28 O4 -","- C21 H28 O4 -","- C84 H112 O16 -","4","1","LI1003","Dastidar, P.; Joseph, T.; Madyastha, K. M.; Guru Row, T. N.","Structure of pregna-4,16-diene-7α,14α-diol-3,20-dione","Acta Crystallographica Section C","1993","49","1","62","64","10.1107/S0108270192004566","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2002052","6.954","0.001","9.049","0.001","11.541","0.002","73.87","0.01","74.47","0.01","87.79","0.01","671.67","0.18","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C13 H16 Cl N O S -","- C13 H16 Cl N O S -","- C26 H32 Cl2 N2 O2 S2 -","2","1","HH1001","Shin, W.; Chae, C. H.","Structure of 3-benzyl-5-(2-hydroxyethyl)-4-methyl-1,3-thiazolium chloride","Acta Crystallographica Section C","1993","49","1","68","70","10.1107/S0108270192005638","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","200776","2020-10-21","18:00:00",""
"2002053","12.002","0.002","11.013","0.002","12.652","0.003","90","","106.24","0.03","90","","1605.6","0.6","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C20 H20 O3 -","- C20 H20 O3 -","- C80 H80 O12 -","4","1","CD0080","Alex, G.; Srinivasan, S.; Krishnasamy, V.; Suresh, R. V.; Iyer, R.; Iyer, P. R.","Structure of a chalcone","Acta Crystallographica Section C","1993","49","1","70","72","10.1107/S0108270192006152","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2002054","14.659","0.001","16.591","0.001","37.558","0.005","90","","90.38","0.01","90","","9134.2","1.5","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C50 H62 N2 O4 -","- C50 H62 N2 O4 -","- C400 H496 N16 O32 -","8","1","PA1003","Guelzim, A.; Khrifi, S.; Baert, F.; Loeber, C.; Asfari, Z.; Matt, D.; Vicens, J.","Structure of 5,11,17,23-tetra-<i>tert</i>-butyl-25,27-dicyanomethoxy-26,28-dimethoxycalix[4]arene","Acta Crystallographica Section C","1993","49","1","72","75","10.1107/S0108270192007005","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002055","9.1584","0.0014","6.91","0.003","20.224","0.004","90","","96.241","0.014","90","","1272.3","0.6","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H30 B Br O6 -","- C25 H30 B Br O6 -","- C50 H60 B2 Br2 O12 -","2","1","BR1003","Drouin, M.; Michel, A. G.; Guindon, Y.; Ogilvie, W.","Structure of dimethyl (2<i>R</i>,3<i>R</i>)-2-{[(<i>S</i>)-bromo(cyclohexyl)methyl]oxy}-3-[(diphenylboryl)oxy]-1,4-butanedioate","Acta Crystallographica Section C","1993","49","1","75","77","10.1107/S0108270192005973","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2002056","7.234","0.003","5.181","0.001","11.524","0.003","90","","92.94","0.03","90","","431.3","0.2","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- B2 Ca2 O5 -","- B2 Ca2 O5 -","- B8 Ca8 O20 -","4","1","AB0264","Ji, Y.; Liang, J.; Xie, S.; Zhu, N.; Li, Y.","Structure of 2CaO.B~2~O~3~","Acta Crystallographica Section C","1993","49","1","78","79","10.1107/S0108270192002130","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2002057","16.167","0.004","10.186","0.002","33.424","0.007","90","","99.94","0.02","90","","5422","2","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C51 H30 Cl N O15 P2 Rh6 -","- C51 H30 Cl N O15 P2 Rh6 -","- C204 H120 Cl4 N4 O60 P8 Rh24 -","4","1","ST0574","Rheingold, A. L.; White, C. B.; Macklin, P. D.; Geoffroy, G. L.","Bis(triphenylphosphine)iminium tetra-μ~3~-carbonyl-undecacarbonylchloro-<i>octahedro</i>-hexarhodium","Acta Crystallographica Section C","1993","49","1","80","81","10.1107/S0108270192005018","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002058","10.439","0.002","12.605","0.001","13.307","0.001","107.77","0.01","100.45","0.01","107.76","0.01","1513.5","0.4","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C33 H25 F3 Fe O3 P Rh -","- C33 H25 F3 Fe O3 P Rh -","- C66 H50 F6 Fe2 O6 P2 Rh2 -","2","1","AL0523","Lamprecht, G. J.; Swarts, J. C.; Conradie, J.; Leipoldt, J. G.","Structure of carbonyl[(ferrocenecarbonyl)trifluoroacetonato-κ<i>O</i>,κ<i>O</i>]triphenylphosphinerhodium(I)","Acta Crystallographica Section C","1993","49","1","82","84","10.1107/S0108270192002506","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2002059","8.774","0.001","15.474","0.002","8.635","0.001","90","","90.56","0.01","90","","1172.3","0.2","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C10 H10 Cl2 N2 Pd -","- C10 H10 Cl2 N2 Pd -","- C40 H40 Cl8 N8 Pd4 -","4","0.5","DU1002","Viossat, B.; Dung, Nguyen-Huy; Robert, F.","Structure du <i>trans</i>-dichlorobis(pyridine)palladium(II)","Acta Crystallographica Section C","1993","49","1","84","85","10.1107/S0108270192004438","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002060","12.4367","0.0008","12.719","0.0006","18.0229","0.0008","90","","90","","90","","2850.9","0.3","","","","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C25 H27 F6 O P2 Rh S3 -","- C31 H39 F14 O P2 Rh S3 -","- C124 H156 F56 O4 P8 Rh4 S12 -","4","0.5","HA0111","Blake, A. J.; Halcrow, M. A.; Schröder, M.","[Rh([9]aneS~3~)(CO)(PPh~3~)]^+^.PF~6~^{-^}","Acta Crystallographica Section C","1993","49","1","85","87","10.1107/S0108270192004943","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2002061","11.415","0.005","11.185","0.005","9.075","0.004","90","","96.93","0.03","90","","1150.2","0.9","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H25 N Ni S4 -","- C22 H25 N Ni S4 -","- C44 H50 N2 Ni2 S8 -","2","1","HA1008","Anderson, I. H.; Blake, A. J.; Heath, G. A.","(Diisopropyldithiocarbamato-<i>S</i>,<i>S</i>')(1,3-diphenyl-1,3-propanedithionato-<i>S</i>,<i>S</i>')nickel(II)","Acta Crystallographica Section C","1993","49","1","87","89","10.1107/S0108270192005560","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2002062","7.969","0.002","8.402","0.002","14.747","0.003","103.24","0.03","90.05","0.03","111.29","0.03","891.7","0.4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H16 Cl3 N8 Rh -","- C12 H16 Cl3 N8 Rh -","- C24 H32 Cl6 N16 Rh2 -","2","1","ST0582","Ma, R.; Li, Y.-J.; Muir, J. A.; Muir, M. M.","Structure of <i>trans</i>-dichlorotetrakis(pyrazole-<i>N</i>^2^) rhodium(III) chloride","Acta Crystallographica Section C","1993","49","1","89","91","10.1107/S0108270192004293","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2002063","16.632","0.004","16.906","0.003","19.332","0.003","90","","93.15","0.02","90","","5427.6","1.8","","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C55 H40 Cl2 Co2 Mn O8 P2 Sb -","- C55 H40 Cl2 Co2 Mn O8 P2 Sb -","- C220 H160 Cl8 Co8 Mn4 O32 P8 Sb4 -","4","1","LI1004","Farrugia, L. J.; Norman, N. C.; Webster, P. M.","Structure of [SbCl{Mn(CO)~2~(η^5^-C~5~H~5~)}{Co(CO)~3~(PPh~3~)}~2~].C~6~H~5~Cl","Acta Crystallographica Section C","1993","49","1","91","93","10.1107/S0108270192004578","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2002064","6.486","0.002","10.921","0.002","12.542","0.001","79.9","0.01","88.87","0.02","73.5","0.02","838.2","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H23 N O -","- C20 H23 N O -","- C40 H46 N2 O2 -","2","1","AB0270","Sekar, K.; Parthasarathy, S.; Radhakrishnan, T. R.","Structure of 4-piperidone derivatives. III. 1,3,3-Trimethyl-2,6-diphenyl-4-piperidone and 2,6-bis(<i>p</i>-chlorophenyl)-1,3,5-trimethyl-4-piperidone","Acta Crystallographica Section C","1993","49","1","93","95","10.1107/S0108270192004207","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2002065","7.42","0.002","23.118","0.001","10.624","0.002","90","","90","","90","","1822.4","0.6","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C20 H21 Cl2 N O -","- C20 H21 Cl2 N O -","- C80 H84 Cl8 N4 O4 -","4","0.5","AB0270","Sekar, K.; Parthasarathy, S.; Radhakrishnan, T. R.","Structure of 4-piperidone derivatives. III. 1,3,3-Trimethyl-2,6-diphenyl-4-piperidone and 2,6-bis(<i>p</i>-chlorophenyl)-1,3,5-trimethyl-4-piperidone","Acta Crystallographica Section C","1993","49","1","93","95","10.1107/S0108270192004207","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2002066","7.383","0.001","13.134","0.005","14.51","","90","","90","","90","","1407","0.6","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C13 H19 N O5 -","- C13 H19 N O5 -","- C52 H76 N4 O20 -","4","1","KA1001","Soriano-García, M.","Refinement of the structure of <i>N</i>-acetyl-<small>L</small>-tyrosine ethyl ester monohydrate","Acta Crystallographica Section C","1993","49","1","96","97","10.1107/S0108270192004724","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002067","8.929","0.002","8.99","0.002","8.094","0.002","103.79","0.02","116.71","0.02","67.86","0.02","535.7","0.2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H15 N O -","- C13 H15 N O -","- C26 H30 N2 O2 -","2","1","AB0271","Sekar, K.; Parthasarathy, S.; Prabahar, K. J.; Ramakrishnan, V. T.","Structure of 1,8-dimethyl-4-oxo-1,2,2a,3,4,5-hexahydrocyclopenta[<i>de</i>]quinoline","Acta Crystallographica Section C","1993","49","1","97","99","10.1107/S0108270192004219","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2002068","14.422","0.003","7.468","0.008","8.27","0.002","90","","97.47","0.01","90","","883.1","1","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H11 N O2 -","- C10 H11 N O2 -","- C40 H44 N4 O8 -","4","1","HA1004","Nicholson, W. V.; Sawyer, L.; Taylor, P.; Dawson, I.; Gould, R. O.","4-Methoxyindan-1-one oxime","Acta Crystallographica Section C","1993","49","1","101","103","10.1107/S0108270192005663","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002069","13.978","0.008","7.467","0.009","16.452","0.009","90","","114.11","0.04","90","","1567","2","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","","","","","- C15 H19 Cl2 N O -","- C15 H19 Cl2 N O -","- C60 H76 Cl8 N4 O4 -","4","1","AL0475","Barlow, M. G.; Pritchard, R. G.; Sibous, L.; Tipping, A. E.","(4<i>E</i>,8<i>Z</i>,12<i>E</i>)-13,16-Dichloro-14-azabicyclo[10.4.0]hexadeca-4,8,12-trien-15-one: a thermal cycloaddition product","Acta Crystallographica Section C","1993","49","1","103","104","10.1107/S0108270192005110","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002070","5.269","0.002","19.781","0.006","6.768","0.002","90","","106.46","0.02","90","","676.5","0.4","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C17 H12 O5 -","- C17 H12 O5 -","- C34 H24 O10 -","2","1","HL1008","Koh, L. L.; Ng, A. S.","Structures of two flavonoids from <i>Physalis minima</i>, 5-methoxy-6,7-methylenedioxyflavone (I) and 5,6,7-trimethoxyflavone (II)","Acta Crystallographica Section C","1993","49","1","105","107","10.1107/S0108270192005584","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2002071","13.074","0.004","14.196","0.005","8.365","0.002","90","","102.87","0.02","90","","1513.5","0.8","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C18 H16 O5 -","- C18 H16 O5 -","- C72 H64 O20 -","4","1","HL1008","Koh, L. L.; Ng, A. S.","Structures of two flavonoids from <i>Physalis minima</i>, 5-methoxy-6,7-methylenedioxyflavone (I) and 5,6,7-trimethoxyflavone (II)","Acta Crystallographica Section C","1993","49","1","105","107","10.1107/S0108270192005584","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002072","36.276","0.007","10.469","0.003","8.229","0.003","90","","90","","90","","3125.2","1.6","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C17 H18 N2 O S -","- C17 H18 N2 O S -","- C136 H144 N16 O8 S8 -","8","1","CD0069","Eswaramoorthy, S.; Raju, K. S.; Ponnuswamy, M. N.","Structure of 2-[<i>N</i>-(2-hydroxyethyl)]aminomethyl-3-phenylthioindole","Acta Crystallographica Section C","1993","49","1","107","109","10.1107/S0108270192003469","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002073","6.104","0.002","19.538","0.002","9.286","0.002","90","","93.28","0.02","90","","1105.6","0.4","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H6 Cl3 N O3 -","- C9 H6 Cl3 N O3 -","- C36 H24 Cl12 N4 O12 -","4","1","ST0576","Mullica, D. F.; Sappenfield, E. L.; Reeves, W. P.; Scheide, G. M.","Structure of 2-(4-nitrophenyl)-2-trichloromethyloxirane","Acta Crystallographica Section C","1993","49","1","109","111","10.1107/S010827019200502X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002074","9.533","0.002","23.568","0.005","13.666","0.003","90","","103.47","0.03","90","","2985.9","1.2","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C12 H21 N4 O2 S -","- C12 H21 N4 O1.5 S -","- C96 H168 N32 O12 S8 -","8","2","HH0623","Shin, W.; Shim, J. H.","Structure of tetrahydrothiamin hemihydrate","Acta Crystallographica Section C","1993","49","1","111","113","10.1107/S0108270192004001","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002075","6.0092","0.0005","5.3074","0.0002","15.7538","0.0006","90","","93.672","0.005","90","","501.41","0.05","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C14 H8 O4 -","- C14 H8 O4 -","- C28 H16 O8 -","2","0.5","CD0070","Marasinghe, P. A. B.; Gillispie, G. D.","Structure of 1,5-dihydroxyanthraquinone: a redetermination","Acta Crystallographica Section C","1993","49","1","113","114","10.1107/S0108270192004542","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002076","6.521","0.002","9.223","0.002","15.235","0.005","90","","91.91","0.03","90","","915.8","0.5","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 O2 -","- C26 H22 O2 -","- C52 H44 O4 -","2","0.5","GR0203","Harmata, M.; Barnes, C. L.","5α,8β,14α,17α-5,6,8,9,14,15,17,18-Octahydro-5,17:8,14-diepoxydibenzo[<i>e</i>,<i>e</i>']benzo[1,2-<i>a</i>:4,5-<i>a</i>']dicyclooctene","Acta Crystallographica Section C","1993","49","1","115","116","10.1107/S0108270192004694","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002077","9.16","0.001","9.921","0.002","10.372","0.004","100.57","0.02","112.01","0.02","92.17","0.01","853.1","0.4","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H30 F6 N6 O Si2 -","- C36 H30 F6 N6 O Si2 -","- C36 H30 F6 N6 O Si2 -","1","0.5","BX0582","Jansen, M.; Mokros, I.","Structure of hexakis(2-fluorophenylamino)disiloxane","Acta Crystallographica Section C","1993","49","1","119","120","10.1107/S0108270192004360","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002078","8.984","0.006","14.9","0.02","16.56","0.02","113","0.07","99.63","0.07","104.39","0.06","1888","4","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C8 H30 N8 O Si3 -","- C8 N8 O Si3 -","- C32 N32 O4 Si12 -","4","2","BX0583","Jansen, M.; Löffelholz, J.","Structure of 3,5-dimethyl-2,2,4,4,6,6-hexakis(methylamino)-1-oxa-3,5-diaza-2,4,6-trisilacyclohexane","Acta Crystallographica Section C","1993","49","1","120","122","10.1107/S0108270192004451","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002079","8.455","0.003","13.052","0.002","9.267","0.003","90","","124.89","0.03","90","","838.8","0.9","294","","","","","","","","","","","1","P 1 2/c 1","","","","gamma sulfur","","- S8 -","- S8 -","- S32 -","4","1","AB1021","Gallacher, A. C.; Pinkerton, A. A.","A redetermination of monclinic γ-sulfur","Acta Crystallographica Section C","1993","49","1","125","126","10.1107/S0108270192009661","","","0.71073","Mo_Kα","","","0.036","","","0.041","","","","","1.222","1.222","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2002080","3.721","0.001","3.721","","16.639","0.007","90","","90","","120","","199.5","0.1","115","","115","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","potassium zirconium indium sulfide","","- In0.5 K0.5 S2 Zr0.5 -","- K0.5 S2 Zr0.5 -","- K S4 Zr -","2","0.0833333","ST1015","Wu, P.; Ibers, J. A.","Synthesis and structures of the quaternary sulfides K~0.5~Zr~0.5~In~0.5~S~2~ and K~0.5~Cr~0.5~Sn~0.5~S~2~","Acta Crystallographica Section C","1993","49","1","126","129","10.1107/S0108270192008345","","","0.7093","MoKα","","","","","0.111","0.111","","","","2.3","2.3","2.3","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2002081","3.5786","0.0005","3.5786","0.0005","24.832","0.005","90","","90","","120","","275.4","0.1","115","","115","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- Cr0.5 K0.5 S2 Sn0.5 -","- Cr0.5 K0.5 S2 -","- Cr1.5 K1.5 S6 -","3","0.0833333","ST1015","Wu, P.; Ibers, J. A.","Synthesis and structures of the quaternary sulfides K~0.5~Zr~0.5~In~0.5~S~2~ and K~0.5~Cr~0.5~Sn~0.5~S~2~","Acta Crystallographica Section C","1993","49","1","126","129","10.1107/S0108270192008345","","","0.7093","MoKα","","","","","0.1","0.1","","","","1.91","1.91","1.91","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002082","9.993","0.001","6.8236","0.0006","16.398","0.002","90","","96","0.01","90","","1112","0.2","240","1","240","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H13 Br2 Cd N S -","- C5 H13 Br2 Cd N S -","- C20 H52 Br8 Cd4 N4 S4 -","4","1","AL1022","Clegg, W.; Casals, I.; González-Duarte, P.","<i>catena</i>-[Cd{μ-S(CH~2~)~3~NHMe~2~}Br~2~]","Acta Crystallographica Section C","1993","49","1","129","130","10.1107/S0108270192010746","","","0.71073","MoKα","","0.0548","0.042","","0.1412","0.1102","","","","1.132","1.168","1.168","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002083","12.336","0.002","14.108","0.002","19.875","0.008","90","","97.44","0.02","90","","3429.9","1.6","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H30 Au N3 P2 -","- C40 H30 Au N3 P2 -","- C160 H120 Au4 N12 P8 -","4","1","HA1016","Wang, J.-C.; Wang, Y.","Structure of [Au(PPh~3~)~2~][C(CN)~3~]","Acta Crystallographica Section C","1993","49","1","131","132","10.1107/S0108270192008461","","","0.71073","MoKα","","","0.033","","","0.037","","","","","0.495","0.495","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2002084","14.399","0.006","20.51","0.02","16.817","0.005","90","","100.75","0.03","90","","4879","5","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H18 N O19 S16 W6 -","- C15.5 N0.5 O9.5 S9 W3 -","- C62 N2 O38 S36 W12 -","4","2","PA1021","Triki, S.; Ouahab, L.; Grandjean, D.","Structure of the tetrakis(2,2',5,5'-tetrathiafulvalene) hexatungstate acetonitrile solvate salt (TTF)~4~W~6~O~19~.0.5(CH~3~CN)","Acta Crystallographica Section C","1993","49","1","132","135","10.1107/S0108270192008643","","","0.71073","MoKα","","","0.033","","","0.042","","","","","1.045","1.045","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2002085","11.072","0.003","13.873","0.005","14.31","0.004","92.38","0.03","98.58","0.02","95.95","0.03","2158.1","1.2","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H37.5 O1.25 P3 Ru S4 -","- C45 H35 O2 P3 Ru S4 -","- C90 H70 O4 P6 Ru2 S8 -","2","1","HA1009","Blake, A. J.; McQueen, A. E. D.; Schröder, M.; Stephenson, T. A.; Yellowlees, L. J.","Structure of carbonylbis(diphenyldithiophosphinato)(triphenylphosphine)ruthenium diethyl ether solvate [Ru(CO)(S~2~PPh~2~)~2~(PPh~3~)].0.25Et~2~O","Acta Crystallographica Section C","1993","49","1","135","137","10.1107/S0108270192008084","","","0.71073","MoKα","","","0.0378","","","0.0622","","","","","1.723","1.723","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002086","13.984","0.003","13.984","0.003","12.232","0.005","90","","90","","90","","2392","1.2","120","1","","","","","","","","","","5","P 4/n","-P 4a","","","","","- C16 H40 Cl4 Cu N2 -","- C16 Cl4 Cu N2 -","- C64 Cl16 Cu4 N8 -","4","","AS1014","Kawata, T.; Aoyama, T.; Ohba, S.","Tetraethylammonium tetrachlorocuprate(II), [N(C~2~H~5~)~4~]~2~[CuCl~4~]","Acta Crystallographica Section C","1993","49","1","137","139","10.1107/S0108270192009065","","","0.71073","MoKα","","","0.107","","","0.083","","","","","3.62","3.62","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002087","8.729","0.001","10.864","0.002","34.35","0.006","90","","90","","90","","3257.5","0.9","298","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C38 H37 Fe N P2 -","- C38 H37 Fe N P2 -","- C152 H148 Fe4 N4 P8 -","4","1","LI1012","Shawkataly, O. B.; Fun, H.-K.; Chinnakali, K.; Yip, B.-C.; Teoh, S.-G.; Ito, Y.; Sawamura, M.","Structure of 1-[(<i>R</i>)-1',2-bis(diphenylphosphino)ferrocenyl]-(<i>S</i>)-<i>N</i>,<i>N</i>-dimethylethylamine","Acta Crystallographica Section C","1993","49","1","139","141","10.1107/S010827019200790X","","","0.71069","MoKα","","","0.038","","","0.0501","","","","","0.89","0.89","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002088","14.754","0.003","14.805","0.005","15.277","0.004","90","","90","","90","","3337","1.6","197","","296","","","","","","","","","5","C 2 2 21","C 2c 2","20","","tetrakis(dimethylphenylphosphine)-rhodium(I) chloride","","- C32 H44 Cl P4 Rh -","- C32 H44 Cl P4 Rh -","- C128 H176 Cl4 P16 Rh4 -","4","0.5","ST1031","Reibenspies, J. H.; Darensbourg, D. J.","Structure of tetrakis(dimethylphenylphosphine)rhodium(I) chloride","Acta Crystallographica Section C","1993","49","1","141","142","10.1107/S0108270192009612","","","0.71073","MoKα","","0.0501","0.0501","","0.0512","0.0512","","","","1.0197","1.0197","1.0197","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002089","28.325","0.006","9.79","0.005","23.042","0.006","90","","105.999","0.006","90","","6142","4","293","","","","","","","","","","","8","I 1 2/c 1","-I 2yc","15","","","","- C55 H61 Cl2 F12 N O2 P6 Ru2 -","- C55 H61 Cl2 F12 N O2 P6 Ru2 -","- C220 H244 Cl8 F48 N4 O8 P24 Ru8 -","4","0.5","HA1003","Blake, A. J.; Fotheringham, J. D.; Stephenson, T. A.","[{(η^6^-C~6~H~6~)(PMe~2~Ph)RuCl}~2~(μ-Ph~2~PCH~2~CH~2~PPh~2~)]^2+^.2PF~6~^{-^}.CH~3~NO~2~","Acta Crystallographica Section C","1993","49","1","142","144","10.1107/S0108270192008163","","","0.71073","MoKα","","","0.0611","","","0.0753","","","","","1.406","1.406","","","","","has coordinates,has disorder","205828","2020-10-21","18:00:00",""
"2002090","18.246","0.002","18.246","0.002","11.303","0.002","90","","90","","120","","3258.8","0.8","300","2","","","","","","","","","","5","P 1 1 m","P -2","6","","","","- C38 H56 Cu2 N2 O8 -","- C10.6667 Cu0.666667 N0.666667 O2.66667 -","- C32 Cu2 N2 O8 -","3","1.5","AS1018","Fujita, T.; Ohba, S.; Tokii, T.; Kato, M.","Dimeric copper(II) 2,2-dimethylpropanoate adducts with 3- or 4-picoline","Acta Crystallographica Section C","1993","49","1","144","147","10.1107/S0108270192009107","","","0.71073","MoKα","","","0.077","","","0.105","","","","","3.5","3.5","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2002091","31.902","0.004","31.902","0.004","11.111","0.002","90","","90","","120","","9793","2","300","2","","","","","","","","","","5","R -3 m","-R 3 2""","","","","","- C38 H56 Cu2 N2 O8 -","- C32 Cu2 N2 O8 -","- C288 Cu18 N18 O72 -","9","","AS1018","Fujita, T.; Ohba, S.; Tokii, T.; Kato, M.","Dimeric copper(II) 2,2-dimethylpropanoate adducts with 3- or 4-picoline","Acta Crystallographica Section C","1993","49","1","144","147","10.1107/S0108270192009107","","","0.71073","MoKα","","","0.072","","","0.094","","","","","3.51","3.51","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002092","13.467","0.001","14.879","0.001","10.1125","0.0008","90","","90","","90","","2026.3","0.3","293","","293","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C8 H12 Cl6 Fe2 N4 -","- C8 H12 Cl6 Fe2 N4 -","- C32 H48 Cl24 Fe8 N16 -","4","1","DU1009","Gao, Y.; Guery, J.; Jacoboni, C.","FeCl~3~ behavior in acetonitrile: structures of [FeCl~2~(CH~3~CN)~4~][FeCl~4~] and [AlCl(CH~3~CN)~5~][FeCl~4~]~2~.CH~3~CN","Acta Crystallographica Section C","1993","49","1","147","151","10.1107/S0108270192009892","","","0.71073","MoKα","","","0.035","","","0.035","","","","","1.38","1.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002093","10.1025","0.0005","14.513","0.001","21.032","0.002","90","","90","","90","","3083.7","0.4","293","","293","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C12 H18 Al Cl9 Fe2 N6 -","- C12 H18 Al Cl9 Fe2 N6 -","- C48 H72 Al4 Cl36 Fe8 N24 -","4","1","DU1009","Gao, Y.; Guery, J.; Jacoboni, C.","FeCl~3~ behavior in acetonitrile: structures of [FeCl~2~(CH~3~CN)~4~][FeCl~4~] and [AlCl(CH~3~CN)~5~][FeCl~4~]~2~.CH~3~CN","Acta Crystallographica Section C","1993","49","1","147","151","10.1107/S0108270192009892","","","0.71073","MoKα","","","0.042","","","0.042","","","","","2.21","2.21","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002094","8.812","0.002","8.5","0.003","8.377","0.003","85.61","0.03","111.15","0.03","114.28","0.03","531.5","0.3","163","","","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H10 N2 O3 S -","- C11 H10 N2 O3 S -","- C22 H20 N4 O6 S2 -","2","1","ST1006","Rizvi, S. K.; Hossain, M. B.; van der Helm, D.","Structures of perfragilin A and B","Acta Crystallographica Section C","1993","49","1","151","154","10.1107/S0108270192008709","","","0.71073","MoKα","","","0.041","","","0.04","","","","","1.92","1.92","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002095","6.915","0.002","9.86","0.003","9.924","0.003","111.22","0.02","99.7","0.02","102.24","0.02","593.7","0.3","163","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H11 N O3 S2 -","- C12 H11 N O3 S2 -","- C24 H22 N2 O6 S4 -","2","1","ST1006","Rizvi, S. K.; Hossain, M. B.; van der Helm, D.","Structures of perfragilin A and B","Acta Crystallographica Section C","1993","49","1","151","154","10.1107/S0108270192008709","","","1.54178","CuKα","","","0.039","","","0.055","","","","","2.41","2.41","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002096","8.594","0.001","19.173","0.002","9.34","0.003","90","","102.52","0.02","90","","1502.4","0.5","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C15 H15 N3 O3 -","- C15 H15 N3 O3 -","- C60 H60 N12 O12 -","4","1","PA1009","Rodier, N.; Robert, J.-M.; Robert-Piessard, S.; Le Baut, G.","<i>N</i>-(4,6-Diméthylpyrid-2-yl)-2-(3-nitrophényl)acétamide","Acta Crystallographica Section C","1993","49","1","154","156","10.1107/S010827019200859X","","","1.5418","CuKα","","","0.045","","","0.05","","","","","1.55","1.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002097","10.276","0.001","7.091","0.001","11.38","0.0009","98.79","0.01","105.26","0.01","115.23","0.01","689.5","0.17","294","","","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H17 Cl N2 O -","- C15 H17 Cl N2 O -","- C30 H34 Cl2 N4 O2 -","2","1","PA1013","Rodier, N.; Agafonov, V.; Dubois, P.; Mariaud, M.; Levillain, P.; Cense, J. M.","2,4-Dimethyl-(1<i>H</i>)-naphtho[2,3-<i>b</i>][1,5]diazepinium chloride monohydrate","Acta Crystallographica Section C","1993","49","1","156","159","10.1107/S0108270192008618","","","1.5418","CuKα","","","0.041","","","0.052","","","","","1.75","1.75","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002098","5.6878","0.0008","11.65","0.002","26.21","0.003","90","","90","","90","","1736.7","0.4","294","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C14 H25 N O4 S2 -","- C14 H25 N O4 S2 -","- C56 H100 N4 O16 S8 -","4","1","PA1011","Rodier, N.; Khodadad, P.; Postel, D.; Villa, P.; Ronco, G.; Julien, R.","Désoxy-l <i>N</i>,<i>N</i>-diméthyldithiocarbamoyl-1 di-<i>O</i>-isopropylidène-2,3:4,5 xylitol","Acta Crystallographica Section C","1993","49","1","159","161","10.1107/S0108270192008606","","","1.5418","CuKα","","","0.035","","","0.036","","","","","1.295","1.295","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002099","16.22","0.004","9.763","0.0007","18.325","0.002","90","","99.81","0.01","90","","2859.4","0.8","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C15 H16 N4 O -","- C15 H16 N4 O -","- C120 H128 N32 O8 -","8","1","PA1016","Rodier, N.; Robert, J.-M.; Le Baut, G.","4-(4,6-Diméthylpyrid-2-yl)-5-éthyl-3-(furan-2-yl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","1993","49","1","161","163","10.1107/S0108270192008631","","","1.5418","CuKα","","","0.052","","","0.046","","","","","1.43","1.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002100","10.459","0.002","9.887","0.002","11.735","0.002","90","","115.13","0.01","90","","1098.6","0.4","294","","","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H38 N2 O2 -","- C11 H19 N O -","- C22 H38 N2 O2 -","2","1","PA1014","Rodier, N.; Dvolaitzky, M.; Rassat, A.; Agafonov, V.; Céolin, R.","2,5,<i>N</i>,<i>N</i>'-tétra-<i>tert</i>-butyl-<i>p</i>-phénylènediaminoxyl","Acta Crystallographica Section C","1993","49","1","163","165","10.1107/S010827019200862X","","","1.5418","CuKα","","","0.042","","","0.047","","","","","1.089","1.089","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2002101","22.669","0.006","15.663","0.006","12.995","0.004","90","","90","","90","","4614","3","294","","","","","","","","","","","3","P b c a","-P 2ac 2ab","","","","","- C22 H32 O8 -","- C22 H32 O8 -","- C176 H256 O64 -","8","1","ST1014","Erickson, M. S.; Schilling, P. J.; Fronczek, F. R.; Watkins, S. F.","Structure of a cyclotetradecadiene","Acta Crystallographica Section C","1993","49","1","165","167","10.1107/S0108270192008813","","","1.54184","CuKα","","","0.08","","","0.073","","","","","2.225","2.225","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002102","7.5289","0.0008","14.5526","0.0016","12.8578","0.0011","90","","90","","90","","1408.8","0.2","277","","","","","","","","","","","5","P b c 21","","","","","","- C8 H16 Cl2 Pd S4 -","- C8 H16 Cl2 Pd S4 -","- C32 H64 Cl8 Pd4 S16 -","4","1","HU1010","Blake, A. J.; Freeman, G.; Schröder, M.; Yellowlees, L. J.","[12]aneS~4~PdCl~2~","Acta Crystallographica Section C","1993","49","1","167","168","10.1107/S0108270192008758","","","0.71073","MoKα","","","0.0161","","","0.0229","","","","","1.17","1.17","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002103","12.458","0.002","11.468","0.001","7.105","0.001","94.61","0.01","100.04","0.01","112.24","0.01","913.2","0.2","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 As F6 S4 -","- C14 H16 As F6 S4 -","- C28 H32 As2 F12 S8 -","2","1","AB1022","Noreland, J.; Olovsson, G.; Olovsson, I.","Structure of the organic radical cation salt 2,3,6,7-tetrakis(methylthio)naphthalene hexafluoroarsenate","Acta Crystallographica Section C","1993","49","1","168","171","10.1107/S0108270192008941","","","0.71069","MoKα","","","0.069","","","0.076","","","","","1.84","1.84","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002104","10.193","0.003","11.966","0.001","14.802","0.003","90","","90","","90","","1805.4","0.7","158","","158","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 3-Hydroxy-22-oxokopsan-1-carboxylate","","- C22 H24 N2 O4 -","- C22 H24 N2 O4 -","- C88 H96 N8 O16 -","4","1","CD1025","Watt, W.; Ghosh, R.; Seal, T.; Mukherjee, B.","Structure of kopsine: methyl 3-hydroxy-22-oxokopsan-1-carboxylate","Acta Crystallographica Section C","1993","49","1","171","173","10.1107/S0108270192010035","","","1.5418","CuKα","","0.047","0.045","","0.123","0.122","","","","4.8","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002105","11.224","0.002","6.182","0.002","12.6485","0.0002","90","","103.16","0.02","90","","854.6","0.3","292","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H5 Cl2 N O -","- C8 H5 Cl2 N O -","- C32 H20 Cl8 N4 O4 -","4","1","LI1016","Zukerman-Schpector, J.; Pinto, A. Da C.; da Silva, J. F. M.; Barcellos, M. T. F. C.","Structure of 3,3-dichloro-1<i>H</i>-indol-2(3<i>H</i>)-one","Acta Crystallographica Section C","1993","49","1","173","175","10.1107/S0108270192008205","","","0.71073","MoKα","","","0.045","","","0.046","","","","","1.44","1.44","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2002106","7.345","0.002","8.865","0.003","10.644","0.002","72.07","0.03","88.69","0.03","78.94","0.04","646.7","0.3","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H16 Br N O3 -","- C12 H16 Br N O3 -","- C24 H32 Br2 N2 O6 -","2","1","AL1012","Seetharaman, J.; Rajan, S. S.; Srinivasan, R.","Structure of hydrocotarnine hydrobromide","Acta Crystallographica Section C","1993","49","1","175","177","10.1107/S0108270192008576","","","1.5418","CuKα","","","0.037","","","0.041","","","","","2.3","2.3","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2002107","14.356","0.004","4.663","0.002","15.366","0.005","90","","95.2","0.03","90","","1024.4","0.6","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 N2 O4 -","- C10 H12 N2 O4 -","- C40 H48 N8 O16 -","4","1","SE1006","Das, A. K.; Mazumdar, S. K.; Das, N.; Talapatra, S. K.; Scheiner, P.; Schwalbe, C. H. W.","Structure of a nucleoside analogue: α-(1-thyminylmethyl)-γ-butyrolactone","Acta Crystallographica Section C","1993","49","1","177","179","10.1107/S0108270192008655","","","0.71069","MoKα","","","0.055","","","0.059","","","","","2.249","2.249","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2002108","13.856","0.002","18.783","0.004","15.209","0.002","90","","90","","90","","3958.3","1.1","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","5-chloro-2-hydroxycarbonylmethoxy-1,3-xylyl-18-crown-5","","- C18 H25 Cl O8 -","- C18 H25 Cl O8 -","- C144 H200 Cl8 O64 -","8","1","BR1013","Ferguson, G.; Kaitner, B.; McKervey, M. A.; Owens, M.","5-Chloro-2-hydroxycarbonylmethoxy-1,3-xylyl-18-crown-5 and 5-chloro-2-ethoxycarbonylmethoxy-1,3-xylyl-18-crown-5","Acta Crystallographica Section C","1993","49","1","179","182","10.1107/S0108270192009971","","","0.7093","MolybdenumKα","","0.112","0.036","","0.059","0.048","","","","","1.24","1.24","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002109","17.884","0.003","8.792","0.003","13.918","0.003","90","","90","","90","","2188.4","1","293","","293","","","","","","","","","4","P c a 21","P 2c -2ac","29","","5-chloro-2-ethoxycarbonylmethoxy-1,3-xylyl-18-crown-5","","- C20 H29 Cl O8 -","- C20 H29 Cl O8 -","- C80 H116 Cl4 O32 -","4","1","BR1013","Ferguson, G.; Kaitner, B.; McKervey, M. A.; Owens, M.","5-Chloro-2-hydroxycarbonylmethoxy-1,3-xylyl-18-crown-5 and 5-chloro-2-ethoxycarbonylmethoxy-1,3-xylyl-18-crown-5","Acta Crystallographica Section C","1993","49","1","179","182","10.1107/S0108270192009971","","","0.7093","MolybdenumKα","","0.189","0.033","","0.084","0.04","","","","","1.07","1.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002110","7.237","0.007","14.952","0.009","17.07","0.02","90","","95.11","0.08","90","","1840","3","170","","170","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,1,2,2,3,3-Hexamethyl-4-(2-ethynylphenyl)-1,2,3- trigermacyclopent-4-ene","","- C16 H24 Ge3 -","- C16 H24 Ge3 -","- C64 H96 Ge12 -","4","1","AL1028","Preut, H.; Weisbeck, M. P.; Neumann, W. P.","Structure of 1,1,2,2,3,3-hexamethyl-4-(2-ethynylphenyl)-1,2,3-trigermacyclopent-4-ene","Acta Crystallographica Section C","1993","49","1","182","184","10.1107/S0108270192011053","","","0.71073","MoKα","","0.0845","0.068","","0.0916","0.083","","","","","0.87","0.87","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002111","20.373","0.009","8.707","0.004","12.637","0.006","90","","126.91","0.03","90","","1792.4","1.6","293","1","293","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Dimethyl trans-3,3'-(1,1-dimethylgermacyclopentane-3,4-diyl) bis[(E)-2-methylpropenoate]","","- C16 H26 Ge O4 -","- C16 H26 Ge O4 -","- C64 H104 Ge4 O16 -","4","0.5","AL1027","Preut, H.; Wienken, S.; Neumann, W. P.","Structure of dimethyl <i>trans</i>-3,3'-(1,1-dimethylgermacyclopentane-3,4-diyl)bis[(<i>E</i>)-2-methylpropenoate]","Acta Crystallographica Section C","1993","49","1","184","185","10.1107/S0108270192009776","","","0.71073","MoKα","","0.048","0.037","","0.0627","0.05","","","","","0.55","0.55","","","","","has coordinates","198857","2020-10-21","18:00:00",""
"2002112","6.41","0.002","15.438","0.002","9.808","0.002","90","","104.06","0.02","90","","941.5","0.4","295","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H27 N O3 Si -","- C19 H27 N O3 Si -","- C38 H54 N2 O6 Si2 -","2","1","ST1017","Marsh, R. E.; Schaefer, W. P.; Kephart, S. E.; Myers, A. G.","Structure of a <i>syn</i>-aldol addition product of benzaldehyde and a prolinol-derived <i>O</i>-silacyclopentyl ketene <i>N</i>,<i>O</i>-acetal","Acta Crystallographica Section C","1993","49","1","185","188","10.1107/S0108270192008825","","","0.71073","MoKα","","","","","","","","","","","1.75","1.75","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2002113","19.361","0.004","13.942","0.003","9.054","0.003","90","","90","","90","","2444","1.1","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-[4-(Dimethylamino)phenyl]imino]-3-oxo-N-phenylbutanamide N,N-dimethyl-4-nitroso-benzenamine","","- C26 H29 N5 O3 -","- C26 H44 N5 O3 -","- C104 H176 N20 O12 -","4","1","AB1020","Lewinski, K.; Nitek, W.; Milart, P.","Molecular complex of 2-[4-(dimethylamino)phenylimino]-3-oxo-<i>N</i>-phenylbutanamide and <i>N</i>,<i>N</i>-dimethyl-4-nitrosoaniline","Acta Crystallographica Section C","1993","49","1","188","190","10.1107/S0108270192010461","","","1.54051","CuKα","","","0.035","","","0.043","","","","","0.967","0.967","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002901","4.515","0.001","9.503","0.003","11.618","0.002","90","","90.33","0.01","90","","498.5","0.2","295","","295","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Lead diselenite","Lead diselenate(IV)","","- O5 Pb Se2 -","- O5 Pb Se2 -","- O20 Pb4 Se8 -","4","1","AB1172","Jussi Valkonen","Lead Diselenite","Acta Crystallographica Section C","1995","51","1","1","3","10.1107/S0108270194005093","","","0.71073","MoKα","","","0.034","","","0.043","","","","","0.53","0.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002969","21.937","0.008","15.327","0.003","6.924","0.001","90","","90","","90","","2328","2","296","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H15 N O2 -","- C14 H15 N O2 -","- C112 H120 N8 O16 -","8","1","","Jerry P. Jasinski; Richard C. Woudenberg","7-Dimethylaminocyclopenta[c]coumarin, In Two Polymorphic Forms","Acta Crystallographica Section C","1995","51","","107","109","","","","0.71069","MoKα","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002970","8.779","0.002","22.042","0.005","6.043","0.002","90","","90","","90","","1169.3","0.8","296","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C14 H15 N O2 -","- C14 H15 N O2 -","- C56 H60 N4 O8 -","4","1","","Jerry P. Jasinski; Richard C. Woudenberg","7-Dimethylaminocyclopenta[c]coumarin, In Two Polymorphic Forms","Acta Crystallographica Section C","1995","51","","107","109","","","","0.7107","MoKα","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003171","6.4","0.001","10.767","0.001","11.203","0.002","91.62","0.01","91.34","0.02","102.2","0.2","753.9","0.2","295","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H23 N2 O3 -","- C15 H23 N2 O3 -","- C30 H46 N4 O6 -","2","1","KA1059","Tomasz A. Olszak; Piotr H. Sobczynski; Andrzej M. Brzozowski; Mieczyslaw J. Grabowski; Krzysztof Gwozdzinski","Piperidine Nitroxide Radicals with Heterocyclic Ring Substituents. 4-Hydroxy-2,2,6,6-tetramethyl-4-(2-pyridylmethyl 1-oxide)piperidine 1-Oxide","Acta Crystallographica C","1995","51","1","121","123","10.1107/S0108270194007791","","","1.54178","CuKα","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2003175","8.6439","0.0004","19.5142","0.0007","10.5033","0.0004","90","","101.723","0.004","90","","1734.74","0.12","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H18 N2 O2 -","- C21 H18 N2 O2 -","- C84 H72 N8 O8 -","4","1","PA1117","Piotr K. Olszewski; Katarzyna Stadnicka","Two Centrosymmetric Conjugated Nitrones of the Diazabutadiene System","Acta Crystallographica C","1995","51","1","98","103","10.1107/S0108270194007742","","","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003180","13.665","0.001","14.68","0.002","19.539","0.002","94.965","0.006","104.131","0.007","90.482","0.008","3784.9","0.7","193","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C68 H11 Cl3 O4 -","- C68 H11 Cl3 O4 -","- C272 H44 Cl12 O16 -","4","2","SE1063","E. F. Paulus; C. Bingel","Diethyl Methano-C~60~-fullerene-61,61-dicarboxylate Chloroform Solvate at 193 K, C~60~C(CO~2~C~2~H~5~)~2~.CHCl~3~","Acta Crystallographica C","1995","51","1","143","146","10.1107/S0108270194009728","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2003182","3.4603","0.0005","6.1972","0.0009","9.548","0.002","90","","103.47","0.01","90","","199.12","0.06","300","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C2 Ag2 O4 -","- C2 Ag2 O4 -","- C4 Ag4 O8 -","2","0.5","VS1014","Dmitry Yu. Naumov; Alexander V. Virovets; Nina V. Podberezskaya; Elena V. Boldyreva","Silver Oxalate, 2Ag^+^.C~2~O~4~^2-^","Acta Crystallographica C","1995","51","1","60","62","10.1107/S0108270194008188","","","1.54178","CuKα","","","0.0259","","0.0541","0.0519","","","","1.129","1.188","1.188","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003198","7.058","0.007","18.962","0.007","17.05","0.02","90","","90.92","0.09","90","","2281","2","273.2","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H30 Cl3 N2 O Re S2 -","- C15 H30 Cl3 N2 O Re S2 -","- C60 H120 Cl12 N8 O4 Re4 S8 -","4","1","FG1012","Trevor W. Hambley; Robert K. Knott; Timothy W. Jackson; Masaharu Kojima; Richard M. Lambrecht","[3,10-Diethyl-5,8-diazadodecane-3,10-dithiolato-(3-)-N,N',S,S']oxorhenium(IV) Chloroform Solvate","Acta Crystallographica C","1995","51","2","203","205","10.1107/S0108270194007651","","","0.7109","MoKα","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003201","11.061","0.001","12.171","0.001","14.334","0.002","95.2","0.008","92.094","0.009","105.191","0.008","1851","0.4","298","","298","","","","","","","","","5","P -1","-P 1","2","","trans-bromo-ortho-tolyl-bis(triphenylphosphine)palladium(II)","","- C43 H37 Br P2 Pd -","- C43 H37 Br P2 Pd -","- C86 H74 Br2 P4 Pd2 -","2","1","HA1125","Cross, Ronald J.; Kennedy, Alan R.; Muir, Kenneth W.","trans-Bromo(o-tolyl)bis(triphenylphosphine)palladium(II) from Crystals With and Without Stacking Faults","Acta Crystallographica Section C","1995","51","2","208","210","10.1107/S0108270194009042","","","0.71073","MoKα","","","0.051","","","0.054","","","","","1.7","1.7","","","","","has coordinates","175111","2020-10-21","18:00:00",""
"2003202","11.0691","0.0004","12.1779","0.0011","14.338","0.0007","95.161","0.006","92.072","0.004","105.199","0.006","1854","0.2","299","","299","","","","","","","","","5","P -1","-P 1","2","","trans-bromo-ortho-tolyl-bis(triphenylphosphine)palladium(II)","","- C43 H37 Br P2 Pd -","- C43 H37 Br P2 Pd -","- C86 H74 Br2 P4 Pd2 -","2","1","HA1125","Cross, Ronald J.; Kennedy, Alan R.; Muir, Kenneth W.","trans-Bromo(o-tolyl)bis(triphenylphosphine)palladium(II) from Crystals With and Without Stacking Faults","Acta Crystallographica Section C","1995","51","2","208","210","10.1107/S0108270194009042","","","0.71073","MoKα","","","0.06","","","0.095","","","","","3.6","3.6","","","","","has coordinates","175111","2020-10-21","18:00:00",""
"2003205","8.161","0.001","8.222","0.001","23.113","0.002","93.46","0.02","96.88","0.02","113.43","0.02","1402.8","0.3","293","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H13 N O4 -","- C17 H13 N O4 -","- C68 H52 N4 O16 -","4","2","KA1091","B. Satish Goud; Kaliyamoorthy Panneerselvam; David E. Zacharias; Gautam R. Desiraju","4,6-Dimethyl-2-(4-nitrobenzylidene)-3(2H)-benzofuranone","Acta Crystallographica C","1995","51","2","265","267","10.1107/S0108270194007973","","","0.7107","MoKα","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2003206","13.579","0.003","11.107","0.002","8.299","0.001","90","","105.9","0.01","90","","1203.8","0.8","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H8 F4 N2 O -","- C13 H8 F4 N2 O -","- C52 H32 F16 N8 O4 -","4","1","LI1120","R. E. Banks; W. J. Jondi; R. G. Pritchard; A. E. Tipping","(E)-Acetophenone O-(3,4,5,6-Tetrafluoro-2-pyridyl)oxime, Formed by 2-Substitution of Pentafluoropyridine by (E)-Acetophenone Oximate","Acta Crystallographica C","1995","51","2","293","295","10.1107/S0108270194009133","","","0.71069","MoKα","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003211","8.175","0.001","10.15","0.002","11.254","0.001","83.28","0.01","81.07","0.01","74.3","0.01","885.3","0.2","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H42 Cl14 N6 Pb -","- C12 H42 Cl14 N6 Pb -","- C12 H42 Cl14 N6 Pb -","1","0.5","MU1117","Marcus Geselle; Hartmut Fuess","Hexakis(2-chloroethylammonium) Hexachloroplumbate(II) Chloride","Acta Crystallographica C","1995","51","2","242","244","10.1107/S0108270194009583","","","0.71069","MoKα","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003215","13.087","0.002","13.087","0.002","11.793","0.001","90","","90","","90","","2019.8","0.5","298","","298","","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C12 H32 Cl4 N2 Zn -","- C12 H31 Cl4 N2 Zn -","- C48 H124 Cl16 N8 Zn4 -","4","0.5","NA1105","Caëtano, Odile; Lapasset, Jacques; Saint-Grégoire, Pierre","Tetraethylammonium Tetramethylammonium Tetrachlorozincate(II), [(C~2~H~5~)~4~N][(CH~3~)~4~N]ZnCl~4~","Acta Crystallographica Section C","1995","51","2","220","222","10.1107/S0108270194008152","","","0.7107","MoKα","","","0.041","","","0.042","","","","","1.33","1.33","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2003217","14.9821","0.0009","5.9131","0.0007","23.502","0.002","90","","105.99","0.01","90","","2001.6","0.3","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H22 Cl2 N4 O4 -","- C18 H22 Cl2 N4 O4 -","- C72 H88 Cl8 N16 O16 -","4","1","SE1047","Matthias Ramm; Hendrik Baumann; Klaus Kirschke","(E,E)-4-[3-(3,5-Dichloro-2-hydroxyphenylazo)-2-morpholino -2-butenoyl]morpholine","Acta Crystallographica C","1995","51","2","277","279","10.1107/S0108270194009364","","","1.54178","CuKα","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003220","4.577","0.001","32.074","0.006","7.353","0.001","90","","90.74","0.03","90","","1079.4","0.3","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H20 N O4 P -","- C7 H18 N O7 P -","- C28 H72 N4 O28 P4 -","4","1","AB0326","Waskowska, A.; Kroupa, J.","Disorder in <i>n</i>-Alkyl Ammonium Dihydrogen Phosphate Crystals: C~<i>n~</i>H~2<i>n~ + 1</i>NH~3~^+^.H~2~PO~4~^{-^}","Acta Crystallographica Section C","1995","51","3","420","423","10.1107/S0108270194006402","","","0.71073","MoKα","","","0.056","","","0.06","","","","","1.45","1.45","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003221","4.589","0.002","34.701","0.007","7.365","0.003","90","","90.61","0.03","90","","1172.8","0.7","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H22 N O4 P -","- C8 H20 N O7 P -","- C32 H80 N4 O28 P4 -","4","1","AB0326","Waskowska, A.; Kroupa, J.","Disorder in <i>n</i>-Alkyl Ammonium Dihydrogen Phosphate Crystals: C~<i>n~</i>H~2<i>n~ + 1</i>NH~3~^+^.H~2~PO~4~^{-^}","Acta Crystallographica Section C","1995","51","3","420","423","10.1107/S0108270194006402","","","0.71073","MoKα","","","0.065","","","0.065","","","","","1.66","1.66","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003222","8.2341","0.0005","9.7275","0.0005","20.8316","0.0012","90","","92.74","0.01","90","","1666.65","0.16","295","","","","","","","","","","Moberg et al. (1991)","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N2 O6 -","- C16 H18 N2 O6 -","- C64 H72 N8 O24 -","4","1","AB1160","A. Ertan; I. Csöregh; H. Adolfsson; C. Moberg","Complexation with Ligands Containing a Dipyridylmethane Unit. Structures of a Free Ligand and Two Copper(II) Complexes","Acta Crystallographica Section C","1995","51","3","385","392","10.1107/S010827019400853X","","","1.54183","CuKα","","","0.043","","","0.056","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003223","11.0497","0.0006","13.1208","0.0005","13.5252","0.0005","90","","98.71","0.01","90","","1938.28","0.16","295","","","","","","","","","","Adolfsson et al. (1994)","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H19 Cu N3 O6 -","- C21 H19 Cu N3 O6 -","- C84 H76 Cu4 N12 O24 -","4","1","AB1160","Ertan, A.; Csöregh, I.; Adolfsson, H.; Moberg, C.","Complexation with Ligands Containing a Dipyridylmethane Unit. Structures of a Free Ligand and Two Copper(II) Complexes","Acta Crystallographica Section C","1995","51","3","385","392","10.1107/S010827019400853X","","","1.54183","CuKα","","","0.048","","","0.071","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003224","10.2034","0.0005","15.4648","0.0013","14.7073","0.0009","90","","102.4","0.01","90","","2266.6","0.3","295","","","","","","","","","","Adolfsson et al. (1994)","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 Cu N3 O6.5 -","- C52 H38 Cu2 N6 O14 -","- C104 H76 Cu4 N12 O28 -","2","0.5","AB1160","Ertan, A.; Csöregh, I.; Adolfsson, H.; Moberg, C.","Complexation with Ligands Containing a Dipyridylmethane Unit. Structures of a Free Ligand and Two Copper(II) Complexes","Acta Crystallographica Section C","1995","51","3","385","392","10.1107/S010827019400853X","","","1.54183","CuKα","","","0.042","","","0.059","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003225","22.965","0.003","13.196","0.003","15.823","0.003","90","","108.28","0.01","90","","4553.1","1.5","294","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C6 H21.44 N2 O0.72 S7 Sn3 -","- C6.14 N1.9 O0.605 S7 Sn3 -","- C49.12 N15.2 O4.84 S56 Sn24 -","8","1","AB1180","Tan, K.; Ko, Y.; Parise, J. B.","Trimethylammonium Tin Sulfide","Acta Crystallographica Section C","1995","51","3","398","401","10.1107/S0108270194010437","","","0.7107","MoKα","","","0.058","","","0.041","","","","","1.54","1.54","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003226","10.537","0.002","10.615","0.003","21.101","0.004","90","","92.24","0.02","90","","2358.3","0.9","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H54 Cd N16 Ni2 -","- C44 H54 Cd N16 Ni2 -","- C88 H108 Cd2 N32 Ni4 -","2","0.5","AB1195","Yuge, H.; Iwamoto, T.","Two-Dimensional Open-Frame Host Structure of the Inclusion Compound [Cd(tenH)~2~{Ni(CN)~4~}~2~].4C~6~H~5~NH~2~ (ten = 1,4-Diazabicyclo[2.2.2]octane)","Acta Crystallographica Section C","1995","51","3","374","377","10.1107/S0108270194009388","","","0.71069","MoKα","","","0.0417","","","0.0338","","","","","1.369","1.369","","","","","has coordinates","288340","2023-12-15","11:09:55",""
"2003227","21.023","0.001","14.907","0.001","8.2059","0.0007","90","","90","","90","","2571.6","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-methoxy-5-oxo-11-azabenzo[b]fluorene-11-oxide","","- C17 H11 N O3 -","- C17 H11 N O3 -","- C136 H88 N8 O24 -","8","1","AB1206","Kubicki, M.; Borowiak, T.; Antkowiak, W. Z.","4-Methoxy-11-oxo-5-azabenzo[<i>b</i>]fluorene <i>N</i>-Oxide and its Free Base","Acta Crystallographica Section C","1995","51","3","462","465","10.1107/S0108270194010528","","","1.54178","CuKα","","0.0387","0.038","","0.0859","0.0825","","","","1.087","1.087","1.087","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003228","7.47","0.001","20.033","0.002","8.97","0.002","90","","111.91","0.01","90","","1245.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-methoxy-5-oxo-11-azabenzo[b]fluorene","","- C17 H11 N O2 -","- C17 H11 N O2 -","- C68 H44 N4 O8 -","4","1","AB1206","Kubicki, M.; Borowiak, T.; Antkowiak, W. Z.","4-Methoxy-11-oxo-5-azabenzo[<i>b</i>]fluorene <i>N</i>-Oxide and its Free Base","Acta Crystallographica Section C","1995","51","3","462","465","10.1107/S0108270194010528","","","1.54178","CuKα","","0.1442","0.0771","","0.1765","0.1561","","","","1.875","2.423","2.423","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003229","16.374","0.002","20.082","0.002","19.137","0.005","90","","90.61","0.01","90","","6292.3","1.9","293","","293","","","","","","","","synthesised by the authors","5","P 1 21/n 1","-P 2yn","14","","2,2',2""-Triammoniumtriethylamine molybdate hexahydrate","","- C24 H96 Mo6 N16 O30 -","- C24 H96 Mo6 N16 O30 -","- C96 H384 Mo24 N64 O120 -","4","1","AB1214","Alyea, E. C.; Ferguson, G.; Xu, Z.","Hydrogen-Bonded Self-Assembly of Tris(2-ammonioethyl)amine Molybdate Hydrate, 4[N(CH~2~CH~2~NH~3~)~3~]^3+^.6[MoO~4~]^2{-^}.6H~2~O","Acta Crystallographica Section C","1995","51","3","353","356","10.1107/S0108270194009996","","","0.71069","MolybdenumKα","","0.042","0.03","","0.049","0.045","","","","","1.25","1.25","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003230","11.321","0.003","10.782","0.002","17.916","0.004","90","","90","","90","","2186.9","0.9","293","","293","","","","","","","","synthesised by the authors","3","P c a n","-P 2n 2c","60","o-phenylenedioxy-bis(dimethyl-4-oxahexanoic acid)","6,6'-o-phenylenedioxybis(2,2-dimethyl-4-oxahexanoic acid)","","- C20 H30 O8 -","- C20 H30 O8 -","- C80 H120 O32 -","4","0.5","AB1215","Ferguson, G.; Gallagher, J. F.; McAlees, A. J.","Ligands for Application in Coordination Chemistry: Three Dicarboxylic Acids","Acta Crystallographica Section C","1995","51","3","454","458","10.1107/S0108270194010000","","","0.71067","MolybdenumKα","","0.107","0.071","","0.088","0.082","","","","","2.04","2.04","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003231","12.457","0.003","9.828","0.002","12.588","0.002","90","","106.79","0.02","90","","1475.4","0.5","293","","293","","","","","","","","synthesised by authors","3","P 1 21/a 1","-P 2yab","14","tetramethyl-4,7-dioxadecanedioic acid","2,2,9,9-tetramethyl-4,7-dioxadecanedioic acid","","- C12 H22 O6 -","- C12 H22 O6 -","- C48 H88 O24 -","4","1","AB1215","Ferguson, G.; Gallagher, J. F.; McAlees, A. J.","Ligands for Application in Coordination Chemistry: Three Dicarboxylic Acids","Acta Crystallographica Section C","1995","51","3","454","458","10.1107/S0108270194010000","","","0.71067","MolybdenumKα","","0.097","0.038","","0.061","0.052","","","","","1.35","1.35","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003232","5.765","0.002","11.951","0.002","13.325","0.002","98.17","0.02","91.71","0.02","101.48","0.02","889","0.4","293","","293","","","","","","","","synthesised by the authors","3","P -1","-P 1","2","hexamethyl-4,8-dioxaundecanedioic acid","2,2,6,6,10,10-hexamethyl-4,8-dioxaundecanedioic acid","","- C15 H28 O6 -","- C15 H28 O6 -","- C30 H56 O12 -","2","1","AB1215","Ferguson, G.; Gallagher, J. F.; McAlees, A. J.","Ligands for Application in Coordination Chemistry: Three Dicarboxylic Acids","Acta Crystallographica Section C","1995","51","3","454","458","10.1107/S0108270194010000","","","0.71067","MolybdenumKα","","0.091","0.04","","0.065","0.057","","","","","1.55","1.55","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003233","14.565","0.003","15.359","0.003","7.883","0.002","90","","90.08","0.02","90","","1763.5","0.7","293","1","","","","","","","","","totally synthetic","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 O7 -","- C21 H23 O7 -","- C84 H92 O28 -","4","1","AS1118","Cotterill, A. S.; Gable, R. W.; Gill, M.","Methyl Austrocorticinate","Acta Crystallographica Section C","1995","51","3","500","502","10.1107/S010827019400956X","","","0.71069","MoKᾱ","","","0.063","","","0.043","","","","","1.876","1.876","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003234","15.387","0.002","7.705","0.002","16.013","0.002","90","","90","","90","","1898.5","0.6","296","","296","","","","","","","","synthesized and crystallized from EtOH/H~2~O solution","5","P n a 21","P 2c -2n","33","","6-ethyl-9-fluoro-6,7-dihydro-8-(4-hydroxy-1-piperidyl)-5-methyl-1-oxo-1H,5H- benzo[i,j]quinolizine-2-carboxylic acid","","- C21 H25 F N2 O4 -","- C21 H25 F N2 O4 -","- C84 H100 F4 N8 O16 -","4","1","AS1135","Hashimoto, K.; Fujita, N.; Tanaka, T.; Kido, M.","6-Ethyl-9-fluoro-6,7-dihydro-8-(4-hydroxy-piperidino)-5-methyl-1-oxo-1<i>H</i>,5<i>H</i>-benzo[<i>ij</i>]quinolizine-2-carboxylic Acid","Acta Crystallographica Section C","1995","51","3","519","521","10.1107/S0108270194008504","","","0.7107","MoKα","","","0.036","","","0.04","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003235","12.325","0.004","8.553","0.003","16.299","0.007","90","","103.39","0.03","90","","1671.5","1.1","293","","","","","","","","","","EPA, recrystallized from ethanol","6","P 1 21/c 1","-P 2ybc","","","","","- C12 H16 N3 O3 P S2 -","- C12 H22 N3 O3 P S2 -","- C48 H88 N12 O12 P4 S8 -","4","1","BK1007","Baughman, R. G.; Allen, J. L.","Organophosphorus Insecticides. 16. Azinphos Ethyl: <i>O</i>,<i>O</i>-Diethyl <i>S</i>-{[4-Oxo-1,2,3-benzotriazin-3(4<i>H</i>)-yl]methyl} Phosphorodithioate, C~12~H~16~N~3~O~3~PS~2~","Acta Crystallographica Section C","1995","51","3","521","523","10.1107/S0108270194007705","","","0.71073","MoKα","","","0.05","","","0.044","","","","","1.5","1.5","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003236","12.241","0.005","16.05","0.05","9.63","0.004","90","","110.73","0.03","90","","1769","6","173","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H24 N6 S3 -","- C11 H24 N6 S3 -","- C44 H96 N24 S12 -","4","1","BK1026","Garneau, I.; Raymond, S.; Brisse, F.","A Thiourea‒1,5-Cyclooctadiene Clathrate at 173 K","Acta Crystallographica Section C","1995","51","3","538","541","10.1107/S0108270194007717","","","1.54178","GraphitemonochromatedCuKᾱ","","","0.0432","","","0.0539","","","","","1.872","1.872","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003237","13.364","0.002","12.991","0.002","13.548","0.002","90","","108.35","0.012","90","","2232.5","0.6","293","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H32 B Cl F4 Mo P3 -","- C14 H32 B Cl F4 Mo P3 -","- C56 H128 B4 Cl4 F16 Mo4 P12 -","4","1","BK1037","Fettinger, J. C.; Kraatz, H.-B.; Poli, R.; Rheingold, A. L.","[CpMoCl(PMe~3~)~3~][BF~4~] and [Cp*MoCl(PMe~3~)~3~][PF~6~]","Acta Crystallographica Section C","1995","51","3","364","367","10.1107/S010827019400898X","","","0.7093","MoKα","","0.074","0.052","","0.066","0.056","","","","","1.051","1.051","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003238","12.369","0.006","14.664","0.005","15.769","0.005","90","","90.96","0.03","90","","2859.8","1.9","299","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H42 Cl F6 Mo P4 -","- C19 H42 Cl F6 Mo P4 -","- C76 H168 Cl4 F24 Mo4 P16 -","4","1","BK1037","Fettinger, J. C.; Kraatz, H.-B.; Poli, R.; Rheingold, A. L.","[CpMoCl(PMe~3~)~3~][BF~4~] and [Cp*MoCl(PMe~3~)~3~][PF~6~]","Acta Crystallographica Section C","1995","51","3","364","367","10.1107/S010827019400898X","","","0.7093","MoKα","","0.0851","0.0694","","0.1255","0.1193","","","","","1.89","1.89","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003239","14.3565","0.0007","14.8021","0.0008","25.612","0.002","90","","90","","90","","5442.7","0.6","295","","","","","","","","","","slow cooling of p-xylene solution","4","P b c a","-P 2ac 2ab","61","","","","- C22 H24 Cl8 O6 -","- C22 H24 Cl8 O6 -","- C176 H192 Cl64 O48 -","8","1","BK1038","Garcia, J. G.; Fronczek, F. R.","The <i>endo</i>-<i>endo</i>-<i>syn</i> Diels‒Alder Diadduct of Tetrachlorodimethoxycyclopentadiene with 1,6-Dioxacyclodeca-3,8-diene","Acta Crystallographica Section C","1995","51","3","468","471","10.1107/S0108270194008681","","","0.71073","MoKα","","","0.035","","","0.037","","","","","1.468","1.468","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003240","13.684","0.005","20.294","0.005","13.09","0.004","98.64","0.02","107.98","0.03","91.06","0.02","3410.2","1.9","200","","","","","","","","","","from acetic acid/CH~2~Cl~2~ solution","5","P -1","-P 1","2","","","","- C71 H84 Cl2 N4 O10 -","- C71 H84 Cl2 N4 O10 -","- C142 H168 Cl4 N8 O20 -","2","1","BK1046","Barkigia, K. M.; Fajer, J.; Berber, M. D.; Smith, K. M.","A Solvate of the Diacetate Salt of the Octaethyltetraphenylporphyrin Dication, H~4~OETPP^2+^.2CH~3~COO^{-^}.3CH~3~COOH.CH~2~Cl~2~","Acta Crystallographica Section C","1995","51","3","511","515","10.1107/S0108270194008978","","","1.5418","CuKα","","","0.095","","","0.119","","","","","3.17","3.17","","","","","has coordinates","190721","2020-10-21","18:00:00",""
"2003241","7.162","0.001","7.417","0.001","9.469","0.002","69.27","0.02","93.79","0.02","92.41","0.02","469.31","0.15","298","","298","","","","","","","","The title compound was obtained by reaction of 2,6-dimethoxypyridine with Vilsmeier's reagent following a literature procedure (Shiao, Shyu & Tarng, 1990). Suitable crystals for this study were obtained from dichloromethane--hexane (1:2), m.p. 415--416 K.","5","P -1","-P 1","2","","2-chloro-6-dimethylamino-3,5-diformylpyridine","","- C9 H9 Cl N2 O2 -","- C9 H9 Cl N2 O2 -","- C18 H18 Cl2 N4 O4 -","2","1","BK1066","Lai, L.-L.; Liu, L.-K.; Shiao, M.-J.; Wen, Y.-S.","2-Chloro-6-dimethylamino-3,5-pyridine-dicarbaldehyde","Acta Crystallographica Section C","1995","51","3","517","519","10.1107/S0108270194010310","","","0.7107","MoKα","","0.036","0.028","","0.038","0.037","","","","","1.95","1.95","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003242","10.677","0.007","16.763","0.008","10.015","0.005","90","","90","","90","","1792.5","1.7","295","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H27 O6 P -","- C16 H27 O6 P -","- C64 H108 O24 P4 -","4","1","BK1079","Capron, M. A.; An, J.; Swenson, D. C.; Wiemer, D. F.","Cyclic (1<i>R</i>,3<i>R</i>)-1,3-Dimethyltrimethylene [(5<i>R</i>)-2-Hydroxy-5-methyl-5-(2-methyl-1,3-dioxolan-2-yl)-1-cyclohexen-1-yl]phosphonate, a Stable Enol","Acta Crystallographica Section C","1995","51","3","479","482","10.1107/S0108270194010164","","","0.71073","MoKα","","","0.037","","","0.048","","","","","1.09","1.09","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2003243","6.149","0.003","9.221","0.008","3.121","0.001","90.29","0.05","92.23","0.04","104.3","0.05","171.33","0.18","296","","","","","","","","","","","3","P -1","-P 1","2","","","","- B2 Mg2 O5 -","- B2 Mg2 O5 -","- B4 Mg4 O10 -","2","1","BR1079","Guo, G.-C.; Cheng, W.-D.; Chen, J.-T.; Huang, J.-S.; Zhang, Q.-E.","Triclinic Mg~2~B~2~O~5~","Acta Crystallographica Section C","1995","51","3","351","353","10.1107/S0108270194009303","","","0.71069","MoKα","","","0.03","","","0.047","","","","","1.55","1.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003244","6.676","0.001","7.969","0.002","14.259","0.002","90","","93","0.01","90","","757.6","0.2","296","","","","","","","","","","grown from a melt of composition 1SrO:1K~2~O:4B~2","4","P 1 21/c 1","-P 2ybc","14","","","","- B5 K O9 Sr -","- B5 K O9 Sr -","- B20 K4 O36 Sr4 -","4","1","BR1081","Tu, J.-M.; Keszler, D. A.","SrKB~5~O~9~","Acta Crystallographica Section C","1995","51","3","341","343","10.1107/S0108270194007493","","","0.71069","MoKα","","","0.044","","","0.048","","","","","1.27","1.27","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003245","5.951","0.001","5.951","0.001","28.875","0.006","90","","90","","120","","885.6","0.3","295","2","","","","","","","cooled from 1723 to 1523 K at 15 K h^-1^","","Crystals of the title compound were prepared by melting a pre-reacted stoichiometric powder mixture in sealed Pt tube, which was then cooled from 1723 to 1523 K at 15 K h^-1^.","3","R -3 m :H","-R 3 2""","166","","","","- Co10 Ge3 O16 -","- Co10 Ge3 O16 -","- Co30 Ge9 O48 -","3","0.0833333","BR1086","Barbier, J.","Co~10~Ge~3~O~16~","Acta Crystallographica Section C","1995","51","3","343","345","10.1107/S0108270194010954","","","0.5608","AgKα","","","0.058","","","0.069","","","","","0.82","0.82","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003246","18.56","0.003","13.335","0.004","9.677","0.003","90","","90","","90","","2395","1.1","295","1","295","1","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C6 H2 Cl3 Cs6 Fe N6 O -","- C5 Cl2.5 Cs5 Fe0.5 N5 O -","- C20 Cl10 Cs20 Fe2 N20 O4 -","4","0.5","BR1089","Capparelli, M. V.; Murgich, J.","Cs~6~Cl~3~[Fe(CN)~6~].H~2~O: a Mixed-Anion Salt","Acta Crystallographica Section C","1995","51","3","356","358","10.1107/S010827019401022X","","","0.71069","MoKα","","","0.0243","","","0.0276","","","","","2.188","2.188","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003247","6.799","0.02","6.938","0.007","7.011","0.005","77.51","0.07","72.59","0.1","78.5","0.13","304.9","1","291","2","291","2","","","","","","","","5","P -1","-P 1","2","Nickel tin(II) fluoride hexahydrate","Nickel bistrifluorostannate(II) hexaydrate","","- F6 H12 Ni O6 Sn2 -","- F6 H12 Ni O6 Sn2 -","- F6 H12 Ni O6 Sn2 -","1","0.5","BR1092","Abrahams, I.; Donaldson, J. D.; Khan, Z. I.","Nickel Bistrifluorostannate(II) Hexahydrate, [Ni(H~2~O)~6~](SnF~3~)~2~","Acta Crystallographica Section C","1995","51","3","345","346","10.1107/S0108270194011340","","","0.71069","MoKα","","0.0247","0.0214","","0.0566","0.0559","","","","1.099","1.133","1.133","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003248","4.795","0.001","7.108","0.001","7.83","0.002","89.83","0.03","87.59","0.03","73.11","0.03","255.12","0.1","298","","298","","","","","","heated progressively to 1243 K; heating an appropriate mixture of material to 1275 K","","","4","P -1","-P 1","2","","Strontium Iron(III) Diphosphate","","- Fe2 O14 P4 Sr -","- Fe2 O14 P4 Sr -","- Fe2 O14 P4 Sr -","1","0.5","BR1094","Boutfessi, A.; Boukhari, A.; Holt, E. M.","Strontium Diiron(III) Pyrophosphate","Acta Crystallographica Section C","1995","51","3","346","348","10.1107/S0108270194010693","","","0.71073","MoKα","","","0.0378","","","0.0463","","","","","1.13","1.13","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003249","8.962","0.001","11.136","0.002","8.922","0.001","95.14","0.01","104.5","0.01","86.74","0.01","858","0.2","296","","296","","","","","","","","Sigma Chemical Co.,St. Louis, Mo.,USA","5","P -1","-P 1","2","","","","- C20 H18 N2 O2 S -","- C20 H18 N2 O2 S -","- C40 H36 N4 O4 S2 -","2","1","CD1034","Jasinski, J. P.; Paight, E. S.","3-(2-Benzothiazolyl)-7-(diethylamino)coumarin","Acta Crystallographica Section C","1995","51","3","531","533","10.1107/S0108270194003628","","","0.7107","MoKα","","","0.0359","","","0.0413","","","","","1.528","1.528","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003250","6.929","0.003","6.725","0.003","10.778","0.005","90","","99.27","0.04","90","","495.7","0.4","235","","","","","","","","","","recrystallization from ethyl acetate","3","P 1 21 1","P 2yb","4","","","","- C12 H12 O4 -","- C12 H12 O4 -","- C24 H24 O8 -","2","1","CD1064","Sondossi, M.; Lloyd, B. A.; Bariault, D.; Sylvestre, M.; Simard, M.","Microbial Transformation of a Dihydroxybiphenyl","Acta Crystallographica Section C","1995","51","3","491","494","10.1107/S0108270194008590","","","1.54056","CuKα","","","0.046","","","0.053","","","","","2.84","2.84","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003251","11.186","0.001","15.064","0.003","17.281","0.005","90","","103.9","0.02","90","","2826.7","1.1","296","","","","","","","","","","slow evaporation from CH~2~Cl~2~/iso-octane solution","3","P 1 21 1","P 2yb","4","","","","- C30 H50 O3 -","- C30 H50 O3 -","- C120 H200 O12 -","4","2","CR1102","Schultz, L. W.; Clardy, J.; Lessinger, L.","9,11-Secogorgost-5-en-9-one-3β,11-diol, a Marine Steroid from the Sea Whip <i>Pseudopterogorgia hummelinkii</i>","Acta Crystallographica Section C","1995","51","3","415","419","10.1107/S010827019400452X","","","1.54178","CuKα","","","0.0529","","","0.0674","","","","","1.1313","1.1313","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003252","14.822","0.003","7.055","0.001","10.205","0.002","90","","123.79","0.01","90","","886.9","0.3","293","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Eu2 H3 O9 P3 -","- Eu2 H4 O10 P4 -","- Eu8 H16 O40 P16 -","4","0.5","DU1051","Foulon, J.-D.; Durand, J.; Cot, L.; Tijani, N.; Rafiq, M.","Eu~2~(PO~3~H)~3~","Acta Crystallographica Section C","1995","51","3","348","350","10.1107/S0108270193007796","","","0.71073","MoKα","","","0.026","","","0.032","","","","","3.34","3.34","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003253","11.484","0.003","15.913","0.004","9.407","0.003","90","","101.46","0.01","90","","1684.8","0.8","293","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(2-Diphenylphosphinophenyl)-1-propanone","","- C21 H19 O P -","- C21 H19 O P -","- C84 H76 O4 P4 -","4","1","FG1009","Rasley, B. T.; Rapta, M.; Kulawiec, R. J.","2'-(Diphenylphosphino)propiophenone, a Functionalized Tertiary Phosphine","Acta Crystallographica Section C","1995","51","3","523","525","10.1107/S0108270194006578","","","0.71073","MoKα","","0.0577","0.04","","0.1045","0.0944","","","","1.046","1.07","1.07","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003254","8.713","0.004","11.553","0.001","15.612","0.006","90","0.02","107.94","0.05","90","0.03","1495.1","1","293","2","293","2","","","","","","","synthesis (Cambie et al., 1987)","3","P 1 21/c 1","-P 2ybc","14","","13-hydroxy-6-methoxy-4-methyl-7,12-dihydro-1,4epoxy-1H-anthra[2,3-d]-1,2- dioxepin-7,12-dione","","- C19 H14 O7 -","- C19 H14 O7 -","- C76 H56 O28 -","4","1","FG1034","Buckleton, J. S.; Clark, G. R.; Rickard, C. E. F.","A Stable Ozonide","Acta Crystallographica Section C","1995","51","3","494","495","10.1107/S0108270194010577","","","1.5418","CuKα","","0.0843","0.0606","","0.1745","0.1666","","","","1.018","1.157","1.157","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003255","11.408","0.002","11.495","0.002","17.672","0.004","90","","90","","90","","2317.4","0.8","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-(Trimethylsilyl)methyl Tetracylo[5.4.0.0^6,10^.0^9,11^] Undecan-4-yl 3,5-Dinitrobenzoate","","- C22 H28 N2 O6 Si -","- C22 H28 N2 O6 Si -","- C88 H112 N8 O24 Si4 -","4","1","FG1035","Lautens, M.; Lough, A. J.; Tam, W.","4-[(Trimethylsilyl)methyl]tetracyclo[5.4.0.0^6,10^.0^9,11^]undec-3-yl 3,5-Dinitrobenzoate","Acta Crystallographica Section C","1995","51","3","471","473","10.1107/S0108270194010966","","","0.71073","MoKα","","0.0988","0.0483","","0.1279","0.1092","","","","1.024","1.113","1.113","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003256","10.555","0.003","12.68","0.003","13.675","0.004","62.42","0.02","87.01","0.02","85.63","0.02","1617.2","0.8","193","2","193","2","","","","","","","","2","P -1","-P 1","2","","1-diphenylmethylene-4-triphenylmethyl-cyclohexa-2,5-diene","","- C44 H36 -","- C44 H36 -","- C88 H72 -","2","1","HA1119","Bochkarev, L. N.; Molosnova, N. E.; Zakharov, L. N.; Fukin, G. K.; Yanovsky, A. I.; Struchkov, Y. T.","1-Diphenylmethylene-4-(triphenylmethyl)cyclohexa-2,5-diene Benzene Solvate","Acta Crystallographica Section C","1995","51","3","489","491","10.1107/S0108270194009005","","","0.71073","MoKα","","0.1106","0.0525","","0.179","0.1291","","","","1.038","0.988","0.988","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003257","7.544","0.003","8.576","0.003","12.014","0.007","78.01","0.03","83.36","0.03","71.41","0.03","719.6","0.6","295","2","295","2","","","","","","","The title compound was obtained by the reaction of PhNHN=C(Me)CHO with 2,2-dimethyl-1,3-dioxane-4,6-dione. Crystals were grown from ethanol (McNab & Stobie, 1982).","4","P -1","-P 1","2","5-(1,2-Diaza-3-methyl-1-phenylbutadien-4-ylidene)-Meldrum's acid","5-(1,2-Diaza-3-methyl-1-phenylbutadien-4-ylidene)-2,2-dimethyl-1,3-dioxane -4,6-dione","","- C15 H16 N2 O4 -","- C15 H16 N2 O4 -","- C30 H32 N4 O8 -","2","1","HA1123","Blake, A. J.; McNab, H.","2,2-Dimethyl-5-(2-methyl-4-phenyl-3,4-diaza-2-butenylidene)-1,3-dioxane-4,6-dione","Acta Crystallographica Section C","1995","51","3","527","529","10.1107/S0108270194008371","","","0.71073","MoKα","","0.0541","0.0397","","0.1394","0.1285","","","","1.056","1.124","1.124","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003258","11.25","0.007","8.564","0.005","4.157","0.002","90","","90","","90","","400.5","0.4","293","2","293","2","","","","","","","By crystallisation from an aqueous solution containing Pb(NCS)~2~ and sodium acetate","6","P b n m","-P 2c 2ab","62","","Lead hydroxy thiocyanate","","- C H N O Pb S -","- C N2 O Pb S -","- C4 N8 O4 Pb4 S4 -","4","0.5","HA1124","Adovasio, V.; Nardelli, M.","Metal‒Hydroxy Ribbons in Pb(OH)(NCS)","Acta Crystallographica Section C","1995","51","3","380","382","10.1107/S0108270194009145","","","0.71069","MoKα","","","0.0264","","","0.0579","","","","","1.171","1.171","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003259","5.8813","0.0014","15.474","0.003","14.919","0.006","90","","95.64","0.03","90","","1351.2","0.7","150","0.2","150","0.2","","","","","","","The title compound was made by a Wittig reaction of 2-(t-butylthio)benzalde- hyde with methyl triphenylphosphoranylidenacetate in dichloromethane (MacPherson, 1994; Cadogan, MacPherson & McNab, 1994). Crystals were grown from hexane solution.","4","P 1 21/n 1","-P 2yn","14","Methyl 2-(t-Butylthio)cinnamate","Methyl 3-[2-(t-Butylthio)phenyl]propenoate","","- C14 H18 O2 S -","- C14 H18 O2 S -","- C56 H72 O8 S4 -","4","1","HA1130","Blake, A. J.; Cadogan, J. I. G.; Dijksma, F. J. J.; Gould, R. O.; MacPherson, A. D.; McNab, H.","Methyl 3-[2-(<i>tert</i>-Butylthio)phenyl]propenoate","Acta Crystallographica Section C","1995","51","3","509","511","10.1107/S0108270194009777","","","0.71073","MoKα","","0.0393","0.0295","","0.0803","0.0727","","","","1.063","1.071","1.071","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003260","11.79","0.006","11.79","0.006","18.373","0.004","90","","90","","120","","2211.8","1.7","296","","","","","","","","","","from CH~2~Cl~2~/Et~2~O","4","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C14 H16 I P -","- C14 H16 I P -","- C84 H96 I6 P6 -","6","0.5","HR1009","Staples, R. J.; Carlson, T.; Wang, S.; Fackler, Jnr, J. P.","Dimethyldiphenylphosphonium Iodide, [PPh~2~(CH~3~)~2~]^+^.I^{-^}, and Dimethyldiphenylphosphonium Bromide, [PPh~2~(CH~3~)~2~]^+^.Br^{-^}","Acta Crystallographica Section C","1995","51","3","498","500","10.1107/S0108270194009157","","","0.71073","MoKα","","","0.021","","","0.0242","","","","","1.13","1.13","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003261","11.603","0.002","11.603","0.002","17.968","0.005","90","","90","","120","","2094.9","0.8","296","","","","","","","","","","from CH~2~Cl~2~/Et~2~O","4","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C14 H16 Br P -","- C14 H16 Br P -","- C84 H96 Br6 P6 -","6","0.5","HR1009","Staples, R. J.; Carlson, T.; Wang, S.; Fackler, Jnr, J. P.","Dimethyldiphenylphosphonium Iodide, [PPh~2~(CH~3~)~2~]^+^.I^{-^}, and Dimethyldiphenylphosphonium Bromide, [PPh~2~(CH~3~)~2~]^+^.Br^{-^}","Acta Crystallographica Section C","1995","51","3","498","500","10.1107/S0108270194009157","","","0.71073","MoKα","","","0.039","","","0.0464","","","","","1.02","1.02","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003262","8.497","0.003","9.902","0.003","21.03","0.005","90","","92.14","0.01","90","","1768.2","0.9","293","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H20 Cu N3 O7 -","- C16 H19 Cu N3 O7.5 -","- C64 H76 Cu4 N12 O30 -","4","2","HU1069","Baggio, R. F.; Calvo, R.; Brondino, C.; Garland, M. T.; Atria, A. M.; Spodine, E.","A Novel Structure of (<small>L</small>-Aspartato)(1,10-phenanthroline)copper(II) Hydrate","Acta Crystallographica Section C","1995","51","3","382","385","10.1107/S0108270194009297","","","0.71073","MoKα","","","0.0322","","","0.0424","","","","","1.12","1.12","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003263","9.793","0.001","9.793","0.001","9.978","0.002","90","","90","","120","","828.7","0.2","293","10","293","10","","","","","","","","5","P 32","P 32","145","","N-(2R)-bromopropionyl-(2S)-proline methyl ester","","- C9 H14 Br N O3 -","- C9 H14 Br N O3 -","- C27 H42 Br3 N3 O9 -","3","1","HU1118","Ingham, S. L.; Lenman, M. M.","<i>N</i>-[2(<i>R</i>)-Bromopropanoyl]-(2<i>S</i>)-proline Methyl Ester","Acta Crystallographica Section C","1995","51","3","537","538","10.1107/S0108270194007961","","","0.71073","MoKα","","0.0397","0.0343","","0.0944","0.0909","","","","1.124","1.14","1.14","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003264","12.514","0.005","7.433","0.004","13.956","0.006","90","","114.86","0.03","90","","1177.9","1","150","2","","","","","","","","","","5","C 1 c 1","C -2yc","9","","Tetraethylammonium perchlorate","","- C8 H20 Cl N O4 -","- C8 H20 Cl N O4 -","- C32 H80 Cl4 N4 O16 -","4","1","HU1122","Kivikoski, J.; Howard, J. A. K.; Kelly, P.; Parker, D.","Tetraethylammonium Perchlorate at 150 K","Acta Crystallographica Section C","1995","51","3","535","536","10.1107/S0108270194008619","","","0.71073","MoKα","","","0.0489","","","0.0517","","","","","","","","","","","has coordinates","190394","2020-10-21","18:00:00",""
"2003265","8.421","0.002","11.421","0.002","17.431","0.004","90","","93.84","0.01","90","","1672.7","0.6","294","","","","","","","","","","","7","P 1 21/c 1","","","","","","- C13 H18 As F6 O P Ru -","- C13 H18 As F10 O P Ru -","- C52 H72 As4 F40 O4 P4 Ru4 -","4","1","KA1055","Kirchner, K.; Schmid, R.; Mereiter, K.","[Ru(η^5^-C~5~H~5~)(η^4^-C~5~H~4~O){As(CH~3~)~3~}]PF~6~ and [Ru(η^5^-C~5~H~5~)(η^4^-C~5~H~4~O){As(C~6~H~5~)~3~}]PF~6~","Acta Crystallographica Section C","1995","51","3","361","364","10.1107/S0108270194005688","","","0.71069","MoKα","","","0.026","","","0.03","","","","","1.31","1.31","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003266","8.076","0.001","24.399","0.004","13.337","0.002","90","","96.52","0.01","90","","2611","0.7","295","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 As F6 O P Ru -","- C28 H24 As F6 O P Ru -","- C112 H96 As4 F24 O4 P4 Ru4 -","4","1","KA1055","Kirchner, K.; Schmid, R.; Mereiter, K.","[Ru(η^5^-C~5~H~5~)(η^4^-C~5~H~4~O){As(CH~3~)~3~}]PF~6~ and [Ru(η^5^-C~5~H~5~)(η^4^-C~5~H~4~O){As(C~6~H~5~)~3~}]PF~6~","Acta Crystallographica Section C","1995","51","3","361","364","10.1107/S0108270194005688","","","0.71069","MoKα","","","0.028","","","0.027","","","","","1.14","1.14","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2003267","8.411","0.002","7.094","0.001","19.349","0.004","90","","90","","90","","1154.5","0.4","293","","","","","","","","","","recrystallized from water","4","P b c a","-P 2ac 2ab","61","","","","- C2 H7 N5 S -","- C2 H7 N5 S -","- C16 H56 N40 S8 -","8","1","KA1069","Heinemann, F. W.; Hartung, H.; Dehne, H.; Scheunemann, A.","Thiooxalic Acid 2-Amide-1-hydrazide-2-hydrazone","Acta Crystallographica Section C","1995","51","3","442","445","10.1107/S0108270194005494","","","0.71073","MoKα","","","0.0333","","","0.0804","","","","","1.004","1.004","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003268","24.667","0.004","10.573","0.003","15.736","0.004","90","","90","","90","","4104","1.7","293","2","293","2","","","","","","","synthesis","6","C c c 2","C 2 -2c","37","","bis(thiourea)bis(benzoato)zinc(II)","","- C16 H18 N4 O4 S2 Zn -","- C16 H18 N4 O4 S2 Zn -","- C128 H144 N32 O32 S16 Zn8 -","8","1","KA1071","Černák, J.; Adzimová, I.; Gérard, F.; Hardy, A.-M.","Bis(benzoato-<i>O</i>)bis(thiourea-<i>S</i>)zinc(II)","Acta Crystallographica Section C","1995","51","3","392","395","10.1107/S0108270194004075","","","0.7093","MoKα","","0.0517","0.0286","","0.0728","0.0664","","","","0.955","1.075","1.075","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003269","14.257","0.002","7.2001","0.0008","12.871","0.001","90","","108.88","0.01","90","","1250.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","1-hydroxy-5,6-dihydro-12-azabenzo[a]anthracene-N-oxide","","- C17 H13 N O2 -","- C17 H13 N O2 -","- C68 H52 N4 O8 -","4","1","KA1078","Kubicki, M.; Borowiak, T.; Antkowiak, W. Z.","Hindered Cavity-Shaped <i>N</i>-Oxides","Acta Crystallographica Section C","1995","51","3","458","461","10.1107/S0108270194003665","","","1.54178","CuKα","","0.0605","0.0421","","0.1244","0.1112","","","","1.109","1.159","1.159","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003270","16.092","0.002","7.906","0.001","11.889","0.001","90","","115.2","0.01","90","","1368.6","0.3","293","2","293","2","","","","","","","","4","P 1 n 1","P -2yac","7","","1-methoxy-5,6-dihydro-12-azabenzo[a]anthracene-N-oxide","","- C18 H15 N O2 -","- C18 H15 N O2 -","- C72 H60 N4 O8 -","4","2","KA1078","Kubicki, M.; Borowiak, T.; Antkowiak, W. Z.","Hindered Cavity-Shaped <i>N</i>-Oxides","Acta Crystallographica Section C","1995","51","3","458","461","10.1107/S0108270194003665","","","1.54178","CuKα","","0.0576","0.0553","","0.145","0.1412","","","","1.072","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003271","17.158","0.002","17.158","0.002","17.158","0.002","116.66","0.02","116.66","0.02","116.66","0.02","2344","4","293","2","293","2","","","","","","","","4","R 3 c :R","P 3* -2n","161","","","","- C15 H25 N3 O -","- C15 H25 N3 O -","- C90 H150 N18 O6 -","6","1","KA1083","Anulewicz, R.; Fiertek, D.; Izdebski, J.","1-Cyclohexyl-2-cyclohexylamino-5(4<i>H</i>)-imidazolone","Acta Crystallographica Section C","1995","51","3","541","543","10.1107/S0108270194006529","","","1.54056","CuKα","","0.0943","0.0493","","0.1482","0.1148","","","","1.08","1.081","1.081","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003272","13.274","0.004","7.746","0.002","15.08","0.005","90","","108.33","0.03","90","","1471.9","0.8","293","","","","","","","","","","Synthesis","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 O5 -","- C17 H22 O5 -","- C68 H88 O20 -","4","1","KA1087","Guidetti-Grept, R.; Herzog, B.; Debrunner, B.; Siljegovic, V.; Keese, R.; Frey, H.-M.; Hauser, A.; König, O.; Lüthi, S.; Birrer, J.; Nyffeler, D.; Förtsch, M.; Bürgi, H.-B.","A [5.5.5.5]Fenestrane Derivative","Acta Crystallographica Section C","1995","51","3","495","497","10.1107/S0108270194009455","","","0.71069","MoKα","","","0.04","","","0.055","","","","","1.534","1.534","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003273","27.85","0.007","5.217","0.003","13.463","0.004","90","","80.57","0.02","90","","1929.7","1.3","295","","","","","","","","","","synthetic","4","C 1 2 1","C 2y","5","","","","- C18 H25 N O5 -","- C18 H25 N O5 -","- C72 H100 N4 O20 -","4","1","KA1090","Weber, H. P.; Scholz, D.; Schmidt, H.; Gstach, H.","(2<i>S</i>,3<i>R</i>,4<i>S</i>)-4-(1,1-Dimethylethoxycarbonylamino)-2,3-epoxy-5-phenylpentanoic Acid Ethyl Ester","Acta Crystallographica Section C","1995","51","3","477","479","10.1107/S0108270194010656","","","1.54184","CuKα","","","0.098","","","0.109","","","","","0.538","0.538","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003274","15.412","0.008","8.169","0.002","19.487","0.004","90","","110.91","0.03","90","","2291.8","1.5","293","","","","","","","","","","Crystallized from methanol","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 F N5 O -","- C10 H12 F N5 O -","- C80 H96 F8 N40 O8 -","8","2","LI1096","Janes, R. W.; Palmer, R. A.","A Lamotrigine Analogue: 3,5-Diamino-6-(2-fluorophenyl)-1,2,4-triazine Methanol Solvate","Acta Crystallographica Section C","1995","51","3","440","442","10.1107/S0108270194005378","","","1.54178","CuKα","","","0.0579","","","0.0733","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003275","25.171","0.003","5.245","0.001","15.557","0.002","90","","121.92","0.02","90","","1743.3","0.6","296","","296","","","","","","","","synthesis","5","C 1 2/c 1","-C 2yc","15","","2-Fluoro-8,8-Dimethyl-9-Oxa-4,7-Diazabicyclo[4.3.0]Nona-1,6-Dien-3,5-Dione","","- C8 H7 F N2 O3 -","- C8 H7 F N2 O3 -","- C64 H56 F8 N16 O24 -","8","1","LI1122","Banks, R. E.; Jondi, W. J.; Pritchard, R. G.; Tipping, A. E.","5-Fluoro-8,8-dimethyl-7-oxa-3,9-diazabicyclo[4.3.0]nona-5,9-diene-2,4-dione (C~8~H~7~FN~2~O~3~): a Novel Product from Pyrolysis of <i>N</i>-Isopropylidene-<i>O</i>-tetrafluoro-4-pyridylhydroxylamine in Glass","Acta Crystallographica Section C","1995","51","3","515","517","10.1107/S0108270194008772","","","0.71069","MoKα","","","0.0414","","","0.027","","","","","1.947","1.947","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003276","9.456","0.002","22.745","0.004","16.707","0.003","90","","93.16","0.02","90","","3587.8","1.2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C32 H34 Cl3 N Ni O5 P2 S2 -","- C31 H34 N Ni O P2 S2 -","- C124 H136 N4 Ni4 O4 P8 S8 -","4","1","LI1125","Akilan, R.; Sivakumar, K.; Venkatachalam, V.; Ramalingam, K.; Chinnakali, K.; Fun, H.-K.","[1,2-Bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>'](4-morpholinecarbodithioato-<i>S</i>,<i>S</i>')nickel(II) Perchlorate Dichloromethane Solvate","Acta Crystallographica Section C","1995","51","3","368","370","10.1107/S010827019401070X","","","0.71073","MoKα","","0.1259","0.051","","0.1306","0.1073","","","","0.869","1.059","1.059","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003277","7.95","0.001","8.88","0.001","17.525","0.003","90","","90","","90","","1237.2","0.3","295","","","","","","","","","","Dissolving glutaric acid/lithium carbonate (1mol:0.5mol) in water yields crystals on standing","4","P b c a","-P 2ac 2ab","","","","","- C5 H7 Li O4 -","- C5 H7 Li O4 -","- C40 H56 Li8 O32 -","8","1","MU1051","Macdonald, A. L.; Murray, A.; Freer, A. A.; Henderson, K.","Lithium and Caesium Hydrogen Glutarate","Acta Crystallographica Section C","1995","51","3","404","406","10.1107/S0108270194005524","","","1.5418","CuKα","","","0.037","","","0.051","","","","","2.74","2.74","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003278","13.222","0.002","18.633","0.003","10.092","0.002","90","","103.02","0.01","90","","2422.4","0.7","293","","","","","","","","","","Glutaric acid/caesium carbonate (1mol:0.5mol) dissolved in water yields crystals on standing","4","C 1 2/m 1","-C 2y","12","","","","- C5 H7 Cs O4 -","- C5 H7 Cs O4 -","- C60 H84 Cs12 O48 -","12","1.5","MU1051","Macdonald, A. L.; Murray, A.; Freer, A. A.; Henderson, K.","Lithium and Caesium Hydrogen Glutarate","Acta Crystallographica Section C","1995","51","3","404","406","10.1107/S0108270194005524","","","0.71069","MoKα","","","0.029","","","0.043","","","","","2.4","2.4","","","","","has coordinates","198392","2020-10-21","18:00:00",""
"2003279","12.679","0.006","14.794","0.01","12.653","0.007","114.16","0.05","117.54","0.04","75.97","0.06","1916","2","293","","","","","","","","","","Crystallized from methanol","6","P -1","-P 1","2","","","","- C16 H16 Co N3 O5 S3 -","- C15.5 H16 Co N3 O4.5 S3 -","- C62 H64 Co4 N12 O18 S12 -","4","2","MU1088","Xu, Y.-J.; Kang, B.-S.; Chen, X.-T.; Huang, L.-R.","<i>fac</i>-[Co(C~5~H~4~NOS)~3~].H~2~O. 1/2CH~3~OH and <i>fac</i>-[Co(C~5~H~4~NOS)~3~]. 1/3CH~3~OH","Acta Crystallographica Section C","1995","51","3","370","374","10.1107/S0108270194006207","","","0.71069","MoKα","","","0.062","","","0.064","","","","","1.36","1.36","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2003280","21.997","0.011","9.094","0.005","27.594","0.009","90","","95.87","0.04","90","","5491","4","296","1","","","","","","","","","Crystallized from methanol","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H13 Co N3 O4 S3 -","- C15.3333 H13.3333 Co N3 O3.33333 S3 -","- C184 H160 Co12 N36 O40 S36 -","12","3","MU1088","Xu, Y.-J.; Kang, B.-S.; Chen, X.-T.; Huang, L.-R.","<i>fac</i>-[Co(C~5~H~4~NOS)~3~].H~2~O. 1/2CH~3~OH and <i>fac</i>-[Co(C~5~H~4~NOS)~3~]. 1/3CH~3~OH","Acta Crystallographica Section C","1995","51","3","370","374","10.1107/S0108270194006207","","","0.71069","MoKα","","","0.052","","","0.062","","","","","1.38","1.38","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003281","7.511","0.003","9.468","0.005","8.142","0.002","88.26","0.04","112.69","0.02","92.23","0.04","533.7","0.4","295","","","","","","","","","","Synthesis","4","P -1","-P 1","2","","","","- C7 H12 N4 S2 -","- C7 H12 N4 S2 -","- C14 H24 N8 S4 -","2","1","MU1121","Seth, S.; Sur, H.","A 1:1 Adduct of 4,6-Dimethylpyrimidine-2(1<i>H</i>)-thione and Thiourea","Acta Crystallographica Section C","1995","51","3","487","489","10.1107/S0108270194009236","","","0.71073","MoKα","","","0.034","","","0.038","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003282","11.161","0.002","11.338","0.006","17.206","0.013","98.726","0.056","107.306","0.04","111.682","0.039","1846","2","210","1","","","","","","","","","slow diffusion of n-hexane into dichloromethane solution at 243 K","7","P -1","-P 1","2","","","","- C28 H38 B9 Cl4 P2 Rh S -","- C28 H38 B9 Cl4 P2 Rh S -","- C56 H76 B18 Cl8 P4 Rh2 S2 -","2","1","MU1131","Adams, K. J.; McGrath, T. D.; Welch, A. J.","8-(Ph~2~PCH~2~CH~2~PPh~2~)-8,7-<i>nido</i>-RhSB~9~H~10~.2CH~2~Cl~2~","Acta Crystallographica Section C","1995","51","3","401","403","10.1107/S0108270194009947","","","0.71069","MoKα","","","0.0528","","","0.0846","","","","","1.618","1.618","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003283","11.8386","0.0009","15.3158","0.0012","7.7899","0.0006","90","","95.97","0.008","90","","1404.79","0.19","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H15 N -","- C19 H15 N -","- C76 H60 N4 -","4","1","MU1138","Clegg, W.; Hewkin, C. T.; Jackson, R. F. W.","2,6-Diphenyl-3-vinylpyridine","Acta Crystallographica Section C","1995","51","3","525","527","10.1107/S0108270194010814","","","1.54184","CuKα","","0.0633","0.0588","","0.1739","0.1597","","","","1.059","1.064","1.064","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2003284","13.179","0.001","12.075","0.001","17.963","0.001","90","","109.1","0.007","90","","2701.2","0.4","296","1","296.2","","","","","","","","isolation","3","P 1 21 1","P 2yb","4","","","","- C62 H52 O24 -","- C62 H52 O24 -","- C124 H104 O48 -","2","1","NA1086","Bryant, F. O.; Cutler, H. G.; Burla, M. C.; Newton, M. G.","Duclauxin Ethyl Acetate Solvate, 2C~29~H~22~O~11~.C~4~H~8~O~2~","Acta Crystallographica Section C","1995","51","3","437","440","10.1107/S010827019400394X","","","1.54178","CuKᾱ","","","0.038","","","0.042","","","","","3.13","3.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003285","5.593","0.001","12.227","0.002","15.705","0.007","90","","90","","90","","1074","0.5","298","","","","","","","","","","Chemical synthesis","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H12 N2 O4 S -","- C9 H12 N2 O4 S2 -","- C36 H48 N8 O16 S8 -","4","1","NA1093","Ayala, D. J.; Bombieri, G.; Perosino, T.; Stradi, R.","3-(5-Oxo-<small>L</small>-prolyl)-<small>L</small>-thiazolidine-4-carboxylic Acid","Acta Crystallographica Section C","1995","51","3","473","475","10.1107/S0108270194008280","","","0.71069","MoKα","","","0.0367","","","0.0409","","","","","0.85","0.85","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003286","17.144","0.001","11.45","0.003","10.179","0.002","90","","90.757","0.008","90","","1998","0.7","293","","293","","","","","","","","Janssen Research Foundation, Belgium","5","P 1 21/c 1","-P 2ybc","14","","3-{2-[4-(4-Fluorobenzoyl)-1-piperidinyl]ethyl}-2-methyl- 4H-pyrido[1,2-a]pyrimidine-4-one","","- C23 H24 F N3 O2 -","- C23 H24 F N3 O2 -","- C92 H96 F4 N12 O8 -","4","1","NA1112","Blaton, N. M.; Peeters, O. M.; De Ranter, C. J.","3-{2-[4-(4-Fluorobenzoyl)piperidino]ethyl}-2-methyl-4<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidin-4-one (Pirenperone)","Acta Crystallographica Section C","1995","51","3","533","535","10.1107/S0108270194008176","","","1.54184","CuKα","","0.1846","0.0748","","0.2297","0.1648","","","","1.13","1.44","1.44","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003287","7.898","0.001","26.463","0.004","14.099","0.002","90","","99.69","0.02","90","","2904.7","0.7","289","2","289","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(1-pyrenyl)-3-(4-(dimethylamino)phenyl)hexamethyltrisilane","","- C30 H37 N Si3 -","- C30 H37 N Si3 -","- C120 H148 N4 Si12 -","4","1","NA1121","Van Meervelt, L.","1-[4-(Dimethylamino)phenyl]-3-(1-pyrenyl)hexamethyltrisilane","Acta Crystallographica Section C","1995","51","3","543","544","10.1107/S0108270194010413","","","1.54178","CuKα","","0.123","0.064","","0.1746","0.148","","","","1.058","1.191","1.191","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003288","14.539","0.003","5.492","0.002","23.452","0.002","90","","98.12","0.01","90","","1853.8","0.8","296","","","","","","","","","","synthesis","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 O S2 -","- C18 H28 O S2 -","- C72 H112 O4 S8 -","4","1","OH1059","Miyake, M.; Haramoto, Y.","2-(<i>p</i>-Ethoxyphenyl)-5-hexyl-1,3-dithiane, C~18~H~28~OS~2~","Acta Crystallographica Section C","1995","51","3","475","477","10.1107/S0108270194007584","","","0.71069","MoKα","","","0.044","","","0.047","","","","","1.3","1.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003289","7.342","0.002","4.702","0.002","23.131","0.006","90","","101.83","0.01","90","","781.6","0.4","294","1","","","","","","","","","Slow evaporation of an ethanolic solution","4","C 1 2/c 1","-C 2yc","15","","","","- C4 H10 Hg S2 -","- C4 H10 Hg S2 -","- C16 H40 Hg4 S8 -","4","0.5","OH1066","Fraser, K. A.; Clegg, W.; Craig, D. C.; Scudder, M. L.; Dance, I. G.","New Crystal Data for [Hg(SC~2~H~5~)~2~]","Acta Crystallographica Section C","1995","51","3","406","408","10.1107/S0108270194009510","","","0.7107","MoKα","","","0.017","","","0.031","","","","","1.22","1.22","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003290","10.43","0.007","11.728","0.007","12.268","0.009","108.31","0.05","98.34","0.05","115.66","0.05","1212.9","1.7","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H16 N2 O2 -","- C12 H13.5 N2 O2 -","- C48 H54 N8 O8 -","4","2","PA1096","Suchod, B.; Baldeck, P.","<i>N</i>,<i>N</i>-Diethyl-4-(2-nitroethenyl)phenylamine (DEANST), C~12~H~6~N~2~O~2~","Acta Crystallographica Section C","1995","51","3","432","434","10.1107/S0108270194005998","","","0.7107","MoKα","","","0.089","","","0.079","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003291","7.84","0.01","18.4","0.02","7.65","0.03","99.35","0.02","114.48","0.03","80.64","0.02","985","4","293","","","","","","","","","","evaporation of a saturated 50/50% H~2~O/ethanol solution","5","P -1","-P 1","2","","","","- C21 H28 Cl N2 O2 -","- C21 H24 Cl N2 O2 -","- C42 H48 Cl2 N4 O4 -","2","1","PA1108","Brouant, P.; Giorgi, M.","9-(4-Methyl-1-piperazinyl)-9,10-dihydro-9,10-ethanoanthracene Hydrochloride Dihydrate (Trazitilin)","Acta Crystallographica Section C","1995","51","3","434","436","10.1107/S0108270194007274","","","0.71073","MoKα","","","0.051","","","0.054","","","","","0.854","0.854","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003292","8.323","0.004","10.569","0.005","17.022","0.01","90","","100.15","0.02","90","","1473.9","1.3","293","","293","","","","","","","","chemical synthesis","4","P 1 21 1","P 2yb","4","","Baccatin III derivative","","- C26 H44 O8 Si -","- C26 H44 O8 Si -","- C52 H88 O16 Si2 -","2","1","PA1126","Chiaroni, A.; Guénard, D.; Guéritte-Voegelein, F.; Khuong-Huu, F.; Py, S.; Riche, C.; Wahl, A.","A Baccatin III Derivative","Acta Crystallographica Section C","1995","51","3","465","468","10.1107/S0108270194007341","","","1.5418","CuKα","","","0.105","","","0.145","","","","","1.25","1.25","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003293","10.579","0.002","11.618","0.002","11.886","0.003","90","","110.293","0.008","90","","1370.2","0.5","298","","298","","","","","","","","from diethyl ether/pentane (1:1) solution","4","P 1 21/c 1","-P 2ybc","14","","(2RS,1'SR)-4,4-Dimethyl-1-hydroxy-2-[1'-phenethyl]pyrrolidine","","- C14 H21 N O -","- C14 H21 N O -","- C56 H84 N4 O4 -","4","1","PA1132","Bernardinelli, G.; Oppolzer, W.; Spivey, A. C.","(2<i>RS</i>)-4,4-Dimethyl-2-[(1<i>SR</i>)-1-phenylethyl]-1-pyrrolidinol","Acta Crystallographica Section C","1995","51","3","529","530","10.1107/S0108270194009686","","","0.7093","MoKα","","0.162","0.071","","0.047","0.044","","","","2.107","2.89","2.89","","","","","has coordinates","191030","2020-10-21","18:00:00",""
"2003294","33.657","0.003","5.1305","0.0003","16.0816","0.001","90","","92.368","0.008","90","","2774.6","0.3","293","2","293","2","","","","","","","Therabel Research, Bruxelles","5","C 1 2/c 1","-C 2yc","15","Nimesulide","4-nitro-2-phenoxymethanesulfonanilide","","- C13 H12 N2 O5 S -","- C13 H12 N2 O5 S -","- C104 H96 N16 O40 S8 -","8","1","PA1137","Dupont, L.; Pirotte, B.; Masereel, B.; Delarge, J.; Geczy, J.","Nimesulide","Acta Crystallographica Section C","1995","51","3","507","509","10.1107/S0108270194010334","","","1.5418","CuKα","","0.0638","0.0401","","0.1325","0.1146","","","","1.088","1.248","1.248","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003295","11.7356","0.001","13.5707","0.0014","12.4426","0.0011","90","","110.975","0.008","90","","1850.3","0.3","293","2","293","2","","","","","","","Laboratory of Medicinal Chemistry, Univ. of Liege","5","P 1 21/n 1","-P 2yn","14","","N-Cyano-N'-Isopropyl-N""-((4-(3'-Methylphenylamino)Pyrid-3-yl)Sulfonyl) Guanidine","","- C17 H20 N6 O2 S -","- C17 H20 N6 O2 S -","- C68 H80 N24 O8 S4 -","4","1","PA1139","Dupont, L.; Masereel, B.; de Tullio, P.; Pirotte, B.; Delarge, J.","<i>N</i>^2^-Cyano-<i>N</i>^1^-isopropyl-<i>N</i>^3^-[4-(3-methylphenylamino)-3-pyridylsulfonyl]guanidine","Acta Crystallographica Section C","1995","51","3","505","507","10.1107/S0108270194010346","","","1.5418","CuKα","","0.0565","0.0387","","0.1129","0.106","","","","0.983","1.099","1.099","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003296","6.7639","0.0002","8.0105","0.0001","9.3111","0.0001","95.703","0.001","106.774","0.001","92.499","0.002","479.254","0.017","293","2","293","2","","","","","","","diffusion of petroleum ether into a solution of (1) in ethyl acetate","5","P 1","P 1","1","","(5R,6S,7R,9R,13S,14R)-7-Chloro-7-cyano-4,5-epoxy-3,6-dimethoxy-N-methyl- 6,14-ethenoisomorphinane","","- C22 H23 Cl N2 O3 -","- C22 H23 Cl N2 O3 -","- C22 H23 Cl N2 O3 -","1","1","SE1061","Schollmeyer, D.; Keilhofer, D.; Pindur, U.","Diels‒Alder Products of the Alkaloid ({-})-Thebaine with α-Chloroacrylnitrile and 1-Methoxy-1,3-cyclohexadiene with Tetracyanoethene","Acta Crystallographica Section C","1995","51","3","502","505","10.1107/S0108270194007900","","","1.5418","CuKα","","0.0476","0.0475","","0.1362","0.136","","","","1.126","1.126","1.126","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003297","7.5252","0.0005","9.398","0.001","17.29","0.0007","90","","90","","90","","1222.78","0.16","293","2","293","2","","","","","","","slow evaporation of chloroform solution of (2)","4","P 21 21 21","P 2ac 2ab","19","","1-Methoxy-5,5,6,6-tetracyanobicyclo[2.2.2]oct-3-ene","","- C13 H10 N4 O -","- C13 H10 N4 O -","- C52 H40 N16 O4 -","4","1","SE1061","Schollmeyer, D.; Keilhofer, D.; Pindur, U.","Diels‒Alder Products of the Alkaloid ({-})-Thebaine with α-Chloroacrylnitrile and 1-Methoxy-1,3-cyclohexadiene with Tetracyanoethene","Acta Crystallographica Section C","1995","51","3","502","505","10.1107/S0108270194007900","","","1.5418","CuKα","","0.0535","0.0527","","0.1421","0.1407","","","","1.027","1.031","1.031","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003298","20.076","0.002","6.831","0.002","20.113","0.001","90","","90","","90","","2758.3","0.9","293","","","","","","","","","","Kristallisation (Propanol/Hexan)","4","P n a 21","P 2c -2n","33","","","","- C24 H30 N10 O8 -","- C24 H30 N10 O8 -","- C96 H120 N40 O32 -","4","1","SH1093","Gzella, A.; Wrzeciono, U.","Struktur der Molekularverbindung von 3,5-Dinitroindazol und Piperidin. 39. Azole","Acta Crystallographica Section C","1995","51","3","484","487","10.1107/S0108270194008930","","","1.54178","CuKα","","","0.035","","","0.034","","","","","2.8675","2.8675","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003299","9.452","0.006","14.33","0.016","11.826","0.004","90","","112.98","0.04","90","","1475","2","295","","","","","","","","","","recrystallization from DMSO","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 N3 -","- C18 H19 N3 -","- C72 H76 N12 -","4","1","VJ1005","Parihar, D. S.; Bohra, R.; Prasad, R. N.; Nagar, P. N.","An Imidazo[1,2-<i>a</i>]pyrazine Derivative, C~18~H~19~N~3~","Acta Crystallographica Section C","1995","51","3","482","484","10.1107/S0108270194009017","","","0.71069","MoKα","","","0.048","","","0.05","","","","","0.51","0.51","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003300","8.877","0.002","12.179","0.003","9.734","0.002","90","","106.11","0.02","90","","1011","0.4","294","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C23 H30 O4 -","- C23 H30 O4 -","- C46 H60 O8 -","2","1","VJ1006","Bidya Sagar, M.; Ravikumar, K.; Rama Rao, A. V.; Machender Reddy, M.; Singh, A. K.","Structural Studies of Intermediates in the Synthesis of Mifepristone (RU 486). II. Structure of a β-Epoxy Steroid","Acta Crystallographica Section C","1995","51","3","451","454","10.1107/S0108270194008589","","","0.71069","MoKα","","","0.046","","","0.053","","","","","0.952","0.952","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003301","9.24","0.002","10.761","0.002","15.217","0.003","90","","90","","90","","1513.1","0.5","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 O4 -","- C17 H22 O4 -","- C68 H88 O16 -","4","1","VJ1007","Ravikumar, K.; Chandra Mohan, K.; Shekharam, T.; Yadav, J. S.","The Diels‒Alder Reaction Product of β-Ionone and Maleic Anhydride","Acta Crystallographica Section C","1995","51","3","449","451","10.1107/S010827019401067X","","","0.71073","MoKα","","","0.039","","","0.045","","","","","0.884","0.884","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003302","6.6532","0.0006","7.1539","0.0004","20.3786","0.0013","90","","93.473","0.007","90","","968.17","0.12","293","2","293","","","","","","","","","3","P 1 21 1","P 2yb","4","","3'-methoxy spiro [bicyclo[3.1.0] hexane-6,16'-estra [1,3,5(10)] triene]-17'-one","","- C24 H30 O2 -","- C24 H30 O2 -","- C48 H60 O4 -","2","1","AB1170","Hooft, R. W. W.; Kroon, J.","3'-Methoxyspiro[bicyclo[3.1.0]hexane-6,16'-estra-1',3',5'(10')-trien]-17'-one","Acta Crystallographica Section C","1995","51","4","721","723","10.1107/S0108270194008899","","","1.54184","CuKα","","","0.03","","","0.034","","","","","0.18","0.18","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003303","10.716","0.001","17.431","0.004","35.029","0.007","90","","90","","90","","6543","2","295","","295","","","","","","","","The title compound was prepared by the interaction of cis-[PtCl~2~(PMe~2~Ph)~2~] with triphenylsilane in boiling benzene--triethylamine solution (Chatt, Earborn, Ibekwe & Kapoor, 1967). Single crystals were formed on cooling to room temperature.","6","P b c a","-P 2ac 2ab","61","","","","- C34 H37 Cl P2 Pt Si -","- C34 H34 Cl P2 Pt Si -","- C272 H272 Cl8 P16 Pt8 Si8 -","8","1","AB1204","Kapoor, P.; Lövqvist, K.; Oskarsson, Å.","The <i>trans</i> Influence of the Silyl Ligand. Structure of <i>trans</i>-[PtCl(SiPh~3~)(PMe~2~Ph)~2~]","Acta Crystallographica Section C","1995","51","4","611","613","10.1107/S0108270194011170","","","0.7107","MoKα","","","0.0299","","","0.0336","","","","","1.302","1.302","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003304","9.604","0.006","9.994","0.004","16.072","0.005","90","","103.68","0.03","90","","1498.9","1.2","173","1","173","1","","","","","","","Crystals of (I) were grown by slow evaporation of an aqueous acetone solution at room temperature.","3","P 1 21 1","P 2yb","4","3-O-benzoyl-4,6:4',6'-di-O-benzylidene-2,2'-dideoxy-α,α-ribotrehalose","3-O-benzoyl-4,6-O-benzylidene-2-deoxy-α-D-ribohexopyranosyl 4,6-O- benzylidene-2-deoxy-α-D-ribohexopyranoside","","- C33 H34 O10 -","- C33 H34 O10 -","- C66 H68 O20 -","2","1","AB1243","Linden, A.; Lee, C. K.","3-<i>O</i>-Benzoyl-4,6;4',6'-di-<i>O</i>-benzylidene-2,2'-dideoxy-α,α-<i>ribo</i>-trehalose","Acta Crystallographica Section C","1995","51","4","747","751","10.1107/S010827019401440X","","","0.71069","MoKα","","0.0804","0.0416","","0.0347","0.0317","","","","","1.577","1.577","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003305","9.326","0.002","11.991","0.003","7.964","0.001","94.58","0.02","105.39","0.02","113.84","0.03","767.5","0.4","297","","","","","","","","","","chemical synthesis","4","P -1","-P 1","2","","5-Ethoxymethyl-1-[1-ethyl-2,4-dioxo-5- (pyrimidinyl)methyl]uracil","","- C14 H18 N4 O5 -","- C14 H18 N4 O5 -","- C28 H36 N8 O10 -","2","1","AS1096","Yamaguchi, K.; Tanaka, H.; Matsumoto, K.; Kittaka, A.; Miyasaka, T.","A Dimeric Uracil Derivative","Acta Crystallographica Section C","1995","51","4","754","756","10.1107/S0108270194001034","","","1.5405","CuKα~1~","","","0.042","","","0.043","","","","","1.81","1.81","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2003306","11.549","0.003","3.756","0.001","16.442","0.008","90","0.03","104.94","0.03","90","0.02","689.1","0.4","298","","","","","","","","","","from water solution","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H5 N O3 -","- C8 H5 N O3 -","- C32 H20 N4 O12 -","4","1","AS1104","Miao, F.-M.; Wang, J.-L.; Miao, X.-S.","<i>N</i>-Hydroxyphthalimide","Acta Crystallographica Section C","1995","51","4","712","713","10.1107/S0108270194007638","","","0.71073","MoKα","","","0.041","","","0.045","","","","","0.685","0.685","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003307","7.847","0.002","12.691","0.003","7.395","0.002","101.77","0.02","116.2","0.02","74.31","0.02","633.1","0.3","293","","","","","","","","","","chemical synthesis","7","P -1","-P 1","2","","","","- C10 H8 Cl2 N2 O S V -","- C10 H8 Cl2 N2 O S V -","- C20 H16 Cl4 N4 O2 S2 V2 -","2","1","AS1119","Kondo, M.; Kawata, S.; Kitagawa, S.; Kiso, H.; Munakata, M.","An Oxovanadium(IV) Complex Chelated by Dipyridyl Sulfide","Acta Crystallographica Section C","1995","51","4","567","569","10.1107/S0108270194008127","","","0.71069","MoKα","","","0.035","","","0.04","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003308","6.985","0.004","16.056","0.022","16.566","0.017","81.92","0.1","85.05","0.07","79.34","0.08","1804","3","133","","","","","","","","","","natural product isolated from the powdered roots of Phormium cookianum","3","P -1","-P 1","2","","","","- C10 H10 O4 -","- C10 H10 O4 -","- C80 H80 O32 -","8","4","AS1120","Gainsford, G. J.","Antifungal Compounds Isolated from New Zealand Flax: 7-Hydroxy-5-methoxy-6-methylphthalide and 4-Methoxycarbonyl-β-orcinol","Acta Crystallographica Section C","1995","51","4","709","712","10.1107/S0108270194009753","","","0.71073","MoKα","","","0.051","","","0.111","","","","","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003309","7.043","0.002","18.142","0.007","7.238","0.002","90","","96.44","0.02","90","","919","0.5","133","","","","","","","","","","natural product isolated from Phormium cookianum","3","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 O4 -","- C10 H12 O4 -","- C40 H48 O16 -","4","1","AS1120","Gainsford, G. J.","Antifungal Compounds Isolated from New Zealand Flax: 7-Hydroxy-5-methoxy-6-methylphthalide and 4-Methoxycarbonyl-β-orcinol","Acta Crystallographica Section C","1995","51","4","709","712","10.1107/S0108270194009753","","","0.71073","MoKα","","","0.04","","","0.052","","","","","1.74","1.74","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003310","10.127","0.002","4.87","0.002","15.811","0.002","90","","106.61","0.01","90","","747.2","0.4","296","","","","","","","","","","evaporation from 50% ethanol","3","P 1 21/a 1","-P 2yab","14","","","","- C8 H8 O4 -","- C8 H8 O4 -","- C32 H32 O16 -","4","1","AS1128","Okabe, N.; Kohyama, Y.","Homogentisic Acid","Acta Crystallographica Section C","1995","51","4","761","763","10.1107/S0108270194010176","","","0.71069","MoKα","","","0.051","","","0.049","","","","","1.47","1.47","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003311","10.114","0.003","12.013","0.009","9.368","0.004","122.59","0.04","90.11","0.03","98.31","0.04","944.6","1","298","","298","","","","","","","","","4","P -1","-P 1","2","Samarium Octamolybdate","dodecaaquasamarium octamolybdate hexahydrate","","- H36 Mo8 O45 Sm2 -","- Mo8 O45 Sm2 -","- Mo8 O45 Sm2 -","1","0.5","AS1146","Yamase, T.; Ozeki, T.; Kawashima, I.","Photoluminescent Samarium Octamolybdate","Acta Crystallographica Section C","1995","51","4","545","547","10.1107/S0108270194012205","","","0.71069","MoKα","","","0.061","","","0.061","","","","","2.11","2.11","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003312","11.844","0.001","12.871","0.001","15.237","0.002","90","","90","","90","","2322.8","0.4","293","","293","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Dibromo[bis(o-N,N-dimethylaminomethylphenyl)methylsilanol]cobalt(II)","","- C19 H28 Br2 Co N2 O Si -","- C19 H28 Br2 Co N2 O Si -","- C76 H112 Br8 Co4 N8 O4 Si4 -","4","1","BK1030","Baggio, R. F.; Garland, M. T.; Manzur, J.; Spodine, E.","[Bis(<i>o</i>-dimethylaminomethylphenyl)methylsilanol-<i>N</i>,<i>O</i>]dibromocobalt(II)","Acta Crystallographica Section C","1995","51","4","602","604","10.1107/S0108270194009200","","","0.71073","MoKα","","0.056","0.039","","0.055","0.049","","","","","0.83","0.83","","","","","has coordinates","194583","2020-10-21","18:00:00",""
"2003313","11.832","0.003","14.05","0.003","18.049","0.003","90","","90","","90","","3000.5","1.1","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Triethylammonium bis(mercaptobenzoato)(cis-dioxomolibdato(VI))","","- C26 H40 Mo N2 O6 S2 -","- C26 H40 Mo N2 O6 S2 -","- C104 H160 Mo4 N8 O24 S8 -","4","1","BK1032","Li-Kao, J.; González, O.; Baggio, R. F.; Garland, M. T.; Carrillo, D.","Bis(triethylammonium) Bis(2-mercaptobenzoato-<i>O</i>,<i>S</i>)dioxomolybdate(VI)","Acta Crystallographica Section C","1995","51","4","575","578","10.1107/S0108270194011236","","","0.71073","MoKα","","0.0441","0.033","","0.0879","0.08","","","","1.044","1.045","1.045","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003314","7.36","0.002","9.793","0.002","19.369","0.002","90","","90","","90","","1396","0.5","296","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C8 H18 Cl2 O2 Pt S2 -","- C8 H18 Cl2 O2 Pt S2 -","- C32 H72 Cl8 O8 Pt4 S8 -","4","1","BK1039","De Azevedo, Jnr, W. F.; Mascarenhas, Y. P.; De Sousa, G. F.; Filgueiras, C. A. L.","<i>cis</i>-[1,2-Bis(propylsulfinyl)ethane-<i>S</i>,<i>S</i>']dichloroplatinum(II)","Acta Crystallographica Section C","1995","51","4","619","621","10.1107/S0108270194009868","","","0.71073","MoKα","","","0.047","","","0.052","","","","","1.43","1.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003315","9.138","0.002","9.172","0.003","13.598","0.006","103.34","0.03","92.01","0.03","114.3","0.02","999.8","0.6","153","","","","","","","","","","from (Me~3~Si)~3~SiLi and Cl-SiMe~2~-SiMe~2~-Cl","3","P -1","-P 1","2","","","","- C22 H66 Si10 -","- C22 H66 Si10 -","- C22 H66 Si10 -","1","0.5","BK1051","Lambert, J. B.; Pflug, J. L.; Allgeier, A. M.; Campbell, D. J.; Higgins, T. B.; Singewald, E. T.; Stern, C. L.","A Branched Polysilane","Acta Crystallographica Section C","1995","51","4","713","715","10.1107/S0108270194009704","","","0.71069","MoKα","","","0.024","","","0.033","","","","","1.62","1.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003316","10.734","0.003","13.096","0.004","13.712","0.004","72.34","0.02","72.07","0.02","71.82","0.02","1695.9","0.9","188","1","188","1","","","","","","","","4","P -1","-P 1","2","","(N-[Methoxy)carbonyl]-15-keto-13-methoxy-10-aza-14a, 10a-benzobicyclo[7.3.1]tridec-3,7-diyn-5-ene)","","- C40 H34 N2 O9 -","- C41 H30 N2 O9.5 -","- C82 H60 N4 O19 -","2","1","BK1061","Lynch, V. M.; Fairhurst, R. A.; Iliadis, T. N.; Magnus, P.; Davis, B. E.","Two [7.3.1]Azabicyclo-<i>z</i>-3-ene-1,5-diyne Analogues of Dynemicin A","Acta Crystallographica Section C","1995","51","4","782","786","10.1107/S0108270194010231","","","0.71073","MoKα","","0.0576","0.0437","","0.0563","0.0543","","","","","1.83","1.83","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003317","10.747","0.003","11.529","0.003","11.661","0.002","89.82","0.02","70.51","0.02","67.43","0.02","1244.7","0.6","173","1","173","1","","","","","","","","4","P -1","-P 1","2","","(N-[Adamantyloxy)carbonyl]-15-keto-13-methoxy-10-aza-14a, 10a-benzobicyclo[7.3.1]tridec-3,7-diyn-5-ene)","","- C30 H31 N O5 -","- C31 H27 N O5 -","- C62 H54 N2 O10 -","2","1","BK1061","Lynch, V. M.; Fairhurst, R. A.; Iliadis, T. N.; Magnus, P.; Davis, B. E.","Two [7.3.1]Azabicyclo-<i>z</i>-3-ene-1,5-diyne Analogues of Dynemicin A","Acta Crystallographica Section C","1995","51","4","782","786","10.1107/S0108270194010231","","","0.71073","MoKα","","0.0678","0.053","","0.0713","0.0692","","","","","2.297","2.297","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003318","12.491","0.001","12.368","0.001","15.655","0.001","90","","109.72","0.01","90","","2276.7","0.3","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H35 N Ni P2 -","- C21 H35 N Ni P2 -","- C84 H140 N4 Ni4 P8 -","4","1","BK1063","VanderLende, D. D.; Boncella, J. M.; Abboud, K. A.","<i>trans</i>-[Ni(Me~3~Ph)(NHPh)(PMe~3~)~2~], a Monomeric Ni^II^‒Amide Complex","Acta Crystallographica Section C","1995","51","4","591","593","10.1107/S0108270194011534","","","0.71073","MoKα","","","0.0445","","","0.0478","","","","","1.36","1.36","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003319","6.197","0.001","9.348","0.002","9.713","0.002","83.9","0.01","84.97","0.01","85.85","0.02","556.2","0.19","293","2","293","2","","","","","","","see text","4","P -1","-P 1","2","Ethylenediamine-N,N'-dimethyl-N,N'-2,2'-di-6-tert-butyl-1,4-benzoquinone","Ethylenediamine-N,N'-dimethyl-N,N'-2,2'-di-6-tert-butyl-1,4-benzoquinone","","- C24 H32 N2 O4 -","- C24 H32 N2 O4 -","- C24 H32 N2 O4 -","1","0.5","BK1067","Raptova, L.; Rapta, M.; Horak, V.","Ethylenediamine-<i>N</i>,<i>N</i>'-dimethyl-<i>N</i>,<i>N</i>'-2,2'-di-6-<i>tert</i>-butyl-1,4-benzoquinone","Acta Crystallographica Section C","1995","51","4","734","736","10.1107/S0108270194011091","","","0.71073","MoKα","","0.0769","0.0531","","0.1598","0.1372","","","","1.021","1.054","1.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003320","9.415","0.003","8.103","0.002","11.957","0.003","90","","90","","90","","912.2","0.4","130","2","130","2","","","","","","","","5","P m n 21","P 2ac -2","31","aminobenzyl-dioxocyclam nickel(II)","(6-(p-aminobenzyl)-1,4,8,11-tetraazacyclotetradecane-5,7-dione)nickel(II)","","- C17 H25 N5 Ni O2 -","- C17 H25 N5 Ni O2 -","- C34 H50 N10 Ni2 O4 -","2","0.5","BK1076","Moran, J. K.; Olmstead, M. M.; Meares, C. F.","An Aminobenzyldioxocyclam Nickel(II) Complex","Acta Crystallographica Section C","1995","51","4","621","623","10.1107/S0108270194011753","","","0.71073","MoKα","","0.0345","0.0291","","0.0709","0.0667","","","","1.022","1.024","1.024","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003321","13.778","0.002","13.2816","0.0013","26.188","0.003","90","","90","","90","","4792.2","1","298","2","298","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","azidotetrakis(trimethylphosphine)nickel(II) tetrafluoroborate","","- C12 H36 B F4 N3 Ni P4 -","- C12 H36 B F4 N3 Ni P4 -","- C96 H288 B8 F32 N24 Ni8 P32 -","8","1","BK1077","Carson, C. C.; Pike, R. D.; Carpenter, G. B.","Azidotetrakis(trimethylphosphine)nickel(II) Tetrafluoroborate","Acta Crystallographica Section C","1995","51","4","595","598","10.1107/S0108270194010553","","","0.71073","MoKα","","0.1242","0.0577","","0.1529","0.1337","","","","0.852","1.106","1.106","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003322","22.5","0.003","6.0128","0.0005","13.254","0.0015","90","","102.446","0.01","90","","1751","0.3","183","1","183","1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","4,7-Dimethoxybenzo[c]furan","","- C10 H10 O3 -","- C10 H10 O3 -","- C80 H80 O24 -","8","1","BK1080","Lynch, V. M.; Fairhurst, R. A.; Magnus, P.; Davis, B. E.","4,7-Dimethoxybenzo[<i>c</i>]furan","Acta Crystallographica Section C","1995","51","4","780","782","10.1107/S0108270194010152","","","0.71073","MoKα","","0.0569","0.0374","","0.0463","0.0416","","","","","1.302","1.302","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2003323","15.818","0.002","15.818","0.002","7.087","0.001","90","","90","","120","","1535.7","0.3","297","","","","","","","","","","Paraiba, Brazil","6","R 3 m :H","R 3 -2""","160","","","","- Al8 B3 Li Na O31 Si6 -","- Al6 B3 Li3 Na O31 Si6 -","- Al18 B9 Li9 Na3 O93 Si18 -","3","0.166667","BR1070","MacDonald, D. J.; Hawthorne, F. C.","Cu-Bearing Tourmaline from Paraiba, Brazil","Acta Crystallographica Section C","1995","51","4","555","557","10.1107/S0108270194008243","","","0.71073","MoKα","","","0.022","","","0.025","","","","","1.2","1.2","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003324","15.805","0.002","15.805","0.002","7.084","0.001","90","","90","","120","","1532.5","0.3","297","","","","","","","","","","Paraiba, Brazil","6","R 3 m :H","R 3 -2""","160","","","","- Al8 B3 Li Na O31 Si6 -","- Al6 B3 Li3 Na O31 Si6 -","- Al18 B9 Li9 Na3 O93 Si18 -","3","0.166667","BR1070","MacDonald, D. J.; Hawthorne, F. C.","Cu-Bearing Tourmaline from Paraiba, Brazil","Acta Crystallographica Section C","1995","51","4","555","557","10.1107/S0108270194008243","","","0.71073","MoKα","","","0.02","","","0.023","","","","","1.4","1.4","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003325","5.833","0.002","6.593","0.003","7.73","0.003","80.97","0.03","81.11","0.03","76.43","0.03","283.2","0.2","293","2","293","2","","","","","","","Hydrothermal synthesis from NiCl~2~.6H~2~O and NaVO~3~.","4","P -1","-P 1","2","Nickel(II) Metavanadate Monohydrate","Nickel(II) divanadium(V)hexaoxide monohydrate","","- H4 Ni2 O14 V4 -","- Ni2 O14 V4 -","- Ni2 O14 V4 -","1","0.5","BR1075","Marcos, M. D.; Amorós, P.; Beltrán-Porter, A.; Ramírez de Arellano, M. C.","Hydrothermal Synthesis and Structure of Nickel(II) Metavanadate Monohydrate, NiV~2~O~6~.H~2~O","Acta Crystallographica Section C","1995","51","4","552","555","10.1107/S0108270194006797","","","0.71073","MoKα","","0.0575","0.0487","","0.1359","0.1284","","","","1.088","1.108","1.108","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003326","8.889","0.001","7.998","0.001","12.237","0.001","90","","103.82","0.01","90","","844.79","0.16","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- B2 Cs2 Ga2 O7 -","- B2 Cs2 Ga2 O7 -","- B8 Cs8 Ga8 O28 -","4","1","BR1078","Smith, R. W.","Cs~2~Ga~2~O(BO~3~)~2~","Acta Crystallographica Section C","1995","51","4","547","549","10.1107/S0108270194009418","","","0.71069","MoKα","","","0.054","","","0.069","","","","","2.53","2.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003327","7.805","0.001","15.157","0.002","6.094","0.001","100.9","0.01","92.99","0.01","86.71","0.01","706.12","0.18","296","","296","","","","","","","","","5","P -1","-P 1","2","","carbonic dihydrazide, bis(3-fluorophenylmethylene)-","","- C15 H12 F2 N4 O -","- C15 H12 F2 N4 O -","- C30 H24 F4 N8 O2 -","2","1","CR1090","Meyers, C. Y.; Kolb, V. M.; Robinson, P. D.","Dimeric Hydrogen-Bonded Structure of Bis(3-fluorophenylmethine)carbonohydrazide","Acta Crystallographica Section C","1995","51","4","775","777","10.1107/S0108270194011492","","","0.71069","MoKα","","","0.044","","","0.051","","","","","1.92","1.92","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003328","8.109","0.003","11.845","0.005","12.364","0.005","71.08","0.03","76.82","0.03","87.62","0.03","1093.1","0.8","298","","","","","","","","","","Recrystallization from chloroform","4","P -1","-P 1","2","","","","- C10 H10 Cl2 Zr -","- C10 H10 Cl2 Zr -","- C40 H40 Cl8 Zr4 -","4","2","CR1136","Corey, J. Y.; Zhu, X.-H.; Brammer, L.; Rath, N. P.","Zirconocene Dichloride","Acta Crystallographica Section C","1995","51","4","565","567","10.1107/S0108270194011509","","","0.71073","MoKα","","","0.032","","","0.0379","","","","","1.08","1.08","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003329","6.718","0.002","12.27","0.004","13.273","0.004","64.19","0.02","81.76","0.02","89.25","0.02","973.3","0.6","295","","","","","","","","","","W. Zajac, Villanova Univ.","4","P -1","-P 1","2","","","","- C9 H12 N2 O4 -","- C9 H12 N2 O4 -","- C36 H48 N8 O16 -","4","2","CR1141","George, C.; Gilardi, R. D.; Zajac, Jnr, W. W.; Buzby, J. H.; Walters, T. R.","3,7-Dinitronoradamantane, C~9~H~12~N~2~O~4~, and 3,7,9-Trinitronoradamantane, C~9~H~11~N~3~O~6~","Acta Crystallographica Section C","1995","51","4","703","706","10.1107/S0108270194011868","","","0.71069","MoKα","","","0.05","","","0.048","","","","","1.68","1.68","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003330","7.169","0.001","10.875","0.001","13.842","0.002","90","","90","","90","","1079.2","0.2","295","","","","","","","","","","W. Zajac, Villanova Univ.","4","P 21 c n","P -2n 2a","33","","","","- C9 H11 N3 O6 -","- C9 H11 N3 O6 -","- C36 H44 N12 O24 -","4","1","CR1141","George, C.; Gilardi, R. D.; Zajac, Jnr, W. W.; Buzby, J. H.; Walters, T. R.","3,7-Dinitronoradamantane, C~9~H~12~N~2~O~4~, and 3,7,9-Trinitronoradamantane, C~9~H~11~N~3~O~6~","Acta Crystallographica Section C","1995","51","4","703","706","10.1107/S0108270194011868","","","1.5418","CuKα","","","0.032","","","0.042","","","","","1.83","1.83","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003331","12.61","0.003","16.038","0.004","12.106","0.003","111.51","0.02","107.92","0.02","94.07","0.02","2120.1","1","294","","294","","","","","","","","Synthesis (Legzdins, Rettig & S\'anchez, 1988)","6","P -1","-P 1","2","","(η^5^-Cyclopentadienyl)nitrosyl(trimethylsilylmethyl) (N-trimethylsilylmethyl-N-nitrosohydroxylaminato)tungsten","","- C13 H27 N3 O3 Si2 W -","- C13 H27 N3 O3 Si2 W -","- C52 H108 N12 O12 Si8 W4 -","4","2","CR1148","Evans, S. V.; Legzdins, P.; Rettig, S. J.; Sánchez, L.; Trotter, J.","A Tungsten Nitrosyl Complex","Acta Crystallographica Section C","1995","51","4","584","586","10.1107/S0108270194010942","","","0.7093","MolybdenumKα~1~","","","0.05","","","0.046","","","","","1.54","1.54","","","","","has coordinates","190984","2020-10-21","18:00:00",""
"2003332","10.0077","0.0006","10.0077","0.0006","7.4342","0.0008","90","","90","","120","","644.81","0.09","295","2","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- F O12 Sr5 V3 -","- F0.98 Nd0.061 O12 Sr4.909 V2.916 -","- F1.96 Nd0.122 O24 Sr9.818 V5.832 -","2","0.166667","DU1084","Corker, D. L.; Chai, B. H. T.; Nicholls, J.; Loutts, G. B.","Neodymium-Doped Sr~5~(PO~4~)~3~F and Sr~5~(VO~4~)~3~F","Acta Crystallographica Section C","1995","51","4","549","551","10.1107/S0108270194006906","","","0.71069","MoKα","","","0.022","","","0.027","","","","","0.87","0.87","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003333","9.7156","0.0004","9.7156","0.0004","7.281","0.0003","90","","90","","120","","595.2","0.04","295","2","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- F O12 P3 Sr5 -","- F Nd0.027 O12 P2.925 Sr4.959 -","- F2 Nd0.054 O24 P5.85 Sr9.918 -","2","0.166667","DU1084","Corker, D. L.; Chai, B. H. T.; Nicholls, J.; Loutts, G. B.","Neodymium-Doped Sr~5~(PO~4~)~3~F and Sr~5~(VO~4~)~3~F","Acta Crystallographica Section C","1995","51","4","549","551","10.1107/S0108270194006906","","","0.71069","MoKα","","","0.023","","","0.029","","","","","0.84","0.84","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003334","9.987","0.004","12.937","0.004","8.921","0.002","90","","90","","90","","1152.6","0.6","295","","","","","","","","","","benzene-acetic acid (9:1)","3","P 21 21 2","P 2 2ab","18","","","","- C14 H10 O4 -","- C14 H10 O4 -","- C56 H40 O16 -","4","1","FG1008","Parvez, M.; Simion, D.; Lario, P.; Sorensen, T. S.","Absolute Configuration of (<i>S</i>,<i>S</i>)-1,2-Dihydro-1,2-<i>trans</i>-acenaphthylenedicarboxylic Acid","Acta Crystallographica Section C","1995","51","4","644","646","10.1107/S0108270194011480","","","0.71069","MoKα","","","0.0414","","","0.0457","","","","","1.97","1.97","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003335","8.155","0.013","8.546","0.008","8.681","0.011","102.47","0.09","117.42","0.11","93.41","0.11","515.5","1.3","291","2","291","2","","","","","cooling to 253 K","","","4","P -1","-P 1","2","","Bis(η^5^-indenyl)tetrakis(μ~2~-iodo)dimolybdenum","","- C18 H14 I4 Mo2 -","- C18 H14 I4 Mo2 -","- C18 H14 I4 Mo2 -","1","0.5","FG1020","Falvello, L. R.; Mattamana, S. P.; Poli, R.","Bis(η^5^-indenyl)tetrakis(μ-iodo)dimolybdenum(<i>Mo</i>—<i>Mo</i>)","Acta Crystallographica Section C","1995","51","4","569","571","10.1107/S010827019400870X","","","0.71073","MoKα","","0.0755","0.0467","","0.1148","0.101","","","","1.02","1.063","1.063","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003336","12.398","0.002","10.057","0.001","10.177","0.001","90","","109.65","0.01","90","","1195","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(R*,R*)-α-(1-Methoxy-3-methylenecyclopropyl)-cyclohexanemethanol","","- C12 H20 O2 -","- C12 H20 O2 -","- C48 H80 O8 -","4","1","FG1036","Delanghe, P. H. M.; Lautens, M.; Lough, A. J.","Two Highly Substituted Methylenecyclopropanes","Acta Crystallographica Section C","1995","51","4","700","703","10.1107/S0108270194011182","","","0.71073","MoKα","","0.1272","0.0511","","0.412","0.0799","","","","","1.17","1.17","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003337","11.29","0.002","19.433","0.002","11.782","0.002","90","","118.22","0.02","90","","2277.7","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(R*,R*)-α-(1-Methyl-3-methylenecyclopropyl)-cyclohexanemethanol","","- C12 H20 O -","- C12 H20 O -","- C96 H160 O8 -","8","2","FG1036","Delanghe, P. H. M.; Lautens, M.; Lough, A. J.","Two Highly Substituted Methylenecyclopropanes","Acta Crystallographica Section C","1995","51","4","700","703","10.1107/S0108270194011182","","","0.71073","MoKα","","0.2353","0.0515","","0.0743","0.061","","","","","1.35","1.35","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003338","10.497","0.002","17.505","0.006","9.903","0.003","90","","113.46","0.05","90","","1669.3","1","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","bis(isopropyldiphenylphosphineoxide)diiodocobalt(II)","","- C30 H34 Co I2 O2 P2 -","- C30 H34 Co I2 O2 P2 -","- C60 H68 Co2 I4 O4 P4 -","2","1","FG1037","Bauer, S. K.; Willis, C. J.; Payne, N. C.","Diiodobis(isopropyldiphenylphosphine oxide-<i>O</i>)cobalt(II)","Acta Crystallographica Section C","1995","51","4","586","588","10.1107/S0108270194010978","","","0.71073","MoKα","","0.0481","0.0354","","0.0965","0.0865","","","","1.064","1.06","1.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003339","18.205","0.002","7.282","0.002","11.022","0.002","90","","100.62","0.02","90","","1436.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1,1'-Ferrocenediyl)methylphenylsilane","","- C17 H16 Fe Si -","- C17 H16 Fe Si -","- C68 H64 Fe4 Si4 -","4","1","FG1039","Foucher, D. A.; Lough, A. J.; Manners, I.; Rasburn, J.; Vancso, J. G.","The First Unsymmetrically Substituted Ring-Tilted Silicon-Bridged [1]Ferrocenophane","Acta Crystallographica Section C","1995","51","4","580","582","10.1107/S010827019401190X","","","0.71073","MoKα","","0.0738","0.0399","","0.0501","0.0468","","","","","1.55","1.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003340","8.976","0.001","10.8","0.001","27.401","0.003","90","","90","","90","","2656.3","0.5","293","","","","","","","","","","Recrystallized from methanol","3","P 21 21 21","P 2ac 2ab","","","","","- C28 H36 O8 -","- C28 H36 O8 -","- C112 H144 O32 -","4","1","GR0163","Wang, Q.; Tu, Y.","A New Bioactive β-Dihydroagarofuran Sesquiterpenoid","Acta Crystallographica Section C","1995","51","4","732","734","10.1107/S0108270193005219","","","0.7093","MoKα","","","0.037","","","0.035","","","","","0.241","0.241","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003341","6.027","0.003","11.177","0.003","10.715","0.004","90","","97.03","0.04","90","","716.4","0.5","100","0.2","100","0.2","","","","","","","Reaction of 1,4,7-triazacyclononane with (MeO)~2~CHNMe~2~. A clear oil was obtained by vacuum distillation.","3","P 1 21/n 1","-P 2yn","14","","1,4,7-triazatricyclo[5.2.1.0^4.10^]decane","","- C7 H13 N3 -","- C7 H13 N3 -","- C28 H52 N12 -","4","1","HA1126","Blake, A. J.; Fallis, I. A.; Gould, R. O.; Harris, S. G.; Parsons, S.; Ross, S. A.; Schröder, M.","1,4,7-Triazatricyclo[5.2.1.0^4,10^]decane at 100 K","Acta Crystallographica Section C","1995","51","4","738","741","10.1107/S0108270194009546","","","0.71073","MoKα","","0.0868","0.0607","","0.192","0.1578","","","","1.029","1.044","1.044","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003342","5.294","0.002","7.718","0.002","13.274","0.004","83.57","0.02","84.65","0.02","74.94","0.02","519.3","0.3","296","","296","","","","","","","","Synthesized at UMIST","4","P -1","-P 1","2","","2-(2,6-Difluorophenyl)-1,3-dithiane","","- C10 H10 F2 S2 -","- C10 H10 F2 S2 -","- C20 H20 F4 S4 -","2","1","HA1127","Adamson, A. J.; Banks, R. E.; Mothersdale, K. N.; Pritchard, R. G.; Manley, T.; Tipping, A. E.","2-(2,6-Difluorophenyl)-1,3-dithiane and 2-(2,6-Difluorophenyl)-1,3-dithiane 1,1,3,3-Tetraoxide. The Role of Oxidation in Locking a Molecular Conformation","Acta Crystallographica Section C","1995","51","4","772","775","10.1107/S0108270194011364","","","0.71069","MoKα","","","0.0297","","","0.0343","","","","","2.159","2.159","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003343","5.257","0.002","7.332","0.002","15.474","0.005","87.61","0.03","85.91","0.03","78.47","0.03","582.7","0.3","296","","296","","","","","","","","Synthesized at UMIST","5","P -1","-P 1","2","","2-(2,6-Difluorophenyl)-1,3-dithiane-1,1,3,3-tetraoxide","","- C10 H10 F2 O4 S2 -","- C10 H10 F2 O4 S2 -","- C20 H20 F4 O8 S4 -","2","1","HA1127","Adamson, A. J.; Banks, R. E.; Mothersdale, K. N.; Pritchard, R. G.; Manley, T.; Tipping, A. E.","2-(2,6-Difluorophenyl)-1,3-dithiane and 2-(2,6-Difluorophenyl)-1,3-dithiane 1,1,3,3-Tetraoxide. The Role of Oxidation in Locking a Molecular Conformation","Acta Crystallographica Section C","1995","51","4","772","775","10.1107/S0108270194011364","","","0.71069","MoKα","","","0.0301","","","0.0356","","","","","1.492","1.492","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003344","12.392","0.002","5.694","0.0011","19.951","0.003","90","","98.13","0.13","90","","1393.6","0.6","153","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C8 H18 O4 S4 -","- C8 H18 O4 S4 -","- C32 H72 O16 S16 -","4","0.5","HH1027","Freeman, F.; Ma, X.-B.; Ziller, J. W.; Lin, R. I.","Bis(<i>tert</i>-butylsulfonyl) Disulfide","Acta Crystallographica Section C","1995","51","4","661","663","10.1107/S010827019400781X","","","0.71073","MoKα","","","0.041","","","0.045","","","","","1.4","1.4","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003345","5.9314","0.0008","18.92","0.003","15.866","0.002","90","","91.474","0.012","90","","1779.9","0.4","168","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 S -","- C24 H20 S -","- C96 H80 S4 -","4","1","HH1053","Freeman, F.; Lu, H.; Ziller, J. W.; Rodriguez, E.","3-Benzyl-5-phenyl-2-<i>p</i>-tolylthiophene","Acta Crystallographica Section C","1995","51","4","657","659","10.1107/S0108270194007833","","","0.71073","MoKα","","","0.043","","","0.055","","","","","2.23","2.23","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003346","7.3431","0.0013","7.6239","0.0017","12.2209","0.002","78.411","0.016","78.381","0.014","79.439","0.015","649.2","0.2","158","","","","","","","","","","","3","P -1","-P 1","2","","","","- C32 H30 S2 -","- C32 H30 S2 -","- C32 H30 S2 -","1","0.5","HH1054","Freeman, F.; Lu, H.; Ziller, J. W.; Rodriguez, E.","(1<i>Z</i>,3<i>Z</i>)-1,4-Diphenyl-1,4-bis(<i>p</i>-tolylmethylthio)-1,3-butadiene","Acta Crystallographica Section C","1995","51","4","659","661","10.1107/S0108270194007845","","","0.71073","MoKα","","","0.043","","","0.049","","","","","1.42","1.42","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2003347","15.034","0.002","15.034","0.002","7.187","0.002","90","","90","","120","","1406.8","0.5","296","","","","","","","","","","acetone recrystallization","4","P 32","P 32","","","","","- C21 H28 N2 O2 -","- C21 H28 N2 O2 -","- C63 H84 N6 O6 -","3","1","HR1007","Lisgarten, D. R.; Palmer, R. A.; Maes, D.; Lisgarten, J.; Wyns, L.","Two Steroidal Epimers, (5β,17α)-Pregna-20-yno[3,4-<i>c</i>][1,2,5]oxadiazol-17-ol (the 5β-Epimer) and (5α,17α)-Pregna-20-yno[3,4-<i>c</i>][1,2,5]oxadiazol-17-ol (the 5α-Epimer)","Acta Crystallographica Section C","1995","51","4","666","670","10.1107/S0108270194007237","","","1.5418","CuKα","","0.048","0.048","","0.054","0.052","","","","","","","","","","","has coordinates","281832","2023-03-13","07:38:35",""
"2003348","11.949","0.001","13.284","0.001","11.504","0.001","90","","90","","90","","1826","0.3","296","","","","","","","","","","acetone recrystallization","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H28 N2 O2 -","- C21 H28 N2 O2 -","- C84 H112 N8 O8 -","4","1","HR1007","Lisgarten, D. R.; Palmer, R. A.; Maes, D.; Lisgarten, J.; Wyns, L.","Two Steroidal Epimers, (5β,17α)-Pregna-20-yno[3,4-<i>c</i>][1,2,5]oxadiazol-17-ol (the 5β-Epimer) and (5α,17α)-Pregna-20-yno[3,4-<i>c</i>][1,2,5]oxadiazol-17-ol (the 5α-Epimer)","Acta Crystallographica Section C","1995","51","4","666","670","10.1107/S0108270194007237","","","1.5418","CuKα","","","0.042","","","0.05","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003349","8.205","0.002","14.321","0.005","12.838","0.004","90","","107.73","0.02","90","","1436.9","0.8","293","","","","","","","","","","Phillips (1959)","4","P 1 21/a 1","-P 2yab","14","","","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C68 H56 N8 O8 -","4","1","HR1008","Özbey, S.; Kendi, E.; İde, S.; Mak, T. C. W.","2-Methyl-2-(2-methylphenylazo)-1,3-indandione","Acta Crystallographica Section C","1995","51","4","707","709","10.1107/S010827019400867X","","","0.71073","MoKα","","","0.0529","","","0.0565","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003350","7.383","0.001","11.045","0.002","11.253","0.002","92.68","0.02","90.38","0.02","95.93","0.02","911.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","1:1 molecular complex of 2,3,4,5,6-pentafluoro-trans-cinnamic acid and 4-(N,N-dimethylamino)-trans-cinnamic acid","","","- C20 H16 F5 N O4 -","- C20 H16 F5 N O4 -","- C40 H32 F10 N2 O8 -","2","1","HR1028","Goud, B. S.; Reddy, P. K.; Panneerselvam, K.; Desiraju, G. R.","1:1 Molecular Complex of 2,3,4,5,6-Pentafluoro-<i>trans</i>-cinnamic Acid and 4-(<i>N</i>,<i>N</i>-Dimethylamino)-<i>trans</i>-cinnamic Acid","Acta Crystallographica Section C","1995","51","4","683","685","10.1107/S0108270194007894","","","0.71073","MoKα","","0.0479","0.0329","","0.0919","0.0875","","","","0.909","1.064","1.064","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003351","13.945","0.008","6.751","0.008","19.326","0.003","90","","101.4","0.9","90","","1784","6","293","","","","","","","","","","From layering a solution of (I) in CHCl~3~ with petroleum (333-363 K)--piperidine","4","P 1 21/n 1","-P 2yn","14","","","","- C44 H26 Br4 N4 -","- C44 H26 Br4 N4 -","- C88 H52 Br8 N8 -","2","0.5","HU1026","Zou, J.-Z.; Xu, Z.; Li, M.; You, X.-Z.; Wang, H.-Q.","7,8,17,18-Tetrabromo-5,10,15,20-tetraphenylporphyrin, C~44~H~26~Br~4~N~4~","Acta Crystallographica Section C","1995","51","4","760","761","10.1107/S0108270194000053","","","0.71073","MoKα","","","0.074","","","0.081","","","","","3.89","3.89","","","","","has coordinates","204127","2020-10-21","18:00:00",""
"2003352","9.475","0.001","8.57","0.001","9.194","0.001","90","","97.43","0.009","90","","740.29","0.14","293","","","","","","","","","","recrystallized from CH~2~Cl~2~","4","P 1 21/a 1","-P 2yab","14","","","","- C8 H16 I2 S4 -","- C8 H12 I2 S4 -","- C16 H24 I4 S8 -","2","0.5","HU1090","Baker, P. K.; Harris, S. D.; Durrant, M. C.; Hughes, D. L.; Richards, R. L.","Preparation and Structural Characterization of the Charge-Transfer Complex (12[ane]S~4~.I~2~)~{∞~} (12[ane]S~4~ = 1,4,7,10-Tetrathiacyclododecane)","Acta Crystallographica Section C","1995","51","4","697","700","10.1107/S0108270194010267","","","0.71069","MoKα","","","0.047","","","0.061","","","","","0.66","0.66","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003353","7.221","0.002","7.262","0.001","14.67","0.002","76.97","0.01","82.28","0.01","79.4","0.01","733.2","0.3","150","2","150","2","","","","","","","Synthesis at Dept of Physics, Univ. of Durham","3","P -1","-P 1","2","Z-β-(1-diethylmethylimmonium)-α-cyano-4-styryldicyanomethanide","","","- C17 H16 N4 -","- C17 H16 N4 -","- C34 H32 N8 -","2","1","HU1101","Cole, J. C.; Howard, J. A. K.; Cross, G. H.; Szablewski, M.","(<i>Z</i>)-{4-[1-Cyano-3-(diethyliminio)-1-propenyl]phenyl}dicyanomethanide, a Novel `Blue Window' Zwitterionic Molecule for Non-Linear Optics","Acta Crystallographica Section C","1995","51","4","715","718","10.1107/S0108270194006487","","","0.71073","MoKα","","0.0965","0.0417","","0.0866","0.0729","","","","1.181","1.28","1.28","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003354","10.06","0.002","19.793","0.004","10.251","0.002","90","","118.9","0.1","90","","1787","1.8","20","","","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C28 H50 Cl2 N2 O8 Ru2 S2 -","- C28 H50 Cl2 N2 O8 Ru2 S2 -","- C56 H100 Cl4 N4 O16 Ru4 S4 -","2","1","HU1111","Capper, G.; Davies, D. L.; Fawcett, J.; Russell, D. R.","[(η^6^-C~6~H~3~Me~3~)Ru(D-pen)]~2~Cl~2~.4H~2~O","Acta Crystallographica Section C","1995","51","4","578","580","10.1107/S0108270194010218","","","0.7107","MoKα","","","0.0406","","","0.0434","","","","","1.096","1.096","","","","","has coordinates","191022","2020-10-21","18:00:00",""
"2003355","8.563","0.003","21.871","0.001","27.728","0.011","90","","90","","90","","5193","3","150","","150","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Tetrakis(acetonitrile)copper(I) hexafluorophosphate(V) Acetonitrile solvate (1/1)","","- C10 H15 Cu F6 N5 P -","- C10 H15 Cu F6 N5 P -","- C120 H180 Cu12 F72 N60 P12 -","12","3","HU1132","Black, J. R.; Levason, W.; Webster, M.","Tetrakis(acetonitrile-<i>N</i>)copper(I) Hexafluorophosphate(V) Acetonitrile Solvate","Acta Crystallographica Section C","1995","51","4","623","625","10.1107/S0108270194012527","","","0.71069","MoKα","","","0.0539","","","0.0678","","","","","1.09","1.09","","","","","has coordinates","288350","2023-12-15","17:45:49",""
"2003356","9.684","0.002","12.764","0.002","16.773","0.003","76.84","0.01","75.11","0.01","71.03","0.01","1871.1","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Octacarbonyl-μ-hydrido-dimanganese-μ~3~-cyclohexylphosphanido-gold-tri- cyclohexylphosphine","","- C32 H45 Au Mn2 O8 P2 -","- C32 H45 Au Mn2 O8 P2 -","- C64 H90 Au2 Mn4 O16 P4 -","2","1","JZ1018","Flörke, U.; Haupt, H.-J.","Octacarbonyl-1κ^4^<i>C</i>,2κ^4^<i>C</i>-μ~3~-[cyclohexylphosphanido(2-)]-μ-hydrido-1:2κ^2^<i>H</i>-tricyclohexylphosphine-3κ<i>P</i>-golddimanganese(<i>Mn</i>—<i>Mn</i>)","Acta Crystallographica Section C","1995","51","4","573","575","10.1107/S0108270194011522","","","0.71073","MoKα","","0.0574","0.0397","","0.0935","0.0852","","","","1.022","1.039","1.039","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003357","19.053","0.006","11.451","0.003","19.309","0.003","90","","96.62","0.02","90","","4184.7","1.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H25 N3 O -","- C25 H25 N3 O -","- C200 H200 N24 O8 -","8","1","KA1084","Böcskei, Z.; Simon, K.; Örfi, L.; Kökösi, J.","Two Antithrombotic Quinazolone Derivatives","Acta Crystallographica Section C","1995","51","4","723","726","10.1107/S0108270194003938","","","1.5418","CuKα","","0.1066","0.0578","","0.2101","0.1641","","","","1.041","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003358","7.423","0.001","20.54","0.001","9.1829","0.0007","90","","101.448","0.008","90","","1372.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H15 N3 O -","- C17 H15 N3 O -","- C68 H60 N12 O4 -","4","1","KA1084","Böcskei, Z.; Simon, K.; Örfi, L.; Kökösi, J.","Two Antithrombotic Quinazolone Derivatives","Acta Crystallographica Section C","1995","51","4","723","726","10.1107/S0108270194003938","","","1.5418","CuKα","","0.0657","0.053","","0.1602","0.1454","","","","1.122","1.167","1.167","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003359","8.8937","0.0006","7.7404","0.0006","9.5873","0.0006","90","","91.528","0.009","90","","659.76","0.08","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","7,7-Dibromo-3-dibromomethylene-2,2-dimethyl-1-hydroxy-8,9,10,trinorbornane","","- C10 H12 Br4 O -","- C10 H12 Br4 O -","- C20 H24 Br8 O2 -","2","1","KA1095","Kubicki, M.; Dutkiewicz, G.; Antkowiak, W. Z.","7,7-Dibromo-3-dibromomethylene-2,2-dimethylnorbornan-1-ol","Acta Crystallographica Section C","1995","51","4","736","738","10.1107/S0108270194009406","","","1.54178","CuKα","","0.033","0.0329","","0.091","0.0909","","","","1.094","1.094","1.094","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003360","8.756","0.004","14.611","0.006","18.979","0.008","90","","101.21","0.04","90","","2381.7","1.8","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(1,10-phenanthroline)bis(dicyanamide)copper(II)","","- C28 H16 Cu N10 -","- C28 H16 Cu N10 -","- C112 H64 Cu4 N40 -","4","1","KA1097","Potočňák, I.; Dunaj-Jurčo, M.; Mikloš, D.; Kabešová, M.; Jäger, L.","Bis(dicyanamide)bis(1,10-phenanthroline)copper(II)","Acta Crystallographica Section C","1995","51","4","600","602","10.1107/S0108270194012084","","","0.71069","MoKα","","0.1193","0.0405","","0.1177","0.0933","","","","0.686","0.79","0.79","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003361","7.353","0.009","10.805","0.007","9.959","0.011","90","","93.2","0.1","90","","790","1.4","148","2","148","2","","","","","","","slow evaporation from hexane","3","P 1 21 1","P 2yb","4","diosphenol","(Z)-12-hydroxy-14,15-dinorlabda-8(17),11-dien-13-one","","- C18 H28 O2 -","- C18 H28 O2 -","- C36 H56 O4 -","2","1","KH1019","Grant, P. K.; Hanton, L. R.; Wong, G.","(<i>Z</i>)-12-Hydroxy-14,15-dinorlabda-8(17),11-dien-13-one, C~18~H~28~O~2~","Acta Crystallographica Section C","1995","51","4","743","744","10.1107/S0108270194014551","","","0.71069","MoKα","","0.0683","0.0517","","0.1464","0.1357","","","","0.973","1.02","1.02","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003362","9.672","0.002","11.69","0.002","19.184","0.004","90","","95.12","0.02","90","","2160.4","0.7","293","","","","","","","","","","Crystallized from acetonitrile","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 N5 O0.5 -","- C10 H12 N5 O0.5 -","- C80 H96 N40 O4 -","8","2","LI1108","Janes, R. W.; Palmer, R. A.","3,5-Diamino-6-(2-methylphenyl)-1,2,4-triazine Monohydrate: an Analogue of Lamotrigine","Acta Crystallographica Section C","1995","51","4","685","688","10.1107/S0108270194009352","","","1.54178","CuKα","","","0.0566","","","0.0767","","","","","1.37","1.37","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003363","8.236","0.003","14.967","0.004","24.032","0.005","90","","90","","90","","2962.4","1.5","293","","293","","","","","","","","recrystallized from a mixture of chloroform and ethanol","4","P 21 21 21","P 2ac 2ab","19","","P-chlorophenyl-3,4,6-tri-O-benzyl-2-deoxy-2-methylene-β-D-glucopyranoside","","- C34 H33 Cl O5 -","- C34 H33 Cl O5 -","- C136 H132 Cl4 O20 -","4","1","LI1117","Kabaleeswaran, V.; Rajan, S. S.; Booma, C.; Balasubramanian, K. K.","<i>p</i>-Chlorophenyl 3,4,6-Tri-<i>O</i>-benzyl-2-deoxy-2-methylene-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section C","1995","51","4","758","759","10.1107/S0108270194010711","","","1.5418","CuKα","","0.071","0.042","","0.085","0.047","","","","0.65","0.62","0.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003364","10.648","0.002","12.589","0.003","18.594","0.004","90","","90","","90","","2492.5","0.9","233","","233","","","","","","","","synthesized at UMIST","5","P b c a","-P 2ac 2ab","61","","1-Trifluoroacetyl-3-trifluoromethyl-3a,8b-dihydro-1H,4H-indeno[1,2-c]pyrazole","","- C13 H8 F6 N2 O -","- C13 H8 F6 N2 O -","- C104 H64 F48 N16 O8 -","8","1","LI1130","Abdul-Ghani, M.; Pritchard, R. G.; Tipping, A. E.","1-Trifluoroacetyl-3-trifluoromethyl-3a,8b-dihydro-1<i>H</i>,4<i>H</i>-indeno[1,2-<i>c</i>]pyrazole","Acta Crystallographica Section C","1995","51","4","770","772","10.1107/S0108270194011881","","","0.71069","MoKα","","","0.0387","","","0.0458","","","","","1.15","1.15","","","","","has coordinates,has disorder","200173","2020-10-21","18:00:00",""
"2003365","7.447","0.001","10.387","0.002","30.082","0.01","90","","90","","90","","2326.9","0.9","298","","","","","","","","","","synthesis","5","P 21 n b","P -2bc 2a","33","","","","- C14 H36 Cl4 N2 Zn -","- C14 H36 Cl4 N2 Zn -","- C56 H144 Cl16 N8 Zn4 -","4","1","MU1079","Guo, N.; Lin, Y.-H.; Xi, S.-Q.","Bis(<i>n</i>-heptylammonium) Tetrachlorozincate","Acta Crystallographica Section C","1995","51","4","617","619","10.1107/S0108270194009248","","","0.71073","MoKα","","","0.053","","","0.045","","","","","1.181","1.181","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003366","9.601","0.002","13.69","0.002","14.808","0.002","90","","100.83","0.01","90","","1911.7","0.6","183","","","","","","","","","","crystallization from hexane","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H32 N Ti -","- C20 H32 N Ti -","- C80 H128 N4 Ti4 -","4","1","MU1104","Brady, E.; Telford, J. R.; Mitchell, G.; Lukens, W.","Amidobis(pentamethylcyclopentadienyl)titanium(III)","Acta Crystallographica Section C","1995","51","4","558","560","10.1107/S0108270194005792","","","0.71073","MoKα","","","0.0353","","","0.0447","","","","","1.988","1.988","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003367","6.179","0.001","11.534","0.001","11.609","0.002","90","","95.79","0.01","90","","823.1","0.2","290","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H20 N2 Ni S4 -","- C10 H20 N2 Ni S4 -","- C20 H40 N4 Ni2 S8 -","2","0.5","MU1109","Selvaraju, R.; Panchanatheswaran, K.; Thiruvalluvar, A.; Parthasarathi, V.","Redetermination of Bis(<i>N</i>,<i>N</i>-diethyldithiocarbamato)nickel(II)","Acta Crystallographica Section C","1995","51","4","606","608","10.1107/S0108270194010292","","","0.71073","MoKα","","","0.032","","","0.033","","","","","0.61","0.61","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003368","12.835","0.003","17.596","0.003","16.015","0.003","90","","90","","90","","3616.9","1.2","298","","","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C26 H44 Cl4 O2 P2 Pt2 S2 -","- C26 H44 Cl4 O2 P2 Pt2 S2 -","- C104 H176 Cl16 O8 P8 Pt8 S8 -","4","0.5","MU1113","Francisco, R. H. P.; Gambardella, M. T. P.; Rodrigues, A. M. G. D.; de Souza, G. F.; Filgueiras, C. A. L.","The Dimer [PtCl~2~{P(C~2~H~5~)~3~}{(C~6~H~5~)SOCH~2~}]~2~","Acta Crystallographica Section C","1995","51","4","604","606","10.1107/S0108270194009108","","","0.71069","MoKα","","","0.0383","","","0.0428","","","","","0.89","0.89","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003369","11.925","0.001","13.293","0.003","16.314","0.002","90","","99.21","0.01","90","","2552.7","0.7","295","","","","","","","","","","from CH~2~Cl~2~/hexane","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H24 Cl2 P2 Pd -","- C26 H24 Cl2 P2 Pd -","- C104 H96 Cl8 P8 Pd4 -","4","1","MU1120","Singh, S.; Jha, N. K.; Narula, P.; Singh, T. P.","<i>cis</i>-Dichloro[bis(diphenylphosphino)ethane]palladium(II)","Acta Crystallographica Section C","1995","51","4","593","595","10.1107/S0108270194007560","","","1.5418","CuKα","","","0.084","","","0.084","","","","","3.22","3.22","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003370","8.931","0.002","11.303","0.006","9.143","0.002","90","","103.47","0.02","90","","897.6","0.6","293","1","","","","","","","","","Slow diffusion of water into a methanol solution at 277 K","4","P 1 21/m 1","-P 2yb","11","","","","- C11 H24 B10 Si -","- C11 H24 B10 Si -","- C22 H48 B20 Si2 -","2","0.5","MU1122","McGrath, T. D.; Welch, A. J.","Steric Effects in Heteroboranes. V. 1-Ph-2-Me~3~Si-1,2-<i>closo</i>-C~2~B~10~H~10~","Acta Crystallographica Section C","1995","51","4","651","654","10.1107/S010827019400908X","","","0.71069","MoKα","","","0.0643","","","0.0892","","","","","1.341","1.341","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003371","9.3854","0.0019","10.2938","0.0026","13.061","0.005","68.607","0.025","70.281","0.024","64.998","0.017","1039.4","0.6","293","1","","","","","","","","","slow diffusion of water into a methanol solution at 277K","4","P -1","-P 1","2","","","","- C14 H30 B10 Si -","- C14 H30 B10 Si -","- C28 H60 B20 Si2 -","2","1","MU1123","McGrath, T. D.; Welch, A. J.","Steric Effects in Heteroboranes. VI. 1-Ph-2-^<i>t^</i>BuMe~2~Si-1,2-<i>closo</i>-C~2~B~10~H~10~","Acta Crystallographica Section C","1995","51","4","654","657","10.1107/S0108270194009078","","","0.71069","MoKα","","","0.0836","","","0.0939","","","","","1.351","1.351","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003372","10.076","0.001","11.372","0.001","10.571","0.001","90","","100.33","0.02","90","","1191.6","0.2","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 Cu N2 O6 -","- C12 H10 Cu N2 O6 -","- C48 H40 Cu4 N8 O24 -","4","1","MU1125","Ravikumar, K.; Swamy, G. Y. S. K.; Venkata Lakshmi, N.","Structure of a Coordination Polymer Reminiscent of the Pleated Sheets Observed in Polypeptides: Diaqua(2,2'-bipyridine-3,3'-dicarboxylato)copper(II)","Acta Crystallographica Section C","1995","51","4","608","611","10.1107/S0108270194009789","","","0.71069","MoKα","","","0.048","","","0.045","","","","","1.47","1.47","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003373","7.997","0.004","9.746","0.006","10.979","0.002","78.87","0.03","70.26","0.03","79.48","0.04","783.8","0.7","296","","","","","","","","","","","7","P -1","-P 1","2","","","","- C26 H34 N2 Ni O4 P2 S4 -","- C26 H34 N2 Ni O4 P2 S4 -","- C26 H34 N2 Ni O4 P2 S4 -","1","0.5","MU1127","Huang, X.-Y.; Xiong, R.-G.; Dong, J.-X.; You, X.-Z.","<i>trans</i>-Bis(<i>O</i>,<i>O</i>'-diethyl dithiophosphato-κ2<i>S</i>,<i>S</i>')bis(isoquinoline-κ<i>N</i>)nickel(II)","Acta Crystallographica Section C","1995","51","4","598","600","10.1107/S0108270194011327","","","0.71069","MoKα","","","0.049","","","0.066","","","","","1.84","1.84","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003374","17.519","0.002","7.1971","0.0008","25.835","0.003","90","","90.487","0.011","90","","3257.3","0.6","240","2","240","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H39 O18 S3 Ti -","- C21 H29 O18 S3 Ti -","- C84 H116 O72 S12 Ti4 -","4","1","MU1139","Aquino, M. A. S.; Clegg, W.; Liu, Q.-T.; Sykes, A. G.","Hexaaquatitanium(III) Tris(<i>p</i>-Toluenesulfonate) Trihydrate","Acta Crystallographica Section C","1995","51","4","560","562","10.1107/S0108270194010826","","","0.71073","MoKα","","0.1138","0.0656","","0.228","0.1722","","","","1.049","1.048","1.048","","","","","has coordinates,has Fobs","209447","2020-10-21","18:00:00",""
"2003375","7.0278","0.0003","10.855","0.0005","15.6339","0.0007","90","","90","","90","","1192.66","0.09","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H7 Cl3 N2 O3 -","- C9 H7 Cl3 N2 O3 -","- C36 H28 Cl12 N8 O12 -","4","1","MU1141","Clegg, W.; Pogue, H. J.; Lowe, M. P.; Butterfield, I. M.; Jackson, R. F. W.","<i>p</i>-Nitrobenzyl Trichloroacetimidate","Acta Crystallographica Section C","1995","51","4","741","743","10.1107/S0108270194010838","","","0.71073","MoKα","","0.0251","0.0228","","0.0623","0.0597","","","","1.041","1.031","1.031","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003376","12.636","0.003","12.636","0.003","12.636","0.003","90","","90","","90","","2017.6","0.8","153","0.2","153","0.2","","","","","","","The title compound was prepared according to the literature method (Fischer & Boltcher, 1957) and well-formed colourless octahedral crystals were grown by slow evaporation from nitromethane at room temperature.","5","P a -3","-P 2ac 2ab 3","205","","Bis(η^6^-1,3,5-trimethylbenzene)ruthenium(II) tetrafluoroborate","","- C18 H24 B2 F8 Ru -","- C18 H24 B2 F8 Ru -","- C72 H96 B8 F32 Ru4 -","4","0.166667","MU1142","Blake, A. J.; Dyson, P. J.; Gould, R. O.; Johnson, B. F. G.; Parsons, S.","The Twinned Crystal Structure of Bis(η^6^-mesitylene)ruthenium(II) Tetrafluoroborate at 150 K","Acta Crystallographica Section C","1995","51","4","582","584","10.1107/S0108270194010206","","","0.71073","MoKα","","0.0601","0.0412","","0.182","0.1102","","","","1.171","1.056","1.056","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003377","12.0761","0.0006","12.2729","0.0006","21.0414","0.0014","90","","90","","90","","3118.5","0.3","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C28 H28 N4 O8 Zn2 -","- C28 H28 N4 O8 Zn2 -","- C112 H112 N16 O32 Zn8 -","4","0.5","MU1144","Clegg, W.; Hunt, P. A.; Straughan, B. P.","Contrasting Structures of Two Adducts of Zinc Crotonate with Substituted Pyridines","Acta Crystallographica Section C","1995","51","4","613","617","10.1107/S0108270194011315","","","0.71073","MoKα","","0.0418","0.0288","","0.084","0.074","","","","1.062","1.051","1.051","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003378","10.343","0.002","18.329","0.003","9.671","0.002","90","","117.38","0.02","90","","1628","0.6","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 N O4 Zn -","- C15 H17 N O4 Zn -","- C60 H68 N4 O16 Zn4 -","4","1","MU1144","Clegg, W.; Hunt, P. A.; Straughan, B. P.","Contrasting Structures of Two Adducts of Zinc Crotonate with Substituted Pyridines","Acta Crystallographica Section C","1995","51","4","613","617","10.1107/S0108270194011315","","","0.71073","MoKα","","0.0899","0.0396","","0.1129","0.0851","","","","1.078","1.066","1.066","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2003379","21.47","0.006","16.765","0.002","9.6155","0.0014","90","","90","","90","","3461","1.2","150","0.2","150","0.2","","","","","","","","7","P n a 21","P 2c -2n","33","","Bis(triphenylphosphine)iminium Tetrachloro-oxo-molybdenum(V)","","- C36 H30 Cl4 Mo N O P2 -","- C36 H30 Cl4 Mo N O P2 -","- C144 H120 Cl16 Mo4 N4 O4 P8 -","4","1","MU1151","Blake, A. J.; Parsons, S.; Downs, A. J.; Limberg, C.","Bis(triphenylphosphine)iminium Tetrachlorooxomolybdenum(V) at 150 K","Acta Crystallographica Section C","1995","51","4","571","573","10.1107/S0108270194011303","","","0.71073","MoKα","","0.0546","0.0422","","0.0872","0.078","","","","1.082","1.049","1.049","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003380","29.835","0.005","19.784","0.002","9.913","0.001","90","","90","","90","","5851.2","1.3","293","","","","","","","","","","Slow evaporation from benzene and acetonitrile solution","4","P 21 21 21","P 2ac 2ab","19","","","","- C52 H78 N10 O11 -","- C52 H71 N10 O11 -","- C208 H284 N40 O44 -","4","1","NA1092","Saviano, M.; Rossi, F.; Filizola, M.; Di Blasio, B.; Pedone, C.","[Aib^5,6^-<small>D</small>-Ala^8^]-Cyclolinopeptide A, Grown from a Benzene/Acetonitrile Mixture","Acta Crystallographica Section C","1995","51","4","663","666","10.1107/S0108270194006864","","","1.54056","CuKα","","","0.068","","","0.071","","","","","2.18","2.18","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003381","16.031","0.003","16.036","0.002","16.821","0.003","90","","113.74","0.01","90","","3958.3","1.2","294","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C9 H23 Cl4 O3 Rh S3 -","- C9 H23 Cl4 O3 Rh S3 -","- C72 H184 Cl32 O24 Rh8 S24 -","8","2","NA1100","Calligaris, M.; Faleschini, P.","Dimethylacetonylsulfonium Tetrachlorobis(dimethyl sulfoxide-<i>S</i>)rhodate(III)","Acta Crystallographica Section C","1995","51","4","588","591","10.1107/S0108270194010425","","","0.71069","MoKα","","","0.033","","","0.035","","","","","0.389","0.389","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003382","9.386","0.001","27.912","0.003","9.463","0.001","90","","115.27","0.02","90","","2241.9","0.6","295","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H26 N4 O5 -","- C23 H26 N4 O5 -","- C92 H104 N16 O20 -","4","2","NA1107","Didierjean, C.; Aubry, A.; Zouikri, M.; Boussard, G.; Marraud, M.","Z-AzPro-AzPro-OBzl","Acta Crystallographica Section C","1995","51","4","688","690","10.1107/S0108270194012436","","","1.54056","CuKα","","","0.031","","","0.035","","","","","2.37","2.37","","","","","has coordinates","198394","2020-10-21","18:00:00",""
"2003383","10.319","0.001","12.716","0.001","13.9132","0.0007","109.841","0.005","100.207","0.006","101.96","0.008","1618.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dibromobis(4-metoxyphenyl)tellurium(IV)","","- C14 H14 Br2 O2 Te -","- C14 H14 Br2 O2 Te -","- C56 H56 Br8 O8 Te4 -","4","2","NA1109","Farran, J.; Alvarez-Larena, A.; Piniella, J. F.; Germain, G.; Torres-Castellanos, L.","Dibromobis(4-methoxyphenyl)tellurium(IV)","Acta Crystallographica Section C","1995","51","4","639","641","10.1107/S0108270194007122","","","0.71069","MoKα","","0.0592","0.0311","","0.08","0.0776","","","","1.002","1.229","1.229","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003384","15.976","0.004","16.627","0.004","23.67","0.006","90.08","0.02","89.97","0.02","69.16","0.02","5876","3","230","2","230","2","","","","","","","","7","P -1","-P 1","2","","tris[2,3-di(trimethylsilyl)-2,3-dicarba-1-lithia-closo- heptaborane-1κO;4κTb;5κ^2^Tb;6κTb]-tris[2,3-di(trimethylsilyl)-2,3-dicarba- 1-terba-closo-heptaborane-1κO';1κ^4^B;4κLi;5κ^2^Li;6κLi]-tris-μ~4~- tetrahydrofuranyllithium-μ~3~-methoxy-μ~3~-oxide","","- C67 H165 B24 Li6 O5 Si12 Tb3 -","- C67 H165 B24 Li6 O5 Si12 Tb3 -","- C134 H330 B48 Li12 O10 Si24 Tb6 -","2","1","NA1110","Zhang, H.; Oki, A. R.; Wang, Y.; Maguire, J. A.; Hosmane, N. S.","A Trinuclear Terbium(III)‒Carborane Cluster, [C~61~H~159~B~24~Li~6~O~5~Si~12~Tb~3~].C~6~H~6~","Acta Crystallographica Section C","1995","51","4","635","638","10.1107/S0108270194008164","","","0.71073","MoKα","","0.0332","0.0289","","0.0793","0.0737","","","","1.025","1.055","1.055","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003385","5.518","0.001","13.059","0.005","18.246","0.004","90","","90","","90","","1314.8","0.6","298","","","","","","","","","","from methanolic solution","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 N2 O4 -","- C13 H20 N2 O4 -","- C52 H80 N8 O16 -","4","1","NA1115","Bombieri, G.; Del Pra, A.; Ayala, D. J.; Stradi, R.; Mantovanini, M.","(<i>S</i>)-({-})-3-(4-Phenyl-1-piperazinyl)-1,2-propanediol <i>N</i>,<i>N</i>'-Dioxide","Acta Crystallographica Section C","1995","51","4","642","644","10.1107/S0108270194012278","","","0.71069","MoKα","","","0.03","","","0.033","","","","","0.59","0.59","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003386","12.653","0.001","11.233","0.001","11.388","0.001","90","","98.4","0.01","90","","1601.2","0.2","295","2","295","2","","","","","","","chemical synthesis (Sannicol\`o, 1994).","3","P 1 21/c 1","-P 2ybc","14","","4H-cyclopenta[2,1-b;3,4-b']dithiophene","","- C9 H6 S2 -","- C9 H6 S2 -","- C72 H48 S16 -","8","2","NA1119","Pilati, T.","Five 3,3'-Bridged 2,2'-Dithiophenes","Acta Crystallographica Section C","1995","51","4","690","697","10.1107/S0108270194010516","","","0.71073","MoKα","","","0.031","","","0.035","","","","","1.951","1.951","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2003387","21.792","0.004","21.792","0.004","12.566","0.002","90","","90","","120","","5168","1.6","295","2","295","2","","","","","","","chemical synthesis (Sannicol\'o, 1994).","3","P -3","","","","spiro-[4H-cyclopenta[2,1-b:3,4-b']dithiophene-4,1'-cyclopentane]","","- C13 H12 S2 -","- C13 H12 S2 -","- C234 H216 S36 -","18","3","NA1119","Pilati, T.","Five 3,3'-Bridged 2,2'-Dithiophenes","Acta Crystallographica Section C","1995","51","4","690","697","10.1107/S0108270194010516","","","0.71073","MoKα","","","0.034","","","0.035","","","","","1.654","1.654","","","","","has coordinates","266226","2021-06-07","13:35:46",""
"2003388","14.03","0.002","9.009","0.002","16.306","0.005","90","","113.49","0.02","90","","1890.2","0.8","295","2","295","2","","","","","","","chemical synthesis (Sannicol\`o, 1994).","4","P 1 21/c 1","-P 2ybc","14","","4H,6H-dithieno[3,2-c:2',3'-e]oxepine","","- C10 H8 O S2 -","- C10 H8 O S2 -","- C80 H64 O8 S16 -","8","2","NA1119","Pilati, T.","Five 3,3'-Bridged 2,2'-Dithiophenes","Acta Crystallographica Section C","1995","51","4","690","697","10.1107/S0108270194010516","","","0.71073","MoKα","","","0.032","","","0.036","","","","","1.841","1.841","","","","","has coordinates","266226","2021-06-07","13:35:46",""
"2003389","7.643","0.002","24.604","0.003","7.767","0.001","90","","115.29","0.02","90","","1320.6","0.5","295","2","295","2","","","","","","","chemical synthesis (Sannicoló, 1994).","4","P 1 21/n 1","-P 2yn","14","","6H-4,7,8,10-tetrahydrodithieno[3,2-g,2',3'-i][1,4]dioxacycloundecine,","","- C13 H14 O2 S2 -","- C13 H14 O2 S2 -","- C52 H56 O8 S8 -","4","1","NA1119","Pilati, T.","Five 3,3'-Bridged 2,2'-Dithiophenes","Acta Crystallographica Section C","1995","51","4","690","697","10.1107/S0108270194010516","","","0.71073","MoKα","","","0.032","","","0.038","","","","","2.097","2.097","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003390","7.999","0.001","12.06","0.002","14.93","0.002","90","","102.46","0.01","90","","1406.3","0.4","295","2","295","2","","","","","","","chemical synthesis (Sannicoló, 1994).","4","P 1 21/n 1","-P 2yn","14","","4,6,7,9,10,12-hexahydrodithieno[3,2-c;2',3'-e][1,4,7]trioxacyclotridecine","","- C14 H16 O3 S2 -","- C14 H16 O3 S2 -","- C56 H64 O12 S8 -","4","1","NA1119","Pilati, T.","Five 3,3'-Bridged 2,2'-Dithiophenes","Acta Crystallographica Section C","1995","51","4","690","697","10.1107/S0108270194010516","","","0.71073","MoKα","","","0.035","","","0.046","","","","","2.024","2.024","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003391","14.168","0.002","13.323","0.002","19.47","0.003","90","","106.72","0.01","90","","3519.8","0.9","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H19 F24 N S Sn -","- C31 H19 F24 N S Sn -","- C124 H76 F96 N4 S4 Sn4 -","4","1","NA1120","Freitag, S.; Herbst-Irmer, R.; Ahlemann, J. T.; Roesky, H. W.","{<i>N</i>-(1-Adamantyl)[(pentafluoro-2-propenyl)thio]-amino}(fluoro)bis[2,4,6-tris(trifluoromethyl)phenyl]tin at 153K","Acta Crystallographica Section C","1995","51","4","631","633","10.1107/S0108270194011996","","","0.71073","MoKα","","0.063","0.0422","","0.1022","0.0895","","","","1.034","1.05","1.05","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2003392","10.206","0.002","9.692","0.001","24.498","0.001","90","","91.91","0.02","90","","2421.9","0.5","293","","293","","","","","","","","Janssen Research Foundation, Beerse, Belgium","5","P 1 21/c 1","-P 2ybc","14","","2-Methylthio-10,11-dihydro-11-(4-methylpiperazin-1-yl)dibenzo[b,f]thiepine maleic acid","","- C24 H28 N2 O4 S2 -","- C24 H28 N2 O4 S2 -","- C96 H112 N8 O16 S8 -","4","1","NA1122","Blaton, N. M.; Peeters, O. M.; De Ranter, C. J.","2-Methylthio-10,11-dihydro-11-(4-methylpiperazin-1-yl)dibenzo[<i>b</i>,<i>f</i>]thiepine Maleic Acid (Metitepine Maleate)","Acta Crystallographica Section C","1995","51","4","777","780","10.1107/S0108270194011637","","","1.54184","CuKα","","0.0674","0.0478","","0.173","0.1492","","","","1.051","1.066","1.066","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003393","18.06","0.002","10.716","0.001","22.338","0.002","90","","112.89","0.02","90","","3982.7","0.9","295","","295","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","1,2-Bis-crown-5-calix [4] arene","","- C44 H52 O10 -","- C44 O10 -","- C176 O40 -","4","1","PA1099","Pèpe, G.; Astier, J.-P.; Estienne, J.; Bressot, C.; Asfari, Z.; Vicens, J.","1,2-Bis-crown-5-calix[4]arene","Acta Crystallographica Section C","1995","51","4","726","729","10.1107/S0108270194002994","","","1.5416","CuKα","","0.11","0.11","","0.11","0.11","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003394","7.799","0.001","8.132","0.002","8.823","0.001","99.48","0.01","93.84","0.01","117.02","0.02","485.24","0.17","293","","","","","","","","","","\'evaporation d'une solution aqueuse","6","P -1","-P 1","2","","","","- C10 H24 Cl4 N4 Pd S2 -","- C10 H24 Cl4 N4 Pd S2 -","- C10 H24 Cl4 N4 Pd S2 -","1","0.5","PA1105","Viossat, B.; Nguyen-Huy, D.; Rodier, N.","Isotypie Entre les Structures Cristallines des Tétrachlorocuprate(II) et Tétrachloropalladate(II) de <i>S</i>,<i>S</i>'-(Octane-1,8-diyle)bis(thiouronium)","Acta Crystallographica Section C","1995","51","4","628","629","10.1107/S0108270194007432","","","0.7107","MoKᾱ","","","0.023","","","0.029","","","","","1.17","1.17","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003395","31.1","0.01","9.452","0.005","9.507","0.004","90","","90","","90","","2795","2","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C28 H30 O10 -","- C28 H30 O10 -","- C112 H120 O40 -","4","1","PA1115","Cousson, A.; Dancy, I.; Beau, J.-M.","(1<i>R</i>)-4,5-Benzocyclodeca-4-ene-2,6-diyn-1-yl 2,3,4,6-Tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside and 4,5-Benzocyclodeca-4-ene-2,6-diyn-1-one","Acta Crystallographica Section C","1995","51","4","718","721","10.1107/S0108270194008048","","","1.5418","CuKα","","","0.065","","","0.078","","","","","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003396","18.548","0.009","11.886","0.005","9.393","0.003","90","","90","","90","","2070.8","1.5","293","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C14 H10 O -","- C14 H10 O -","- C112 H80 O8 -","8","1","PA1115","Cousson, A.; Dancy, I.; Beau, J.-M.","(1<i>R</i>)-4,5-Benzocyclodeca-4-ene-2,6-diyn-1-yl 2,3,4,6-Tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside and 4,5-Benzocyclodeca-4-ene-2,6-diyn-1-one","Acta Crystallographica Section C","1995","51","4","718","721","10.1107/S0108270194008048","","","1.5418","CuKα","","","0.048","","","0.028","","","","","1.12","1.12","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003397","7.813","0.002","11.83","0.002","19.022","0.006","90","","100.61","0.03","90","","1728.1","0.8","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-Phenyl-4-oxo-tricyclo-3-aza-10-oxa[5.2.1.0^1,5^]-dec-8-ene- 6-carboxylic acid","","- C17 H19 N O5 S -","- C17 H19 N O5 S -","- C68 H76 N4 O20 S4 -","4","1","PA1143","Pèpe, G.; Reboul, J.-P.; Brun, P.; Zylber, J.","3-Oxo-2-phenyl-3a,4,5,7a-tetrahydro-5,7a-epoxyisoindoline-4-carboxylic Acid in Two Crystalline Phases, Solvated with DMSO and Unsolvated","Acta Crystallographica Section C","1995","51","4","729","732","10.1107/S010827019401142X","","","1.5418","CuKα","","0.044","0.044","","0.044","0.044","","","","0.74","0.74","0.74","","","","","has coordinates","198395","2020-10-21","18:00:00",""
"2003398","16.961","0.005","13.219","0.002","11.598","0.002","90","","81.41","0.02","90","","2571.2","1","293","","293","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","","- C15 H13 N O4 -","- C15 H13 N O4 -","- C120 H104 N8 O32 -","8","1","PA1143","Pèpe, G.; Reboul, J.-P.; Brun, P.; Zylber, J.","3-Oxo-2-phenyl-3a,4,5,7a-tetrahydro-5,7a-epoxyisoindoline-4-carboxylic Acid in Two Crystalline Phases, Solvated with DMSO and Unsolvated","Acta Crystallographica Section C","1995","51","4","729","732","10.1107/S010827019401142X","","","1.5418","CuKα","","0.041","0.041","","0.041","0.041","","","","0.93","0.93","0.93","","","","","has coordinates","218197","2020-10-21","18:00:00",""
"2003399","19.051","0.003","26.274","0.004","9.487","0.003","90","","90","","90","","4748.7","1.8","173","1","173","1","","","","","","","see text","5","P 21 21 21","P 2ac 2ab","19","2,2',3,3'-Tetra-O-benzoyl-6,6'-dideoxy-4,4'-di-O-mesyl- 6,6'-dithiocyanato-α,α-trehalose","2,3-di-O-benzoyl-6-deoxy-4-O-mesyl-6-thiocyanato-α-D-glucoopyranosyl 2,3-di-O-benzoyl-6-deoxy-4-O-mesyl-6-thiocyanato-α-D-glucoopyranoside","","- C44 H40 N2 O17 S4 -","- C44 H40 N2 O17 S4 -","- C176 H160 N8 O68 S16 -","4","1","PA1147","Linden, A.; Lee, C. K.","2,2',3,3'-Tetra-<i>O</i>-benzoyl-6,6'-dideoxy-4,4'-di-<i>O</i>-mesyl-6,6'-dithiocyanato-α,α-trehalose","Acta Crystallographica Section C","1995","51","4","751","754","10.1107/S0108270194011595","","","0.71069","MoKα","","0.0679","0.0373","","0.0423","0.0381","","","","","1.376","1.376","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003400","15.62","0.002","6.887","0.002","13.616","0.002","90","","91.82","0.01","90","","1464","0.5","173","1","173","1","","","","","","","Suitable crystals of the title compound were obtained from aqueous solution.","4","C 1 2/c 1","-C 2yc","15","","N,N-dimethyl-1H-pyrrole-2-carboxamide","","- C7 H10 N2 O -","- C7 H10 N2 O -","- C56 H80 N16 O8 -","8","1","PA1149","Linden, A.; Wright, A. D.; König, G. M.","<i>N</i>,<i>N</i>-Dimethyl-1<i>H</i>-pyrrole-2-carboxamide","Acta Crystallographica Section C","1995","51","4","744","747","10.1107/S0108270194011285","","","0.71069","MoKα","","0.1618","0.0442","","0.0461","0.0353","","","","","1.611","1.611","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2003401","6.771","0.004","7.516","0.002","15.765","0.004","85.19","0.02","80","0.02","79.52","0.04","775.8","0.6","293","2","293","2","","","","","","","crystallisation from dry acetone containing small amounts of methanol","5","P -1","-P 1","2","","N-n-octyl-N,N-dimethylammonio acetic acid bromide","","- C12 H26 Br N O2 -","- C12 H26 Br N O2 -","- C24 H52 Br2 N2 O4 -","2","1","SE1060","Rudert, R.; Schulz, B.; Reck, G.; Vollhardt, D.; Kriwanek, J.","(Carboxymethyl)dimethyloctylammonium Bromide","Acta Crystallographica Section C","1995","51","4","766","768","10.1107/S0108270194006554","","","0.71069","MoKα","","","0.039","","","0.045","","","","","1.604","1.604","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003402","16.154","0.003","16.483","0.006","11.454","0.006","90","","90","","90","","3050","2","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","1,3-bis[(3-dimethylethylammonium)propyl]-1,1,3,3-tetramethyldisiloxan- diperchlorate","","- C18 H46 Cl2 N2 O9 Si2 -","- C18 H46 Cl2 N2 O9 Si2 -","- C72 H184 Cl8 N8 O36 Si8 -","4","0.5","SE1066","Rudert, R.; Schmaucks, G.; Zobel, D.; Strumpel, M.","3,3'-(1,1,3,3,-Tetramethyldisiloxane-1,3-diyl)bis(<i>N</i>-ethyl-<i>N</i>,<i>N</i>-dimethyl-1-propanaminium) Diperchlorate at 163 K and Room Temperature","Acta Crystallographica Section C","1995","51","4","763","766","10.1107/S0108270194008073","","","0.71069","MoKα","","","0.082","","","0.062","","","","","4.02","4.02","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003403","15.676","0.003","16.433","0.005","11.316","0.003","90","","90","","90","","2915","1.3","163","2","163","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","1,3-bis[(3-dimethylethylammonium)propyl]-1,1,3,3-tetramethyldisiloxan- diperchlorate","","- C18 H46 Cl2 N2 O9 Si2 -","- C18 H46 Cl2 N2 O9 Si2 -","- C72 H184 Cl8 N8 O36 Si8 -","4","0.5","SE1066","Rudert, R.; Schmaucks, G.; Zobel, D.; Strumpel, M.","3,3'-(1,1,3,3,-Tetramethyldisiloxane-1,3-diyl)bis(<i>N</i>-ethyl-<i>N</i>,<i>N</i>-dimethyl-1-propanaminium) Diperchlorate at 163 K and Room Temperature","Acta Crystallographica Section C","1995","51","4","763","766","10.1107/S0108270194008073","","","1.54178","CuKα","","","0.06","","","0.045","","","","","2.69","2.69","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003404","15.121","0.002","8.475","0.002","18.357","0.002","90","","105.6","0.02","90","","2265.8","0.7","293","2","293","2","","","","","","","erstmalige Darstellung im st\""ochiometrischen Ansatz aus den Komponenten KI, I~2~, 2.2-Crypt.","6","C 1 2/c 1","-C 2yc","15","Kalium(2.2-Crypt)triiodid","Kalium-1,4,10,13-Tetraoxa-7,16-diazacyclooctadecan-triiodid","","- C12 H26 I3 K N2 O4 -","- C12 H26 I3 K N2 O4 -","- C48 H104 I12 K4 N8 O16 -","4","0.5","SE1068","Tebbe, K.-F.; Kavoosian, A.","Kalium-2,2-Crypt-triiodid","Acta Crystallographica Section C","1995","51","4","562","565","10.1107/S010827019401005X","","","0.71069","MoKα","","0.041","0.0332","","0.1032","0.1003","","","","1.465","1.534","1.534","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003405","9.71","0.001","7.386","0.001","15.236","0.001","90","","90.67","0.01","90","","1092.6","0.2","193","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H27 N Si3 -","- C21 H27 N Si3 -","- C42 H54 N2 Si6 -","2","1","SE1070","Mitzel, N. W.; Riede, J.; Schier, A.; Schmidbaur, H.","Tris(<i>p</i>-tolylsilyl)amine","Acta Crystallographica Section C","1995","51","4","756","758","10.1107/S0108270194012163","","","0.71073","MoKα","","","0.028","","","0.0304","","","","","0.411","0.411","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003406","6.791","0.003","7.554","0.004","18.304","0.007","89.89","0.05","84.06","0.04","81.94","0.08","924.6","0.8","294","","","","","","","","","","","5","P -1","-P 1","2","","N-n-octyl-N,N-dimethylammonio acetic acid bromide","","- C15 H32 Br N O2 -","- C15 H31 Br N O2 -","- C30 H62 Br2 N2 O4 -","2","1","SE1072","Rudert, R.; Schulz, B.; Reck, G.; Vollhardt, D.; Kriwanek, J.","(Carboxymethyl)dimethylundecylammonium Bromide","Acta Crystallographica Section C","1995","51","4","768","770","10.1107/S0108270194011443","","","0.71073","MoKα","","","0.06","","","0.055","","","","","0.928","0.928","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2003407","9.6093","0.0009","9.606","0.001","10.118","0.001","81.581","0.009","77.02","0.01","72.97","0.01","866.93","0.16","300","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H15 I Sn -","- C18 H15 I Sn -","- C36 H30 I2 Sn2 -","2","1","TA1013","Ng, S. W.","Triphenyltin Iodide","Acta Crystallographica Section C","1995","51","4","629","631","10.1107/S0108270194012400","","","0.71073","MoKα","","","0.028","","","0.03","","","","","0.403","0.403","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003408","13.944","0.004","5.823","0.002","15.172","0.005","90","","105.86","0.02","90","","1185","0.7","296","","","","","","","","","","from 99.7% ethanol","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 O S -","- C14 H13 O S -","- C56 H52 O4 S4 -","4","1","AB1139","He, Y.; Su, G.; Shi, J.","3-(4-Methylphenyl)-1-(3-thienyl)-2-propen-1-one","Acta Crystallographica Section C","1995","51","5","989","991","10.1107/S0108270194008346","","","0.71069","MoKα","","","0.058","","","0.079","","","","","2.4","2.4","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003409","10.167","0.005","8.797","0.003","13.155","0.007","90","","96.41","0.04","90","","1169.2","0.9","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 N O -","- C14 H15 N O -","- C56 H60 N4 O4 -","4","1","AB1153","Hökelek, T.; Gündüz, N.; Hayvali, Z.; Kilic, Z.","Schiff Bases and Their Complexes with Metal Ions. I. 2-Hydroxy-<i>N</i>-<i>n</i>-propyl-1-naphthaldimine (1) and Bis(2-hydroxy-κ<i>O</i>-<i>N</i>-<i>n</i>-propyl-1-naphthaldiminato-κ<i>N</i>)nickel(II) (2)","Acta Crystallographica Section C","1995","51","5","880","884","10.1107/S0108270194009480","","","1.5418","CuKα","","","0.055","","","0.064","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003410","10.655","0.005","10.688","0.005","12.575","0.005","119.27","0.03","96.56","0.03","103.23","0.04","1172.1","1.1","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H28 N2 Ni O2 -","- C28 H28 N2 Ni O2 -","- C56 H56 N4 Ni2 O4 -","2","1","AB1153","Hökelek, T.; Gündüz, N.; Hayvali, Z.; Kilic, Z.","Schiff Bases and Their Complexes with Metal Ions. I. 2-Hydroxy-<i>N</i>-<i>n</i>-propyl-1-naphthaldimine (1) and Bis(2-hydroxy-κ<i>O</i>-<i>N</i>-<i>n</i>-propyl-1-naphthaldiminato-κ<i>N</i>)nickel(II) (2)","Acta Crystallographica Section C","1995","51","5","880","884","10.1107/S0108270194009480","","","1.5418","CuKα","","","0.044","","","0.064","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003411","11.6125","0.0009","12.6271","0.0012","16.45","0.0014","86.415","0.007","87.307","0.007","63.307","0.007","2150.3","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","1-triphenylphosphine-μ^3^-(2,7,11)-triphenylphosphinecupradihydrido- closo-1,2-telluracupraoctahydrododecaborane","","- C37 H42 B10 Cl2 Cu2 P2 Te -","- C37 H42 B10 Cl2 Cu2 P2 Te -","- C74 H84 B20 Cl4 Cu4 P4 Te2 -","2","1","AB1219","Thornton-Pett, M.; Kennedy, J. D.; Faridoon; Spalding, T. R.","{<i>exo</i>-2,7,11-μ~3~-[(μ-H)~2~Cu(PPh~3~)]-2-(PPh~3~)-<i>closo</i>-2,1-CuTeB~10~H~8~}.CH~2~Cl~2~","Acta Crystallographica Section C","1995","51","5","840","843","10.1107/S0108270194010917","","","0.71069","MoKα","","0.0546","0.0482","","0.1324","0.1267","","","","1.029","1.066","1.066","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003412","13.0681","0.0005","6.1093","0.0002","9.7006","0.0003","79.535","0.002","107.879","0.002","93.968","0.002","724.73","0.04","292","","","","","","","","","","","2","P -1","-P 1","2","","endo-3,3-Diphenyltricyclo[3.2.1.0^2,4^]oct-6-ene","","- C20 H18 -","- C20 H18 -","- C40 H36 -","2","1","AB1249","Peeran, M.; Wilt, J. W.; Zaluzec, E. J.; Pavkovic, S. F.","<i>endo</i>-3,3-Diphenyltricyclo[3.2.1.0^2,4^]oct-6-ene","Acta Crystallographica Section C","1995","51","5","952","954","10.1107/S0108270195000771","","","1.5418","CuKα","","","0.07","","","0.087","","","","","0.8245","0.8245","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2003413","8.382","0.003","14.457","0.004","4.868","0.003","94.84","0.04","104.31","0.04","77.68","0.02","558.1","0.4","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H10 N4 O -","- C13 H10 N4 O -","- C26 H20 N8 O2 -","2","1","AS1131","Kakehi, A.; Kitajima, K.; Ito, S.; Takusagawa, N.","A 1,2-Dihydrodipyrido[1,2-<i>b</i>:3',2'-<i>d</i>]pyrazol-2-one","Acta Crystallographica Section C","1995","51","5","942","944","10.1107/S0108270194012977","","","0.71069","MoKα","","","0.046","","","0.054","","","","","1.63","1.63","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003414","9.593","0.003","15.915","0.002","11.427","0.002","90","","113.89","0.013","90","","1595.1","0.6","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","[(R)-1,2-diethoxycarbonylethyl] bis(dimethylglyoximato)(diphenylmethylphosphine)cobalt(III)","","- C29 H40 Co N4 O8 P -","- C29 H40 Co N4 O8 P -","- C58 H80 Co2 N8 O16 P2 -","2","1","AS1134","Yamada, T.; Sekine, A.; Uekusa, H.; Ohashi, Y.; Arai, Y.; Ohgo, Y.","[(<i>R</i>)-1,2-Diethoxycarbonylethyl]bis(dimethylglyoximato)(methyldiphenylphosphine)cobalt(III)","Acta Crystallographica Section C","1995","51","5","828","831","10.1107/S0108270194012564","","","0.71073","MoKα","","0.08","0.044","","0.111","0.098","","","","1.028","1.063","1.063","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003415","13.6382","0.0005","13.9275","0.0008","7.7297","0.0004","90","","90","","90","","1468.23","0.13","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N,N-diisopropyl(o-methylphenyl)glyoxylamide","","- C15 H21 N O2 -","- C15 H21 N O2 -","- C60 H84 N4 O8 -","4","1","AS1136","Hashizume, D.; Kogo, H.; Sekine, A.; Ohashi, Y.; Miyamoto, H.; Toda, F.","Stereochemistry of Asymmetric β-Lactam Formation Involving Achiral Glyoxylamide Derivatives","Acta Crystallographica Section C","1995","51","5","929","933","10.1107/S0108270194012412","","","1.54178","CuKα","","","0.055","","","0.067","","","","","8.69","8.69","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003416","15.438","0.002","15.343","0.002","12.685","0.001","90","","90","","90","","3004.6","0.6","296","","296","","","","","","","","","4","P b c a","-P 2ac 2ab","61","N,N-diisopropyl(p-methylphenyl)glyoxylamide","","","- C15 H21 N O2 -","- C15 H21 N O2 -","- C120 H168 N8 O16 -","8","1","AS1136","Hashizume, D.; Kogo, H.; Sekine, A.; Ohashi, Y.; Miyamoto, H.; Toda, F.","Stereochemistry of Asymmetric β-Lactam Formation Involving Achiral Glyoxylamide Derivatives","Acta Crystallographica Section C","1995","51","5","929","933","10.1107/S0108270194012412","","","1.54178","CuKα","","","0.081","","","0.074","","","","","6.3","6.3","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003417","16.3","0.008","6.331","0.002","7.461","0.002","90","","95.31","0.05","90","","766.6","0.5","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","N,N-diisopropyl(m,p-dimethylphenyl)glyoxylamide","","- C16 H23 N O2 -","- C16 H23 N O2 -","- C32 H46 N2 O4 -","2","1","AS1136","Hashizume, D.; Kogo, H.; Sekine, A.; Ohashi, Y.; Miyamoto, H.; Toda, F.","Stereochemistry of Asymmetric β-Lactam Formation Involving Achiral Glyoxylamide Derivatives","Acta Crystallographica Section C","1995","51","5","929","933","10.1107/S0108270194012412","","","1.54178","CuKα","","","0.061","","","0.062","","","","","9.73","9.73","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003418","14.369","0.001","13.5367","0.0007","8.2496","0.0007","90","","102.33","0.009","90","","1567.6","0.2","298","","","","","","","","","","slow evaporation from benzene solution","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 Cl N O3 S -","- C16 H14 Cl N O3 S -","- C64 H56 Cl4 N4 O12 S4 -","4","1","AS1137","Shiraga, T.; Iwamoto, T.; Kashino, S.","<i>N</i>-Phenylsulfonyl-<i>N</i>-<i>o</i>-chlorophenylmethacrylamide, C~16~H~14~ClNO~3~S","Acta Crystallographica Section C","1995","51","5","976","978","10.1107/S010827019401200X","","","1.54178","CuKα","","","0.047","","","0.06","","","","","1.412","1.412","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003419","7.964","0.001","8.859","0.001","13.229","0.002","86.34","0.01","73.71","0.01","88.25","0.01","894","0.2","293","","","","","","","","","","Synthesized","4","P -1","-P 1","2","","N-{3-(3,4-Dimethylphenyl)propyl}-4-hydroxy-3-methoxyphenylactamide","","- C20 H25 N O3 -","- C20 H25 N O3 -","- C40 H50 N2 O6 -","2","1","AS1152","Park, N.-S.; Park, I. Y.; Lee, J. C.; Kim, Y. B.","KR-25003, a Potent Analgesic Capsaicinoid","Acta Crystallographica Section C","1995","51","5","927","929","10.1107/S0108270194013879","","","1.5418","CuKα","","0.049","0.047","","0.049","0.048","","","","0.526","0.537","0.537","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2003420","7.652","0.002","9.716","0.002","11.757","0.003","94.66","0.03","98.25","0.04","104.17","0.04","832.5","0.4","298","","","","","","","","","","","3","P -1","-P 1","2","","","","- C23 H20 Fe2 -","- C23 H20 Fe2 -","- C46 H40 Fe4 -","2","1","BK1059","Trnka, T. M.; Kerber, R. C.","An Unexpected By-Product in the Friedel‒Crafts Acrylation of Ferrocene","Acta Crystallographica Section C","1995","51","5","871","873","10.1107/S0108270194012230","","","0.71073","MoKα","","","0.038","","","0.048","","","","","1.082","1.082","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003421","8.649","0.001","10.794","0.001","15.936","0.002","90","","90","","90","","1487.7","0.3","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 O3 -","- C17 H22 O3 -","- C68 H88 O12 -","4","1","BK1064","Abboud, K. A.; Malvestiti, I.; Boldea, L.; Walker, M. A.; Battiste, M. A.","An Intramolecular Diels‒Alder Adduct in the Hydroxy-β-ionone Series","Acta Crystallographica Section C","1995","51","5","995","997","10.1107/S0108270194011972","","","0.71073","MoKα","","","0.0516","","","0.053","","","","","1.62","1.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003422","7.265","0.002","7.557","0.002","21.91","0.007","90","","90","","90","","1202.9","0.6","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","bis(imidazol-2-yl)aminomethane tris(hydrochloride)","","- C7 H12 Cl3 N5 -","- C7 H12 Cl3 N5 -","- C28 H48 Cl12 N20 -","4","1","BK1097","Mendoza-Díaz, G.; Koolhaas, G. J. A. A.; Driessen, W. L.; Reedijk, J.","Bis(2-imidazolyl)aminomethane Tris(hydrochloride)","Acta Crystallographica Section C","1995","51","5","918","920","10.1107/S010827019401320X","","","0.71073","MoKα","","0.076","0.041","","0.057","0.052","","","","1.611","1.826","1.826","","","","","has coordinates","190396","2020-10-21","18:00:00",""
"2003423","7.939","0.006","17.82","0.02","8.734","0.009","90","","94.51","0.08","90","","1232","2","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis(3,5-dimethylpyrazolylphosphinato)copper(II)","","- C20 H28 Cu N8 O4 P2 -","- C20 H28 Cu N8 O4 P2 -","- C40 H56 Cu2 N16 O8 P4 -","2","0.5","BK1100","Folkert, S.; Bryan, C. D.; Cordes, A. W.; Tharmaraj, P.; Chandrasekhar, V.","Bis[bis(3,5-dimethyl-1-pyrazolyl)phosphinato]copper(II), [Cu{O~2~P(N~2~C~3~HMe~2~)~2~}~2~]","Acta Crystallographica Section C","1995","51","5","863","865","10.1107/S0108270194013260","","","0.7107","MoKα","","0.053","0.033","","0.059","0.053","","","","","0.94","0.94","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003424","12.313","0.001","15.335","0.002","16.616","0.002","90","","90","","90","","3137.4","0.6","298","","298","","","","","","","","","6","C c c a :2","-C 2a 2ac","68","","Tetrapyridinodiiodocopper(II)zinc(II) pyridine","","- C30 H30 Cu0.92 I2 N6 Zn0.08 -","- C30 H30 Cu0.92 I2 N6 Zn0.08 -","- C120 H120 Cu3.68 I8 N24 Zn0.32 -","4","0.25","BR1084","Durand, P. B.; Holt, E. M.","Diiodotetra(pyridine-<i>N</i>)copper(II)zinc(II) Dipyridine","Acta Crystallographica Section C","1995","51","5","850","852","10.1107/S0108270194009285","","","0.71073","MoKα","","","0.0316","","","0.0394","","","","","0.98","0.98","","","","","has coordinates,has disorder","206082","2020-10-21","18:00:00",""
"2003425","13.755","0.002","24.817","0.003","9.101","0.002","90","","90","","90","","3106.7","0.9","294","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","cholesteryl-4-vinylbenzoate","","- C36 H52 O2 -","- C36 H52 O2 -","- C144 H208 O8 -","4","1","CR1099","Socci, E. P.; Farmer, B. L.; Chabinyc, M. L.; Fratini, A. V.; Bunning, T. J.; Adams, W. W.","Cholesteryl 4-Vinylbenzoate","Acta Crystallographica Section C","1995","51","5","888","891","10.1107/S0108270194008541","","","0.71073","Mo_Kα","","","0.071","","","0.064","","","","","1.912","1.912","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2003426","6.6946","0.0002","7.0268","0.0001","8.3216","0.0004","90","","107.21","0.03","90","","373.93","0.06","295","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C8 H10 N2 -","- C8 H10 N2 -","- C16 H20 N4 -","2","0.5","CR1126","Echeverria, G.; Punte, G.; Rivero, B. E.; Barón, M.","Conformational Studies of <i>trans</i>-1,4-Substituted Cyclohexanes. I. <i>trans</i>-1,4-Cyclohexanedicarbonitrile","Acta Crystallographica Section C","1995","51","5","1020","1023","10.1107/S0108270194010991","","","0.7093","MoKα","","","0.04","","","0.039","","","","","2.19","2.19","","","","","has coordinates","278309","2022-10-03","09:59:32",""
"2003427","11.92","0.008","6.885","0.005","6.457","0.003","90","","112.14","0.05","90","","490.8","0.6","295","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C8 H8 Br2 N2 -","- C8 H8 Br2 N2 -","- C16 H16 Br4 N4 -","2","0.25","CR1127","Echeverria, G.; Punte, G.; Rivero, B. E.; Barón, M.","Conformational Studies of <i>trans</i>-1,4-Substituted Cyclohexanes. II. <i>trans</i>-1,4-Dibromo-1,4-cyclohexanedicarbonitrile, C~8~H~8~Br~2~N~2~","Acta Crystallographica Section C","1995","51","5","1023","1026","10.1107/S010827019401098X","","","0.7093","MoKα","","","0.037","","","0.037","","","","","1.39","1.39","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003428","14.589","0.003","13.384","0.003","8.158","0.003","90","","91.65","0.03","90","","1592.3","0.8","294","","","","","","","","","","Prof. Harry Wasserman of Yale University","2","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 -","- C24 H20 -","- C96 H80 -","4","1","CR1130","Fratini, A. V.; Chabinyc, M. L.; Perko, T. J.; Adams, W. W.","<i>Syn</i> and <i>Anti</i> Isomers of [2.2]Paracyclonaphthane","Acta Crystallographica Section C","1995","51","5","904","908","10.1107/S0108270194009959","","","0.71073","Mo-Kα","","","0.047","","","0.058","","","","","1.347","1.347","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003429","8.371","0.003","11.807","0.004","16.704","0.008","90","","103.49","0.03","90","","1605.4","1.1","294","","","","","","","","","","Prof. Harry Wasserman of Yale University","2","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 -","- C24 H20 -","- C96 H80 -","4","1","CR1130","Fratini, A. V.; Chabinyc, M. L.; Perko, T. J.; Adams, W. W.","<i>Syn</i> and <i>Anti</i> Isomers of [2.2]Paracyclonaphthane","Acta Crystallographica Section C","1995","51","5","904","908","10.1107/S0108270194009959","","","0.71073","Mo-Kα","","","0.042","","","0.056","","","","","1.431","1.431","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003430","12.286","0.003","12.286","0.003","45.744","0.002","90","","90","","90","","6905","2","222","","","","","","","","","","natural product","4","P 43 21 2","P 4nw 2abw","","","","","- C68 H106 Na2 O16 -","- C68 H106 Na2 O16 -","- C272 H424 Na8 O64 -","4","0.5","CR1138","Shui, X.; Eggleston, D. S.","Two Lasalocid Sodium Salts","Acta Crystallographica Section C","1995","51","5","805","809","10.1107/S0108270194010450","","","1.54184","CuKα","","","0.055","","","0.079","","","","","1.763","1.763","","","","","has coordinates","283803","2023-05-16","08:05:52",""
"2003431","12.9","0.01","17.2","0.02","17.9","0.04","90","","99.79","0.06","90","","3914","10","218","","","","","","","","","","natural product","4","P 1 21 1","","","","","","- C38 H63 Na O9 -","- C40 H58 Na O9 -","- C160 H232 Na4 O36 -","4","2","CR1138","Shui, X.; Eggleston, D. S.","Two Lasalocid Sodium Salts","Acta Crystallographica Section C","1995","51","5","805","809","10.1107/S0108270194010450","","","0.71073","MoKα","","","0.044","","","0.06","","","","","1.857","1.857","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003432","9.4029","0.0006","13.6474","0.001","13.1142","0.001","90","","107.806","0.006","90","","1602.3","0.2","295","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 Cl6 -","- C15 H14 Cl6 -","- C60 H56 Cl24 -","4","1","CR1147","Garcia, J. G.; Fronczek, F. R.","<i>endo</i>-1,10,11,12,13,13-Hexachlorotricyclo[8.2.1.0^2,9^]trideca-11-ene","Acta Crystallographica Section C","1995","51","5","987","989","10.1107/S0108270194011479","","","1.54184","CuKα","","","0.056","","","0.08","","","","","2.64","2.64","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003433","9.4675","0.0012","10.1833","0.0013","8.2964","0.001","112.383","0.004","106.408","0.005","91.788","0.004","700.74","0.16","294","","","","","","","","","","","5","P -1","-P 1","2","","1-benzyl-5-methoxycarbonylmethylthio-4-nitroimidazole","","- C13 H13 N3 O4 S -","- C13 H13 N3 O4 S -","- C26 H26 N6 O8 S2 -","2","1","CR1152","Saadeh, H.; Thompson, C. M.; Fernandez, E.; Pavkovic, S. F.","1-Benzyl-5-methoxycarbonylmethylthio-4-nitroimidazole","Acta Crystallographica Section C","1995","51","5","950","952","10.1107/S0108270194013430","","","0.7107","MoKα","","","0.04","","","0.047","","","","","1.175","1.175","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2003434","13.588","0.002","8.286","0.001","14.683","0.002","90","","110.51","0.01","90","","1548.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","JM216","Bis(acetato)-ammine-dichloro-cyclohexylamine platinum(IV)","","- C10 H22 Cl2 N2 O4 Pt -","- C10 H22 Cl2 N2 O4 Pt -","- C40 H88 Cl8 N8 O16 Pt4 -","4","1","CR1156","Neidle, S.; Snook, C. F.; Murrer, B. A.; Barnard, C. F. J.","Bis(acetato)amminedichloro(cyclohexylamine)platinum(IV), an Orally Active Anticancer Drug","Acta Crystallographica Section C","1995","51","5","822","824","10.1107/S0108270194013600","","","1.54051","CuKα","","0.0417","0.037","","0.1147","0.111","","","","0.971","0.981","0.981","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003435","6.025","0.004","7.566","0.004","9.588","0.005","90","","101.64","0.04","90","","428.1","0.4","293","","","","","","","","","","M\'ethanol","4","P 1 c 1","P -2yc","7","","","","- C7 H13 N O4 -","- C7 H13 N O4 -","- C14 H26 N2 O8 -","2","1","DU1031","Oddon, Y.; Reboul, J.-P.; Pèpe, G.; Siri, D.; Pucci, B.; Pavia, A. A.","2-Acrylamido-2-hydroxymethylpropan-1,3-diol","Acta Crystallographica Section C","1995","51","5","974","976","10.1107/S0108270194000636","","","1.5418","CuKα","","","0.031","","","0.031","","","","","0.21","0.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003436","9.1937","0.0007","11.121","0.001","20.014","0.001","90","","90","","90","","2046.3","0.3","295","","","","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- Ce Mo8 O14 -","- Ce Mo8 O14 -","- Ce8 Mo64 O112 -","8","1","DU1086","Kerihuel, G.; Gougeon, P.","CeMo~8~O~14~, a Third Crystalline Form of the <i>R</i>Mo~8~O~14~ Series (<i>R</i> = La, Ce, Pr, Nd, Sm)","Acta Crystallographica Section C","1995","51","5","787","790","10.1107/S0108270194010681","","","0.71073","MoKα","","","0.04","","","0.042","","","","","1.582","1.582","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003439","9.012","0.001","9.012","0.001","8.027","0.001","90","","90","","120","","564.58","0.11","293","","","","","","","","","","","4","P -6 2 c","P -6c -2c","190","","","","- K3 Nb3 O13 Si2 -","- K3 Nb3 O13 Si2 -","- K6 Nb6 O26 Si4 -","2","0.166667","DU1095","Jaulmes, S.; Launay, S.; Mahé, P.; Quarton, M.","Silicatoniobate de Potassium, K~3~Nb~3~O~6~Si~2~O~7~","Acta Crystallographica Section C","1995","51","5","794","796","10.1107/S0108270194012114","","","0.71073","MoKα","","","0.045","","","0.061","","","","","0.8","0.8","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003440","5.656","0.001","9.066","0.001","10.42","0.001","109.694","0.01","103.062","0.01","90.688","0.01","487.77","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","o-Anisidinium Dihydrogenomonophosphate","","- C7 H12 N O5 P -","- C7 H12 N O5 P -","- C14 H24 N2 O10 P2 -","2","1","DU1096","Ould Abdellahi, M.; Jouini, T.","<i>o</i>-Anisidinium Dihydrogenmonophosphate","Acta Crystallographica Section C","1995","51","5","922","923","10.1107/S0108270194010668","","","0.712","MoKα","","0.0481","0.0408","","0.1644","0.1449","","","","0.253","0.239","0.239","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003441","16.095","0.001","8.49","0.001","16.907","0.0001","90","0.01","116.104","0.001","90","0.01","2074.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","m-Anisidinium Dihydrogenomonophosphate","","- C7 H12 N O5 P -","- C7 H12 N O5 P -","- C56 H96 N8 O40 P8 -","8","2","DU1098","Ould Abdellahi, M.; Jouini, T.","<i>m</i>-Anisidinium Dihydrogenmonophosphate","Acta Crystallographica Section C","1995","51","5","924","926","10.1107/S0108270194011558","","","0.71069","MoKα","","0.0727","0.0484","","0.1064","0.1013","","","","1.282","1.42","1.42","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003442","7.932","0.002","7.321","0.002","10.403","0.003","90","","106.93","0.03","90","","577.9","0.3","293","1","","","","","","","","","recrystallization of the commercial product","4","P 1 21/c 1","-P 2ybc","14","","","","- H8 N2 O6 S -","- H8 N2 O6 S -","- H32 N8 O24 S4 -","4","1","DU1099","Mirceva, A.; Golic, L.","Hydroxylammonium Sulfate","Acta Crystallographica Section C","1995","51","5","798","800","10.1107/S0108270194013351","","","0.71069","MoKα","","","0.026","","","0.026","","","","","0.363","0.363","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003443","9.3781","0.0005","8.2216","0.0006","13.5971","0.0006","90","","104.903","0.004","90","","1013.11","0.1","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","para-Anisidinium Dihydrogénophosphate","","- C7 H12 N O5 P -","- C7 H12 N O5 P -","- C28 H48 N4 O20 P4 -","4","1","DU1105","Ben Amor, F.; Soumhi, E. H.; Ould Abdellahi, M.; Jouini, T.","<i>p</i>-Anisidinium Dihydrogénophosphate","Acta Crystallographica Section C","1995","51","5","933","935","10.1107/S0108270194014289","","","0.71069","MoKα","","0.0441","0.0394","","0.106","0.1033","","","","1.13","1.164","1.164","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003444","13.428","0.002","11.78","0.002","12.318","0.002","90","","115.4","0.01","90","","1760.1","0.5","294","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 Cl3 Mn N2 O3 -","- C16 H14 Cl3 Mn N2 O3 -","- C64 H56 Cl12 Mn4 N8 O12 -","4","1","FG1002","Horwitz, C. P.; Dailey, G. C.; Tham, F. S.","Aquachloro[bis(5-chlorosalicylidene)ethylenediaminato]manganese(III)","Acta Crystallographica Section C","1995","51","5","815","817","10.1107/S0108270194012308","","","0.71069","MoKα","","","0.0311","","","0.0416","","","","","1.0829","1.0829","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003445","14.936","0.004","15.088","0.004","25.727","0.006","90","","92.44","0.02","90","","5792","3","113","","113","","","","","","","","Cram et al. (1987)","4","P 1 21/n 1","-P 2yn","14","","41,42,43,44,45,46,47,48-Octamethoxy-4,9,14,19,24,29,34,39-octamethylnonacyclo (35.3.1.1^2,6^.1^7,11^.1^12,16^.1^17,21^.1^22,26^.1^27,31^.1^32,36^) octatetraconta-1(41),2,4,6(42),7,9,11(43),12,14,16(44),17,19,21(45),22,24,26(46) ,27,29,31(47),32,34,36(48),37,39-tetracosaene dichloromethane clathrate","","- C65 H66 Cl2 O8 -","- C65 H66 Cl4 O8 -","- C260 H264 Cl16 O32 -","4","1","FG1015","Trueblood, K. N.; Maverick, E. F.; Knobler, C. B.; Goldberg, I.","Octaanisyl Cavitands and a Related Caviplex","Acta Crystallographica Section C","1995","51","5","894","904","10.1107/S0108270194013594","","","1.54184","CuKα","","0.077","0.07","","0.081","0.076","","","","2.81","2.85","2.85","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003446","14.117","0.006","27.796","0.009","14.845","0.004","90","","94.29","0.03","90","","5809","3","115","","115","","","","","","","","Cram et al. (1987)","3","P 1 21/n 1","-P 2yn","14","","41,42,43,44,45,46,47,48-Octamethoxy-4,9,14,19,24,29,34,39-octamethylnonacyclo (35.3.1.1^2,6^.1^7,11^.1^12,16^.1^17,21^.1^22,26^.1^27,31^.1^32,36^) octatetraconta-1(41),2,4,6(42),7,9,11(43),12,14,16(44),17,19,21(45),22,24,26(46) ,27,29,31(47),32,34,36(48),37,39-tetracosaene ethanol clathrate","","- C66 H70 O9 -","- C70 H64 O11 -","- C280 H256 O44 -","4","1","FG1015","Trueblood, K. N.; Maverick, E. F.; Knobler, C. B.; Goldberg, I.","Octaanisyl Cavitands and a Related Caviplex","Acta Crystallographica Section C","1995","51","5","894","904","10.1107/S0108270194013594","","","1.54184","CuKα","","0.087","0.082","","0.088","0.085","","","","3.48","3.53","3.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003447","17.088","0.005","19.691","0.006","20.392","0.006","90","","90","","90","","6861","4","115","","115","","","","","","","","Cram et al. (1987)","5","P n a m","-P 2c 2n","62","","Octamethoxy-octamethylnonacyclo(35.3.1.1^2,6^.1^7,11^.1^12,16^.1 ^17,21^.1^22,26^.1^27,31^.1^32,36^)octatetraconta-1(41),2,4,6(42),7,9,11(43),12, 14,16(44),17,19,21(45),22,24,26(46),27,29,31(47),32,34,36(48),37,39-tetracosaene cesium perchlorate dichloromethane clathrate","","- C65 H66 Cl3 Cs O12 -","- C65 H66 Cl6 Cs O12 -","- C260 H264 Cl24 Cs4 O48 -","4","0.5","FG1015","Trueblood, K. N.; Maverick, E. F.; Knobler, C. B.; Goldberg, I.","Octaanisyl Cavitands and a Related Caviplex","Acta Crystallographica Section C","1995","51","5","894","904","10.1107/S0108270194013594","","","0.71073","MoKα","","0.152","0.091","","0.108","0.079","","","","1.62","1.83","1.83","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003448","7.924","0.002","11.433","0.003","25.541","0.006","79.12","0.02","83.61","0.02","87.6","0.02","2257.7","1","296","","296","","","","","","","","Cram et al. (1987)","3","P -1","-P 1","2","","41,42,43,44,45,46,47,48-Octamethoxynonacyclo(35.3.1.1^2,6^.1^7,11^.1^12,16^.1^ 17,21^.1^22,26^.1^27,31^.1^32,36^)octatetraconta-1(41),2,4,6(42),7,9,11(43),12, 14,16(44),17,19,21(45),22,24,26(46),27,29,31(47),32,34,36(48),37,39 -tetracosaene","","- C56 H48 O8 -","- C57 H48 O9 -","- C114 H96 O18 -","2","1","FG1015","Trueblood, K. N.; Maverick, E. F.; Knobler, C. B.; Goldberg, I.","Octaanisyl Cavitands and a Related Caviplex","Acta Crystallographica Section C","1995","51","5","894","904","10.1107/S0108270194013594","","","0.71073","MoKα","","0.191","0.112","","0.109","0.096","","","","1.21","1.49","1.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003449","19.942","0.003","19.942","0.003","10.294","0.002","90","","90","","90","","4093.8","1.2","293","2","293","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","(1R*, 2R*, 3R*, 4R*, 7R*)-2,4,7-trimethylcyclohept-5-ene-1,3-diol","","- C10 H18 O2 -","- C10 H18 O2 -","- C160 H288 O32 -","16","1","FG1032","Colucci, J.; Gajda, C.; Lautens, M.; Lough, A. J.","Product of an <i>S</i>~<i>N~</i>2' Ring-Opening Reaction, (1<i>R</i>*,2<i>R</i>*,3<i>R</i>*,4<i>R</i>*,7<i>R</i>*)-2,4,7-Trimethylcyclohept-5-ene-1,3-diol","Acta Crystallographica Section C","1995","51","5","912","914","10.1107/S0108270194011194","","","0.71073","MoKα","","0.1651","0.04","","0.1092","0.0785","","","","1.012","1.158","1.158","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003450","11.071","0.003","18.283","0.003","6.865","0.004","90","","90","","90","","1389.6","0.9","173","1","173","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","α,α-galactotrehalose","α-D-galactopyranosyl α-D-galactopyranoside","","- C12 H22 O11 -","- C12 H22 O11 -","- C48 H88 O44 -","4","1","FG1050","Linden, A.; Lee, C. K.","α,α-<i>galacto</i>-Trehalose","Acta Crystallographica Section C","1995","51","5","1012","1016","10.1107/S0108270194014204","","","0.71069","MoKα","","0.0364","0.0315","","0.0311","0.0306","","","","","1.949","1.949","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2003451","8","0.004","10.162","0.004","7.198","0.002","107.69","0.03","100.23","0.03","73.48","0.03","531.8","0.4","123","","","","","","","","","","","3","P -1","-P 1","2","","","","- C12 H14 O3 -","- C12 H14 O3 -","- C24 H28 O6 -","2","1","HA1129","Yufit, D. S.; Kozhushkov, S. I.; de Mejere, A.","<i>trans</i>-2-[(Dispiro[2.0.2.1]hept-7-yl)carbonyl]-3-methyl-β-propiolactone","Acta Crystallographica Section C","1995","51","5","948","950","10.1107/S0108270194012333","","","0.71073","MoKα","","","0.038","","","0.037","","","","","2.78","2.78","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003452","5.035","0.001","11.684","0.001","21.792","0.003","90","","90.54","0.02","90","","1281.9","0.3","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H16 N2 O4 S -","- C11 H16 N2 O4 S -","- C44 H64 N8 O16 S4 -","4","1","HA1134","MacNicol, D. D.; Mallinson, P. R.","<i>N</i>,<i>N</i>-Diethyl-4-(methylsulfonyl)-2-nitroaniline","Acta Crystallographica Section C","1995","51","5","926","927","10.1107/S0108270194012916","","","0.71069","MoKα","","","0.044","","","0.053","","","","","2.3","2.3","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003453","6.742","0.001","9.005","0.005","15.932","0.002","92.96","0.02","95.78","0.01","94.45","0.02","957.7","0.6","293","2","293","2","","","","","","","Dr K. Horspool, Aston Univ.","5","P -1","-P 1","2","","3-(2-chlorethyl)-3,3,4-dihydro-4-oxoimidazo[5,1-d]-1,2,3,5-tetrazine-8- carboxylic acid","","- C7 H6 Cl N5 O3 -","- C7 H6 Cl N5 O3 -","- C28 H24 Cl4 N20 O12 -","4","2","HA1135","Lowe, P. R.; Schwalbe, C. H.","8-Acid Derivative of the Antitumour Agent Mitozolomide","Acta Crystallographica Section C","1995","51","5","937","939","10.1107/S0108270194012321","","","0.71069","MoKα","","0.0596","0.0423","","0.1282","0.1238","","","","1.116","1.237","1.237","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003454","13.467","0.001","9.304","0.001","15.752","0.002","90","","109.11","0.01","90","","1864.9","0.4","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 N4 Ni O7 -","- C16 H22 N4 Ni O7 -","- C64 H88 N16 Ni4 O28 -","4","1","HR1020","Skoulika, S.; Michaelides, A.; Aubry, A.","Two Ternary Ni^II^ Complexes: Bisglycinato(1,10-phenanthroline)nickel(II) Trihydrate and Bisglycinato(2,2'-bipyridine)nickel(II) Trihydrate","Acta Crystallographica Section C","1995","51","5","843","846","10.1107/S0108270194012709","","","1.5418","CuKα","","","0.058","","","0.071","","","","","1.216","1.216","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003455","12.827","0.001","9.416","0.001","15.716","0.001","90","","109.33","0.01","90","","1791.2","0.3","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 N4 Ni O7 -","- C14 H22 N4 Ni O7 -","- C56 H88 N16 Ni4 O28 -","4","1","HR1020","Skoulika, S.; Michaelides, A.; Aubry, A.","Two Ternary Ni^II^ Complexes: Bisglycinato(1,10-phenanthroline)nickel(II) Trihydrate and Bisglycinato(2,2'-bipyridine)nickel(II) Trihydrate","Acta Crystallographica Section C","1995","51","5","843","846","10.1107/S0108270194012709","","","1.5418","CuKα","","","0.056","","","0.068","","","","","1.886","1.886","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003456","8.6449","0.001","9.9416","0.001","12.892","0.002","90","","94.96","0.09","90","","1103.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Potassium 4-Sulfonatobenzoic acid dihydrate","","- C7 H9 K O7 S -","- C7 H9 K O7 S -","- C28 H36 K4 O28 S4 -","4","1","HU1119","Kariuki, B. M.; Jones, W.","Three Polymorphs of Potassium 4-Sulfonatobenzoic Acid","Acta Crystallographica Section C","1995","51","5","867","871","10.1107/S0108270194012485","","","0.71069","MoKα","","0.0583","0.0335","","0.0859","0.0812","","","","1.063","1.221","1.221","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003457","6.0576","0.001","6.7412","0.001","12.479","0.002","90.278","0.01","95.841","0.01","106.379","0.01","486.07","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Potassium 4-sulfonatobenzoic acid monohydrate","","- C7 H7 K O6 S -","- C7 H7 K O6 S -","- C14 H14 K2 O12 S2 -","2","1","HU1119","Kariuki, B. M.; Jones, W.","Three Polymorphs of Potassium 4-Sulfonatobenzoic Acid","Acta Crystallographica Section C","1995","51","5","867","871","10.1107/S0108270194012485","","","0.71069","MoKα","","0.0343","0.0304","","0.087","0.085","","","","1.095","1.14","1.14","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003458","6.3113","0.001","7.5404","0.001","9.8868","0.001","103.832","0.01","99.202","0.01","100.707","0.01","438.5","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Potassium 4-sulfonatobenzoic acid","","- C7 H5 K O5 S -","- C7 H5 K O5 S -","- C14 H10 K2 O10 S2 -","2","1","HU1119","Kariuki, B. M.; Jones, W.","Three Polymorphs of Potassium 4-Sulfonatobenzoic Acid","Acta Crystallographica Section C","1995","51","5","867","871","10.1107/S0108270194012485","","","0.71069","MoKα","","0.0438","0.0299","","0.0849","0.0821","","","","1.07","1.165","1.165","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003459","6.646","0.003","20.599","0.006","13.458","0.005","90","","90.61","0.05","90","","1842.3","1.2","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Sodium 6-Amino-5-(2-carboxyphenyl)azouracil Heptahydrate","","- C11 H22 N5 Na O11 -","- C11 H22 N5 Na O11 -","- C44 H88 N20 Na4 O44 -","4","1","HU1133","Kivekäs, R.; Pajunen, A.; Colacio, E.; Dominquez-Vera, J. M.; Romerosa, A.","Heptahydrated Monosodium Salt of 6-Amino-5-(2-carboxyphenyl)azouracil","Acta Crystallographica Section C","1995","51","5","939","942","10.1107/S0108270194012539","","","0.71073","MoKα","","0.081","0.081","","0.061","0.061","","","","1.421","1.421","1.421","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003460","9.569","0.0001","17.651","0.002","13.485","0.002","90","","94.26","0.02","90","","2271.4","0.4","293","1","293","1","","","","","","","see text","5","P 1 21/n 1","-P 2yn","14","","cis,trans-dibromobis(4-methylpyridine) 2,2^'^-bipyridine tungsten(II)","","- C22 H22 Br2 N4 W -","- C22 H22 Br2 N4 W -","- C88 H88 Br8 N16 W4 -","4","1","HU1136","Leban, I.; Brenčič, J. V.; Čeh, B.","<i>cis</i>,<i>trans</i>-(2,2'-Bipyridine-<i>N</i>,<i>N</i>')dibromobis(4-methylpyridine-<i>N</i>)tungsten(II)","Acta Crystallographica Section C","1995","51","5","817","820","10.1107/S0108270194012540","","","0.7093","MoKα","","0.0993","0.0447","","0.1065","0.0893","","","","0.988","1.07","1.07","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003461","10.568","0.004","10.622","0.006","8.545","0.004","106.39","0.04","107.5","0.03","83.38","0.04","877.1","0.8","24","","297","","","","","","","","","3","P 1","P 1","1","","","","- C20 H26 O2 -","- C20 H26 O2 -","- C40 H52 O4 -","2","2","HU1137","Fortes, A. G.; Johnstone, R. A. W.; Whittaker, D.; Lewis, N. J.","Fortesyl 2-Phenylpropionate. An Example of a Novel Hydrocarbon Skeleton Containing Three Fused Five-Membered Rings","Acta Crystallographica Section C","1995","51","5","914","916","10.1107/S0108270194012552","","","0.71069","MoKα","","","0.0712","","","0.068","","","","","2.245","2.245","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003462","11.095","0.007","15.692","0.008","15.173","0.007","90","","109.83","0.04","90","","2485","2","295","","","","","","","","","","synthesis","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H30 Cl4 O5 Ru2 S5 -","- C10 H30 Cl4 O5 Ru2 S5 -","- C40 H120 Cl16 O20 Ru8 S20 -","4","1","JZ1006","Ghosh, P.; Pramanik, A.","Tetrachloropentakis(dimethyl sulfoxide)diruthenium(II)","Acta Crystallographica Section C","1995","51","5","824","825","10.1107/S0108270194012448","","","0.71073","MoKα","","","0.0548","","","0.0631","","","","","2.08","2.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003463","8.133","0.002","11.056","0.002","18.658","0.005","102.27","0.02","91.02","0.02","99.77","0.02","1613.1","0.7","295","","","","","","","","","","","6","P -1","-P 1","2","","","","- C30 H24 Cl2 Mn N6 O8.5 -","- C30 H24 Cl2 Mn N6 O13 -","- C60 H48 Cl4 Mn2 N12 O26 -","2","1","JZ1009","Chen, X.-M.; Wang, R.-Q.; Xu, Z.-T.","Tris(2,2'-bipyridine)manganese(II) Perchlorate Hemihydrate","Acta Crystallographica Section C","1995","51","5","820","822","10.1107/S0108270194012242","","","0.71073","MoKα","","","0.0583","","","0.0736","","","","","3.02","3.02","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003464","13.457","0.001","14.082","0.002","18.845","0.001","90","","105.86","0.01","90","","3435.2","0.6","127","2","127","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2,3,7,8,12,13,17,18-Octaethylporphinato)perchloratoanganese(III)","","- C36 H44 Cl Mn N4 O4 -","- C36 H44 Cl Mn N4 O4 -","- C144 H176 Cl4 Mn4 N16 O16 -","4","1","JZ1011","Cheng, B.; Scheidt, W. R.","(2,3,7,8,12,13,17,18-Octaethylporphinato)perchloratomanganese(III)","Acta Crystallographica Section C","1995","51","5","825","828","10.1107/S0108270194013181","","","0.71073","MoKα","","0.0612","0.0463","","0.117","0.109","","","","1.067","1.101","1.101","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003465","7.834","0.002","10.052","0.001","10.467","0.001","82.818","0.008","68.423","0.008","75.53","0.02","741.7","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","trans-Dipyridiniomethane-Tetrafluorodichloroosmate(IV) Hydrate","trans-Dipyridiniomethane-Tetrafluorodichloroosmate(IV) Hydrate","","- C11 H14 Cl2 F4 N2 O Os -","- C11 H14 Cl2 F4 N2 O Os -","- C22 H28 Cl4 F8 N4 O2 Os2 -","2","1","JZ1020","Bruhn, C.; Preetz, W.","Dipyridiniomethane <i>trans</i>-Dichlorotetrafluoroosmate(IV) Hydrate, <i>trans</i>-[(C~5~H~5~N)~2~CH~2~][OsF~4~Cl~2~].H~2~O","Acta Crystallographica Section C","1995","51","5","865","867","10.1107/S0108270194011960","","","0.71069","MoKα","","0.0366","0.0202","","0.0611","0.0484","","","","1.143","1.055","1.055","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003466","24.166","0.003","8.903","0.003","11.84","0.003","90","","95.074","0.003","90","","2537.4","1.1","293","2","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-N'-[1,1'-ditiobis(phenylene)]bis(5'-metoxy-salicylideneimine)","","- C28 H24 N2 O4 S2 -","- C28 H24 N2 O4 S2 -","- C112 H96 N8 O16 S8 -","4","0.5","KA1077","Ruiz-Pérez, C.; González-Platas, J.; Rodríguez-Romero, F. V.; Gili, P.; Martín-Zarza, P.; Martín-Reyes, G.; Solans, X.","4,4'-Dimethoxy-2,2'-[dithiobis(<i>o</i>-phenylenenitrilomethylidyne)]diphenol","Acta Crystallographica Section C","1995","51","5","1016","1018","10.1107/S0108270194008760","","","0.71073","MoKα","","","0.039","","","0.065","","","","","0.879","0.879","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003467","9.976","0.004","29.601","0.006","14.189","0.005","90","","107.74","0.02","90","","3991","2","223","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H35 N3 O2 P2 Re S3 -","- C40 H35 N3 O2 P2 Re S3 -","- C160 H140 N12 O8 P8 Re4 S12 -","4","1","KA1086","Hübener, R.; Abram, U.; Strähle, J.","<i>trans</i>-Hydroxotris(isothiocyanato)bis(triphenylphosphine)rhenium(IV) Methanol Solvate","Acta Crystallographica Section C","1995","51","5","876","878","10.1107/S0108270194008498","","","0.71073","MoKα","","","0.032","","","0.036","","","","","1.286","1.286","","","","","has coordinates","194546","2020-10-21","18:00:00",""
"2003468","8.478","0.003","8.386","0.003","16.719","0.007","90","","92.73","0.03","90","","1187.3","0.8","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H16 N2 O -","- C13 H16 N2 O -","- C52 H64 N8 O4 -","4","1","KA1096","Sudha, L.; Subramanian, K.; Sivaraman, J.; Ramakrishnan, V. T.; Steiner, Th.; Koellner, G.","5-(Isopropylamino)-8-methyl-2-quinolone","Acta Crystallographica Section C","1995","51","5","1026","1028","10.1107/S0108270194012813","","","1.54184","CuKα","","","0.0747","","","0.089","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003469","17.721","0.002","19.714","0.002","10.49","0.001","90","","90","","90","","3664.7","0.7","293","2","153","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","1,1-Dimethyl-5-trimethylsilyl-1,3,3a,4,6,7,8,9-octahydro1-silanaphtho- [1,2 c] furan","","- C17 H30 O Si2 -","- C17 H30 O Si2 -","- C136 H240 O8 Si16 -","8","1","KA1100","Pohl, E.; Herbst-Irmer, R.; Groth, U.; Eckenberg, P.","<i>rac</i>-1,1,4-Trimethyl-5-trimethylsilyl-1,3,3a,4,6,7,8,9-octahydro-1-silanaphtho[1,2-<i>c</i>]furan at 153 K","Acta Crystallographica Section C","1995","51","5","891","892","10.1107/S0108270194012576","","","0.71073","MoKα","","0.0464","0.0361","","0.0927","0.0842","","","","1.068","1.063","1.063","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003470","7.275","0.003","7.711","0.0007","14.293","0.001","90.152","0.007","98.77","0.01","100.49","0.02","778.8","0.3","298","3","","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H19 Cu N5 O2 S -","- C12 H19 Cu N5 O2 S -","- C24 H38 Cu2 N10 O4 S2 -","2","1","KH1000","Tahirov, T. H.; Lu, T.-H.; Luh, H.; Lai, C.-Y.; Chung, C.-S.","[3,9-Dimethyl-4,8-diaza-3,8-undecadiene-2,10-dione dioximato(1‒)](thiocyanato)copper(II) and [3,6,6,9-Tetramethyl-4,8-diaza-3,8-undecadiene-2,10-dione dioximato(1‒)](isothiocyanato)copper(II)","Acta Crystallographica Section C","1995","51","5","846","849","10.1107/S0108270194012898","","","0.71073","MoKα","","","0.064","","","0.099","","","","","2.37","2.37","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003471","8.099","0.002","10.638","0.002","19.87","0.002","90","","92.7","0.02","90","","1710","0.6","298","3","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H23 Cu N5 O2 S -","- C14 H23 Cu N5 O2 S -","- C56 H92 Cu4 N20 O8 S4 -","4","1","KH1000","Tahirov, T. H.; Lu, T.-H.; Luh, H.; Lai, C.-Y.; Chung, C.-S.","[3,9-Dimethyl-4,8-diaza-3,8-undecadiene-2,10-dione dioximato(1‒)](thiocyanato)copper(II) and [3,6,6,9-Tetramethyl-4,8-diaza-3,8-undecadiene-2,10-dione dioximato(1‒)](isothiocyanato)copper(II)","Acta Crystallographica Section C","1995","51","5","846","849","10.1107/S0108270194012898","","","0.71073","MoKα","","","0.031","","","0.05","","","","","1.3","1.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003472","8.106","0.002","20.135","0.004","10.399","0.002","90","","102.77","0.03","90","","1655.3","0.6","293","","","","","","","","","","see text","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H36 Cl8 Hg4 N4 O4 -","- C16 H36 Cl8 Hg4 N4 O4 -","- C32 H72 Cl16 Hg8 N8 O8 -","2","0.5","KH1002","Wu, D.-D.; Mak, T. C. W.","Mercury(II) Chloride Adduct of a Betaine Derivative: Bis[(dimethyl)(2-dimethylaminoethyl)ammonioacetato]tetrakis[dichloromercury(II)]","Acta Crystallographica Section C","1995","51","5","857","859","10.1107/S0108270194012345","","","0.71073","MoKα","","","0.063","","","0.074","","","","","1.25","1.25","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003473","8.532","0.001","14.946","0.001","12.022","0.001","90","","95.24","0.01","90","","1526.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","ethyl 1,2,4,5-tetrahydro-3H,6H,10H-1-benzopyrano[9,9a,1-gh]quinolizin- 10-one-9-oate","","- C18 H19 N O4 -","- C18 H19 N O4 -","- C72 H76 N4 O16 -","4","1","KH1015","Yip, B.-C.; Fun, H.-K.; Sivakumar, K.; Zhou, Z.-Y.; Shawkataly, O. B.; Teoh, S.-G.","Coumarin 314","Acta Crystallographica Section C","1995","51","5","956","958","10.1107/S010827019401317X","","","0.71073","MoKα","","0.072","0.0432","","0.1322","0.1228","","","","0.98","1.198","1.198","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003474","15.273","0.001","15.273","0.001","27.399","0.003","90","","90","","120","","5535","0.8","293","2","150","1","","","","","","","Crystals were grown from ethyl acetate","5","P 65","P 65","170","","Benzyl 2-acetimido-4-azido-3-O-benzyl-6-O-(tert-butyldiphenylsilyl)- 2,4-dideoxy-β-D-glucopyranoside","","- C38 H42 N4 O6 Si -","- C38 H42 N4 O6 Si -","- C228 H252 N24 O36 Si6 -","6","1","LI1129","Barnes, J. C.; Field, R. A.","Benzyl 2-Acetamido-4-azido-3-<i>O</i>-benzoyl-6-<i>O</i>-(<i>tert</i>-butyldiphenylsilyl)-2,4-dideoxy-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section C","1995","51","5","1018","1020","10.1107/S0108270194012138","","","0.71069","MoKα","","0.0701","0.04","","0.1141","0.0919","","","","0.562","0.635","0.635","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003475","14.904","0.004","12.434","0.002","8.645","0.003","90","","93.12","0.02","90","","1599.7","0.7","293","","","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C14 H10 Fe N2 Na O10 -","- C14 H10 Fe N2 Na O10 -","- C56 H40 Fe4 N8 Na4 O40 -","4","1","MU1094","Cousson, A.; Nectoux, F.; Robert, F.; Rizkalla, E. N.","Sodium Bis(dipicolinato)ferrate(III) Dihydrate","Acta Crystallographica Section C","1995","51","5","838","840","10.1107/S0108270194005561","","","0.71073","MoKα","","","0.0306","","","0.0343","","","","","1.08","1.08","","","","","has coordinates","190396","2020-10-21","18:00:00",""
"2003476","10.32","0.008","16.094","0.007","9.546","0.004","105.3","0.04","91.66","0.05","83.68","0.05","1520","1.5","296","","","","","","","","","","recrystallized from ethanol","7","P -1","-P 1","2","","","","- C28 H22 F6 N2 Ni O4 S2 -","- C27 H21 F6 N2 Ni O4 S3 -","- C54 H42 F12 N4 Ni2 O8 S6 -","2","1","MU1115","Xiong, R.-G.; You, X.-Z.; Dong, J.-X.; Huang, X.-Y.","Bis(3-methylpyridine)bis[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato]nickel(II)","Acta Crystallographica Section C","1995","51","5","835","837","10.1107/S0108270194011935","","","0.71069","MoKα","","","0.058","","","0.068","","","","","1.53","1.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003477","19.951","0.006","7.17","0.002","19.761","0.008","90","","90","","90","","2826.8","1.6","291","","","","","","","","","","","6","P b n a","-P 2ac 2b","60","","","","- C12 H18 Br N3 O Zn -","- C12 H18 Br N3 O Zn -","- C96 H144 Br8 N24 O8 Zn8 -","8","1","MU1129","Haber, V.; Fábry, J.; Petříček, V.","A New Schiff Base Complex: {<i>N</i>-[3-(2-Aminoethylamino)propyl]salicylideneaminato-<i>O</i>,<i>N</i>,<i>N</i>',<i>N</i>''}bromozinc(II)","Acta Crystallographica Section C","1995","51","5","884","887","10.1107/S010827019401245X","","","0.56087","AgKα(Pdfilter)","","","","","","0.0777","","","","","2.65","2.65","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003478","15.75","0.003","6.112","0.002","13.704","0.003","90","","105.98","0.03","90","","1268.2","0.6","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,3,5,7-tetramethyl-2,4,6,8(1H,3H,5H,7H)-pyrimido[4,5-g]pteridinetetrone","","- C12 H12 N6 O4 -","- C12 H12 N6 O4 -","- C48 H48 N24 O16 -","4","0.5","MU1130","Romerosa, A.; Colacio, E.; Suárez-Varela, J.; Avila-Rosón, J. C.; Hidalgo, M. A.; Romero-Garzón, J.","Oxidation of 5,6-Diamino-1,3-dimethyluracil by Metal Ions: Structure of 1,3,6,8-Tetramethyl-2,4,7,9(1<i>H</i>,3<i>H</i>,6<i>H</i>,8<i>H</i>)-pyrimido[4,5-<i>g</i>]pteridinetetrone","Acta Crystallographica Section C","1995","51","5","1005","1007","10.1107/S0108270194009595","","","0.71069","MoKα","","0.2251","0.0482","","0.169","0.0526","","","","","2.3091","2.3091","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003479","7.349","0.003","7.535","0.003","14.539","0.005","90","","90","","90","","805.1","0.5","297","2","297","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","potassium D-3-phosphoglycerate","","- C3 H6 K O7 P -","- C3 H6 K O7 P -","- C12 H24 K4 O28 P4 -","4","1","MU1133","Lis, T.; Jerzykiewicz, L. B.","Potassium <small>D</small>-3-Phosphoglycerate and Cyclohexylammonium <small>D</small>-3-Phosphoglycerate Hydrate","Acta Crystallographica Section C","1995","51","5","1001","1005","10.1107/S0108270194010474","","","0.71069","MoKα","","0.0313","0.0264","","0.0726","0.0703","","","","1.123","1.131","1.131","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003480","11.332","0.006","22.406","0.011","5.783","0.003","90","","90","","90","","1468.3","1.3","","","85","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","Cyclohexylammonium D-3-phosphoglycerate monohydrate","","- C9 H22 N O8 P -","- C9 H22 N O8 P -","- C36 H88 N4 O32 P4 -","4","1","MU1133","Lis, T.; Jerzykiewicz, L. B.","Potassium <small>D</small>-3-Phosphoglycerate and Cyclohexylammonium <small>D</small>-3-Phosphoglycerate Hydrate","Acta Crystallographica Section C","1995","51","5","1001","1005","10.1107/S0108270194010474","","","0.71069","MoKα","","","0.0433","","","0.1037","","","","","1.061","1.061","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003481","15.369","0.004","14.399","0.007","13.772","0.003","90","","90.88","0.07","90","","3047.4","1.8","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis-dioxo ((N,N,N',N'-tetrakis (2-pyridylmethyl-2-ol-1,3-propanediamine) -divanadium (V) Iodide dihydrate ((VO~2~)~2~ (TPHPN))I.2H~2~O","","- C27 H33 I N6 O7 V2 -","- C27 H33 I N6 O7 V2 -","- C108 H132 I4 N24 O28 V8 -","4","1","MU1137","Neves, A.; Vencato, I.; Hörner, M.; Fenner, H.","μ-[<i>N</i>,<i>N</i>-Bis(2-pyridylmethyl-1κ<i>N</i>)-<i>N</i>',<i>N</i>'-bis(2-pyridylmethyl-2κ<i>N</i>)-1,3-diaminopropan-2-olato]-1κ<i>N</i>,2κ<i>N</i>',1:2κ^2^<i>O</i>-bis(dioxovanadium)(1+) Iodide Dihydrate, [(VO~2~)~2~(TPHPN)]I.2H~2~O","Acta Crystallographica Section C","1995","51","5","809","811","10.1107/S0108270194009066","","","0.71073","MoKα","","","0.0424","","","0.0516","","","","","2.7","2.7","","","","","has coordinates","206184","2020-10-21","18:00:00",""
"2003482","7.296","0.004","7.451","0.003","9.333","0.004","87.77","0.05","79.45","0.05","82.03","0.04","493.9","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","tripotassium phosphoglycolate dihydrate","","- C2 H6 K3 O8 P -","- C2 H6 K3 O8 P -","- C4 H12 K6 O16 P2 -","2","1","MU1147","Lis, T.","Tripotassium Phosphoglycolate Dihydrate and Tris(cyclohexylammonium) Phosphoglycolate Trihydrate","Acta Crystallographica Section C","1995","51","5","997","1001","10.1107/S0108270194011297","","","0.71069","MoKα","","","0.0263","","","0.0665","","","","","1.082","1.082","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003483","22.512","0.009","19.613","0.009","6.201","0.003","90","","90","","90","","2738","2","","","85","2","","","","","","","","5","P n a 21","P 2c -2n","33","","tris(cyclohexylammonium) phosphoglycolate trihydrate","","- C20 H50 N3 O9 P -","- C20 H50 N3 O9 P -","- C80 H200 N12 O36 P4 -","4","1","MU1147","Lis, T.","Tripotassium Phosphoglycolate Dihydrate and Tris(cyclohexylammonium) Phosphoglycolate Trihydrate","Acta Crystallographica Section C","1995","51","5","997","1001","10.1107/S0108270194011297","","","0.71069","MoKα","","","0.0431","","","0.1157","","","","","1.096","1.096","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003484","7.595","0.005","10.146","0.006","15.005","0.01","77.28","0.05","75.93","0.05","69.39","0.05","1038.2","1.2","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H21 Mn N2 O6 -","- C23 H21 Mn N2 O6 -","- C46 H42 Mn2 N4 O12 -","2","1","MU1150","Dutta, S.; Manivannan, V.; Giri Babu, L.; Pal, S.","A Mononuclear Manganese(III) Schiff Base Complex, [Mn(C~14~H~10~N~2~O~2~)(C~8~H~7~O~3~)(CH~4~O)]","Acta Crystallographica Section C","1995","51","5","813","815","10.1107/S0108270194012151","","","0.71073","MoKα","","","0.047","","","0.0595","","","","","0.9","0.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003485","9.3055","0.0006","8.4118","0.0006","12.3965","0.0007","90","","98.731","0.007","90","","959.1","0.11","293","2","293","2","","","","","","","Laboratory of Medicinal Chemistry, Li\`ege","5","P 1 21/n 1","-P 2yn","14","","3-Methyl-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-Dioxide Monohydrate","","- C7 H9 N3 O3 S -","- C7 H9 N3 O3 S -","- C28 H36 N12 O12 S4 -","4","1","MU1153","Dupont, L.; de Tullio, P.; Pirotte, B.; Masereel, B.; Delarge, J.","3-Methyl-4<i>H</i>-pyrido[4,3-<i>e</i>][1,2,4]thiadiazine 1,1-Dioxide Monohydrate","Acta Crystallographica Section C","1995","51","5","946","948","10.1107/S0108270194013235","","","1.5418","CuKα","","0.0394","0.0375","","0.102","0.1012","","","","1.089","1.125","1.125","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2003486","13.899","0.002","12.156","0.002","15.781","0.003","90","","105.84","0.02","90","","2565.1","0.8","294","2","294","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","Zn(ω-nap)~2~ dipyridine adduct","bis(ω-nitroacetophenonato)Zn(II) cis-dipyridine adduct","","- C26 H22 N4 O6 Zn -","- C26 H22 N4 O6 Zn -","- C104 H88 N16 O24 Zn4 -","4","0.5","MU1155","Falvello, L. R.; Hicke, S.; Mueller, T. E.","<i>cis</i>-Dipyridine Complex of Bis(ω-nitroacetophenonato)zinc(II)","Acta Crystallographica Section C","1995","51","5","859","861","10.1107/S010827019401293X","","","0.71073","MoKα","","0.0749","0.0386","","0.0818","0.0708","","","","1.065","1.101","1.101","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003487","8.186","0.001","11.107","0.001","11.515","0.002","80.28","0.01","76.36","0.03","68.73","0.01","944.1","0.2","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C40 H44 N12 Ni -","- C40 H40 N12 Ni -","- C40 H40 N12 Ni -","1","0.5","NA1102","Muñoz, M. C.; Cano, J.; Ruiz, R.; Lloret, F.; Faus, J.","The 7,7,8,8-Tetracyanoquinodimethane Salt of (<i>C</i>-<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane)nickel(II), [Ni(<i>C</i>-<i>meso</i>-Me~6~[14]aneN~4~)](TCNQ)~2~","Acta Crystallographica Section C","1995","51","5","873","876","10.1107/S0108270194010401","","","0.71069","MoKα","","","0.042","","","0.042","","","","","1.7","1.7","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003488","12.719","0.002","12.906","0.002","16.93","0.003","68.2","0.02","68.23","0.02","64.08","0.02","2247.2","0.8","294","","","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H28 Cl3 N4 Rh Sn -","- C44 H28 Cl3 N4 Rh Sn -","- C88 H56 Cl6 N8 Rh2 Sn2 -","2","1","NA1113","Licoccia, S.; Paolesse, R.; Boschi, T.; Bandoli, G.; Dolmella, A.","Trichlorotin(II)‒(<i>meso</i>-Tetraphenylporphyrinato)rhodium(III), a Porphyrin Derivative with an Rh—Sn Bond","Acta Crystallographica Section C","1995","51","5","833","835","10.1107/S0108270194012424","","","0.71073","MoKα","","","0.057","","","0.08","","","","","1.72","1.72","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003489","17.842","0.003","5.489","0.001","20.045","0.002","90","","105.18","0.01","90","","1894.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[(Aqua)(glicinato)(3,4,7,8-tetramethyl-1,10-phenanthroline) copper(II)] nitrate.","","- C18 H22 Cu N4 O6 -","- C18 H22 Cu N4 O6 -","- C72 H88 Cu4 N16 O24 -","4","1","NA1125","Alvarez-Larena, A.; Briansó-Penalva, J. L.; Piniella, J. F.; Moreno-Esparza, R.; Ruiz-Ramírez, L.; Ferrer-Sueta, G.","Aqua(glycinato)(3,4,7,8-tetramethyl-1,10-phenanthroline)copper(II) Nitrate","Acta Crystallographica Section C","1995","51","5","852","854","10.1107/S0108270194013041","","","0.71069","MoKα","","0.0467","0.0406","","0.0973","0.0918","","","","1.253","1.245","1.245","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003490","12.995","0.001","7.161","0.001","16.187","0.001","90","","112.37","0.01","90","","1393","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3-Hydroxyimino-5α,13α,14β,17α-lanosta-8,24-dien-20-oic Acid","","- C30 H47 N O3 -","- C30 H47 N O3 -","- C60 H94 N2 O6 -","2","1","NA1127","Argay, G.; Kálmán, A.; Vladimirov, S.; Zivanov-Stakic, D.; Ribár, B.","3-Hydroxyimino-5α,13α,14β,17α-lanosta-8,24-dien-20-oic Acid","Acta Crystallographica Section C","1995","51","5","958","960","10.1107/S010827019401228X","","","1.5418","CuKα","","0.0348","0.0337","","0.1024","0.0968","","","","1.117","1.064","1.064","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003491","25.601","0.003","8.3508","0.0014","6.8213","0.001","90","","90","","90","","1458.3","0.4","122","2","122","2","","","","","","","","4","P c a 21","P 2c -2ac","29","(R,S)-1-phenylethylammonium (R,S)-mandelate","(R,S)-1-Phenylethylammonium (R,S)-2-hydroxy-2-phenylethanoate","","- C16 H19 N O3 -","- C16 H19 N O3 -","- C64 H76 N4 O12 -","4","1","NA1135","Lopez de Diego, H.","(<i>R</i>,<i>S</i>)-1-Phenylethylammonium (<i>R</i>,<i>S</i>)-Mandelate","Acta Crystallographica Section C","1995","51","5","935","937","10.1107/S010827019401303X","","","1.5418","CuKα","","0.0304","0.0288","","0.0764","0.0749","","","","1.053","1.058","1.058","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003492","8.217","0.007","31.54","0.01","10.384","0.004","90","","98.09","0.04","90","","2664","3","293","","293","","","","","","","","Janssen Research Foundation, Belgium","5","P 1 21/n 1","-P 2yn","14","","N-[2-(3-Methoxyphenoxy)propyl]-m-tolylacetamidinium p-Toluenesulfonate Monohydrate","","- C26 H34 N2 O6 S -","- C33 H41 N2 O6 S -","- C132 H164 N8 O24 S4 -","4","1","NA1140","Blaton, N. M.; Peeters, O. M.; De Ranter, C. J.","<i>N</i>-[2-(3-Methoxyphenoxy)propyl]-<i>m</i>-tolylacetamidinium <i>p</i>-Toluenesulfonate Monohydrate (Xylamidine)","Acta Crystallographica Section C","1995","51","5","991","993","10.1107/S0108270194013818","","","1.54184","CuKα","","0.0775","0.0511","","0.1575","0.1389","","","","1.08","1.078","1.078","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003493","10.1429","0.0002","10.1429","0.0002","10.1429","0.0002","90","","90","","90","","1043.49","0.04","295","","","","","","","","","","Powder","3","F d 3 m","F 4d 2 3 -1d","","","","","- O7 Ru2 Y2 -","- O16 Ru Y -","- O128 Ru8 Y8 -","8","","OH1070","Kennedy, B. J.","Structure Refinement of Y~2~Ru~2~O~7~ by Neutron Powder Diffraction","Acta Crystallographica Section C","1995","51","5","790","792","10.1107/S0108270194013168","","neutron","","neutron","","","0.0602","","","0.0794","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003494","11.049","0.004","18.659","0.006","11.602","0.004","90","","117.08","0.02","90","","2129.7","1.3","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(±)-3-methyl-1-diphenyl-2-butyl 3-acetamidocrotonate","","- C23 H27 N O3 -","- C23 H27 N O3 -","- C92 H108 N4 O12 -","4","1","PA1050","Chiaroni, A.; Riche, C.; Dumas, F.; Potin, D.; d'Angelo, J.","(±)-3-Methyl-1,1-diphenyl-2-butyl 3-Acetamidocrotonate and its Hydrogenation Product","Acta Crystallographica Section C","1995","51","5","967","970","10.1107/S0108270193007383","","","1.5418","CuKα","","","0.051","","","0.07","","","","","0.67","0.67","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2003495","22.41","0.03","20.76","0.02","9.195","0.006","90","","90","","90","","4278","8","293","","293","","","","","","","","from chemical synthesis","4","P c c n","-P 2ab 2ac","56","","(±)-3-methyl-1-diphenyl-2-butyl 3-acetamidobutanoate","","- C23 H29 N O3 -","- C23 H29 N O3 -","- C184 H232 N8 O24 -","8","1","PA1050","Chiaroni, A.; Riche, C.; Dumas, F.; Potin, D.; d'Angelo, J.","(±)-3-Methyl-1,1-diphenyl-2-butyl 3-Acetamidocrotonate and its Hydrogenation Product","Acta Crystallographica Section C","1995","51","5","967","970","10.1107/S0108270193007383","","","1.5418","CuKα","","","0.105","","","0.145","","","","","1.05","1.05","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2003496","9.791","0.002","18.974","0.003","10.358","0.002","90","","117.51","0.02","90","","1706.7","0.6","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H23 N O6 -","- C17 H23 N O6 -","- C68 H92 N4 O24 -","4","1","PA1057","Bocelli, G.; Cantoni, A.; Bigi, F.; Sartori, G.; Lina, F.","<i>tert</i>-Butyl 2-[(Hydroxy)(5-hydroxy-1,3-benzodioxol-6-yl)methyl]pyrrolidine-1-carboxylate","Acta Crystallographica Section C","1995","51","5","993","995","10.1107/S0108270193014118","","","1.54178","CuKα","","","0.059","","","0.066","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003497","14.29","0.003","13.571","0.002","27.314","0.008","90","","90","","90","","5297","2","296","","","","","","","","","","from acetone","6","P b c a","-P 2ac 2ab","61","","","","- C25 H27 Nb O5 P2 W -","- C25 H27 Nb O5 P2 W -","- C200 H216 Nb8 O40 P16 W8 -","8","1","PA1107","Oudet, P.; Kubicki, M. M.; Moise, C.","Pentacarbonyl-1κ<i>C</i>,2κ^4^<i>C</i>-bis[1,1(η^5^)-cyclopentadienyl](dimethylphenylphosphine-2κ<i>P</i>)-μ-dimethylphosphanido-niobiumtungsten","Acta Crystallographica Section C","1995","51","5","811","813","10.1107/S0108270194007262","","","0.71073","MoKα","","","0.043","","","0.051","","","","","2.22","2.22","","","","","has coordinates","190987","2020-10-21","18:00:00",""
"2003498","8.955","0.005","11.085","0.003","17.45","0.005","83.9","0.02","78.8","0.01","85.3","0.02","1686.2","1.2","293","","293","","","","","","","","","4","P -1","-P 1","2","Sel de maprotiline","N-méthyl-N-[Dibenzo(b,e)]-bicyclo-[2,2,2]-octadi ène]-propylcarbamate de N-méthyl-N-[Dibenzo(b,e)]-bicyclo-[2,2,2]-octadi ène]-propylammonium","","- C41 H47 N2 O2.5 -","- C41 H47 N2 O2.5 -","- C82 H94 N4 O5 -","2","1","PA1112","Brouant, P.; Reboul, J.-P.; Siri, D.; Soyfer, J.-C.; Barbe, J.; Pèpe, G.","Un sel de Maprotiline (Ludiomil), Médicament Psychotrope, C~20~H~24~N^+^.C~21~H~22~NO~2~^{-^}.0,5H~2~O","Acta Crystallographica Section C","1995","51","5","970","974","10.1107/S0108270194006049","","","0.7019","MoKα","","0.041","0.041","","0.042","0.042","","","","1.01","1.01","1.01","","","","","has coordinates","190530","2020-10-21","18:00:00",""
"2003499","18.169","0.003","10.932","0.003","16.12","0.003","90","","117.17","0.02","90","","2848.5","1.2","293","","","","","","","","","","\'evaporation d'une solution m\'ethanolique","7","C 1 2/c 1","-C 2yc","15","","","","- C6 H17 Cl2 N5 O Pt S -","- C6 H17 Cl2 N5 O Pt S -","- C48 H136 Cl16 N40 O8 Pt8 S8 -","8","1","PA1121","Viossat, B.; Nguyen-Huy Dung; Rodier, N.; Bentefrit, F.","Chlorure de <i>cis</i>-Chloro(diméthyl sulfoxyde)(metformine)platine(II)","Acta Crystallographica Section C","1995","51","5","878","880","10.1107/S0108270194009674","","","0.7107","MoKα","","","0.032","","","0.038","","","","","1.2","1.2","","","","","has coordinates","199682","2020-10-21","18:00:00",""
"2003500","8.174","0.001","7.228","0.001","36.114","0.003","90","","86.96","0.01","90","","2130.7","0.4","293","","","","","","","","","","from ethanol/nitromethane (20/80 v/v)","5","C 1 c 1","C -2yc","9","","","","- C21 H35 Cl N2 O -","- C21 H35 Cl N2 O -","- C84 H140 Cl4 N8 O4 -","4","1","PA1122","Aubry, A.; Brembilla, A.; Faivre, V.; Lochon, P.","5-Dodecyl-2-(1-hydroxyethyl)benzimidazolium Chloride","Acta Crystallographica Section C","1995","51","5","893","894","10.1107/S0108270194011273","","","1.5418","CuKα","","","0.0463","","","0.0541","","","","","1.725","1.725","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003501","17.154","0.002","5.748","0.001","17.657","0.002","90","","111.96","0.01","90","","1614.7","0.4","291","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 N2 O2 S -","- C16 H22 N2 O2 S -","- C64 H88 N8 O8 S4 -","4","1","PA1134","Tinant, B.; Declercq, J.-P.; Abdellaoui, H.; Depreux, P.; Lesieur, D.","<i>N</i>,<i>N</i>-Dimethyl-2-[7-(methylaminosulfonylmethyl)-1-naphthyl]ethylamine, the Naphthalenic Bioisostere of Sumatriptan","Acta Crystallographica Section C","1995","51","5","916","918","10.1107/S0108270194011601","","","1.54184","CuKα","","","0.042","","","0.05","","","","","0.9","0.9","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003502","8.261","0.004","8.847","0.004","17.807","0.007","95.19","0.03","95.14","0.03","113.9","0.04","1173.5","1","292","","","","","","","","","","\'evaporation d'une solution dans l'\'ethanol","5","P -1","-P 1","2","","","","- C21 H40 Br N O -","- C21 H40 Br N O -","- C42 H80 Br2 N2 O2 -","2","1","PA1146","Rodier, N.; Dugué, J.; Céolin, R.; Baziard-Mouysset, G.; Stigliani, J.-L.; Payard, M.","Bromure de Benzododécinium Monohydraté","Acta Crystallographica Section C","1995","51","5","954","956","10.1107/S0108270194014435","","","0.71073","MoKα","","","0.068","","","0.056","","","","","1.67","1.67","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003503","10.207","0.008","26.978","0.012","8.744","0.006","90","","106.96","0.03","90","","2303","3","293","","293","","","","","","","","synth\`ese","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-(4-chlorophényl)-3a-méthyl- 5-phényl-3,3a,4,11-tétrahydro-3H-[1,2,4] triazolo [4,3-a] [1,5] benzodiazépine","","- C26 H23 Cl N4 O2 -","- C26 H23 Cl N4 O2 -","- C104 H92 Cl4 N16 O8 -","4","1","PA1148","Chiaroni, A.; Riche, C.; Baouid, A.; Benharref, A.; Hasnaoui, A.; Lavergne, J.-P.","Ethyl 3-(4-Chlorophényl)-3a-méthyl-5-phényl-3,3a,4,11-tétrahydro-3<i>H</i>-[1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazépine-1-carboxylate, C~26~H~23~ClN~4~O~2~","Acta Crystallographica Section C","1995","51","5","961","963","10.1107/S0108270194011418","","","1.5418","CuKα","","","0.06","","","0.059","","","","","1.99","1.99","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003504","20.709","0.003","7.777","0.0014","17.276","0.003","90","","143.279","0.005","90","","1663.6","0.5","293","2","293","2","","","","","","","Lab. of Medicinal Chemistry, Li\`ege","5","C 1 c 1","C -2yc","9","","3-methyl-4H-pyrido[3,2-e][1,2,4]thiadiazine 1,1-dioxide","","- C7 H7 N3 O2 S -","- C7 H7 N3 O2 S -","- C56 H56 N24 O16 S8 -","8","2","PA1150","Dupont, L.; Pirotte, B.; de Tullio, P.; Masereel, B.; Delarge, J.","3-Methyl-4<i>H</i>-pyrido[3,2-<i>e</i>][1,2,4]thiadiazine 1,1-Dioxide","Acta Crystallographica Section C","1995","51","5","944","946","10.1107/S0108270194013569","","","1.5418","CuKα","","0.0274","0.0268","","0.0693","0.0691","","","","1.108","1.117","1.117","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003505","7.491","0.001","12.188","0.002","15.744","0.003","90","","97.95","0.01","90","","1423.6","0.4","293","","","","","","","","","","Kristallisation (CH~3~OH)","3","P 1 21 1","P 2yb","4","","","","- C31 H44 O7 -","- C31 H44 O7 -","- C62 H88 O14 -","2","1","SE1056","Gzella, A.; Wrzeciono, U.; Zaprutko, L.","Triterpenoide. VII. Über die Struktur von neuen 2-oxa- und 1,2-seco-Derivaten des Olenanolsäuremethylesters","Acta Crystallographica Section C","1995","51","5","908","912","10.1107/S010827019400973X","","","1.54178","CuKα","","","0.044","","","0.05","","","","","5.2148","5.2148","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003506","7.709","0.001","18.293","0.002","21.082","0.003","90","","90","","90","","2973","0.7","293","","","","","","","","","","Kristallisation (CH~3~OH)","3","P 21 21 21","P 2ac 2ab","19","","","","- C32 H46 O7 -","- C32 H46 O7 -","- C128 H184 O28 -","4","1","SE1056","Gzella, A.; Wrzeciono, U.; Zaprutko, L.","Triterpenoide. VII. Über die Struktur von neuen 2-oxa- und 1,2-seco-Derivaten des Olenanolsäuremethylesters","Acta Crystallographica Section C","1995","51","5","908","912","10.1107/S010827019400973X","","","1.54178","CuKα","","","0.05","","","0.046","","","","","3.8027","3.8027","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003507","10.197","0.007","10.623","0.001","20.08","0.003","90","","101.53","0.02","90","","2131.2","1.5","293","2","","","","","","","","","Synthese, Kristallisation aus CH~3~OH","4","C 1 c 1","C -2yc","9","","","","- C19 H21 N9 O7 -","- C19 H21 N9 O7 -","- C76 H84 N36 O28 -","4","1","SH1092","Gzella, A.; Wrzeciono, U.","Azoles. 38. Struktur der Molekularverbindung von 3,5-Dinitroindazol, 5-Nitro-3-piperazinoindazol und Methanol","Acta Crystallographica Section C","1995","51","5","963","967","10.1107/S0108270194008954","","","1.54178","CuKα","","","0.0889","","","0.0947","","","","","1.8529","1.8529","","","","","has coordinates","194546","2020-10-21","18:00:00",""
"2003508","9.4","0.001","11.029","0.001","9.153","0.001","96.144","0.009","96.84","0.01","65.235","0.007","853.79","0.16","173","1","173","","","","","","","","see text","3","P 1","P 1","1","α,α-allo-trehalose trihydrate","α-D-allopyranosyl α-D-allopyranoside trihydrate","","- C12 H28 O14 -","- C12 H28 O14 -","- C24 H56 O28 -","2","2","SH1108","Linden, A.; Lee, C. K.","α,α-<i>allo</i>-Trehalose Trihydrate","Acta Crystallographica Section C","1995","51","5","1007","1012","10.1107/S0108270194012102","","","0.71069","MoKα","","0.0285","0.027","","0.0322","0.032","","","","","1.817","1.817","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003509","7.3812","0.0011","8.4422","0.0009","12.42","0.0014","73.243","0.009","81.924","0.011","83.473","0.011","731.53","0.16","293","2","293","2","","","","","","","from methanol","6","P -1","-P 1","2","","Methyl N-(N'-4-chlorophenylaminothiocarbonyl) imidate","","- C15 H13 Cl N2 O S -","- C15 H13 Cl N2 O S -","- C30 H26 Cl2 N4 O2 S2 -","2","1","TA1022","Hajjem, B.; Jouini, T.; Harizi, A.; Baccar, B.","Methyl <i>N</i>-(4-Chlorophenylaminothiocarbonyl)benzimidate","Acta Crystallographica Section C","1995","51","5","920","922","10.1107/S0108270194011625","","","0.71069","MoKα","","0.0491","0.0382","","0.0869","0.0855","","","","1.302","1.348","1.348","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003510","14.203","0.006","14.203","0.006","22.447","0.004","90","","90","","90","","4528","3","293","2","","","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","","","","- C12 H30 Cl2 Co2 N6 O14 -","- C12 H30 Cl2 Co2 N6 O20.5 -","- C96 H240 Cl16 Co16 N48 O164 -","8","0.5","AB1161","Chen, M.-Q.; Liu, J.; Mao, Z.-W.; Hang, Q.-W.; Tang, W.-X.","Bis(diethylenetriamine-<i>N</i>'-acetato)-di-μ-hydroxo-dicobalt(III) Perchlorate","Acta Crystallographica Section C","1995","51","6","1080","1082","10.1107/S0108270194013387","","","0.7093","MoKα","","","0.051","","","0.047","","","","","4.149","4.149","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003511","5.978","0.002","4.945","0.002","20.168","0.004","90","","95.8","0.03","90","","593.1","0.3","296","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H9 Br O S -","- C13 H9 Br O S -","- C26 H18 Br2 O2 S2 -","2","1","AB1178","He, Y.; Wu, Q.; Su, G.","3-(4-Bromophenyl)-1-(3-thienyl)-2-propen-1-one (BTC)","Acta Crystallographica Section C","1995","51","6","1167","1168","10.1107/S0108270194013843","","","0.71069","MoKα","","","0.046","","","0.052","","","","","1.39","1.39","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003512","10.731","0.006","18.016","0.006","8.347","0.005","90","","90","","90","","1613.7","1.4","295","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H23 N O3 -","- C18 H23 N O3 -","- C72 H92 N4 O12 -","4","1","AB1186","Urtiaga, M. K.; Arriortua, M. I.; Badía, D.; Domínguez, E.; González-Cameno, A. M.; Ochando, L.; Reventos, M.; Debaerdemaeker, T.","The Effect of Substituents on the Crystal Structure of β-Amino Alcohols. 2-[(3,4-Dimethoxybenzyl)(methyl)amino]-2-phenylethanol","Acta Crystallographica Section C","1995","51","6","1175","1177","10.1107/S0108270194013855","","","0.71073","MoKα","","","0.052","","","0.15","","","","","0.998","0.998","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003513","9.668","0.002","8.358","0.002","25.582","0.009","90","","98.26","0.03","90","","2045.7","1","289","","","","","","","","","","synthesis","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 N8 Ni O2 -","- C21 H20 N8 Ni O2 -","- C84 H80 N32 Ni4 O8 -","4","1","AB1196","Jian, P.; Wang, S.; Suo, J.; Wang, L.; Wu, Q.","Azido[2,6-bis(2-benzimidazolyl-<i>N</i>^3^)pyridine-<i>N</i>](methanol)(methanolato)nickel(II)","Acta Crystallographica Section C","1995","51","6","1071","1073","10.1107/S0108270194011741","","","0.71073","MoKα","","","0.051","","","0.065","","","","","1.75","1.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003514","10.809","0.001","8.4044","0.0009","21.119","0.003","90","","96.63","0.01","90","","1905.7","0.4","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H22 Cu N8 O8 -","- C15 H22 Cu N8 O8 -","- C60 H88 Cu4 N32 O32 -","4","1","AB1203","Kivekäs, R.; Klinga, M.; Colacio, E.; Dominguez-Vera, J. M.; Romerosa, A.","Aqua[1,3-propanediyldiiminobis(1,3-dimethyl-5-nitrosouracilato)-κ^4^<i>N</i>^5^,<i>N</i>^6^,<i>N</i>^15^,<i>N</i>^16^]copper(II) Monohydrate","Acta Crystallographica Section C","1995","51","6","1087","1089","10.1107/S0108270194013697","","","0.71073","MoKα","","","0.04","","","0.036","","","","","2.064","2.064","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003515","8.014","0.002","8.633","0.002","12.6","0.003","90","","90.53","0.03","90","","871.7","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","11,12-seco-12,13-didehydromultiflorine perchlorate hydrate","","- C15 H25 Cl N2 O6 -","- C15 H25.07 Cl N2 O6 -","- C30 H50.14 Cl2 N4 O12 -","2","1","AB1207","Dutkiewicz, G.; Kubicki, M.; Borowiak, T.; Wysocka, W.","11,12-Seco-12,13-didehydromultiflorine Perchlorate Hydrate","Acta Crystallographica Section C","1995","51","6","1182","1184","10.1107/S0108270194011650","","","1.54178","CuKα","","0.0577","0.036","","0.1741","0.1069","","","","1.076","1.118","1.118","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003516","6.116","0.002","16.656","0.004","6.007","0.003","99.29","0.03","100.94","0.03","99.05","0.02","581.7","0.4","243","","","","","","","","","","","5","P 1","P 1","1","","","","- C5 H18 N Na O9 -","- C5 H17.5 N Na O9 -","- C10 H35 N2 Na2 O18 -","2","2","AS1110","Kashiwagi, T.; Sano, C.; Kawakita, T.; Nagashima, N.","Monosodium <small>L</small>-Glutamate Pentahydrate","Acta Crystallographica Section C","1995","51","6","1053","1056","10.1107/S0108270194014472","","","1.5418","CuKα","","","0.056","","","0.076","","","","","3.06","3.06","","","","","has coordinates","190394","2020-10-21","18:00:00",""
"2003517","8.6917","0.0007","11.576","0.001","15.006","0.003","110.1","0.02","103.8","0.01","91.465","0.009","1367.3","0.4","298","3","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H36 N4 O2 -","- C14 H32 N4 O2 -","- C42 H96 N12 O6 -","3","1.5","AS1126","Tahirov, T. H.; Lu, T.-H.; Liu, G.-S.; Chi, T.-Y.; Chung, C.-S.","Two Isomers of 5,7,12,14-Tetramethyl-1,4,8,11-tetraazacyclotetradecane","Acta Crystallographica Section C","1995","51","6","1146","1148","10.1107/S0108270194011352","","","0.71073","MoKα","","","0.051","","","0.068","","","","","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003518","8.96","0.004","11.507","0.006","8.889","0.007","97.29","0.05","97.71","0.05","105.58","0.03","862","0.9","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","Spiro[(4',4'-dimethyl-2',6'-dioxa-cyclohexane)- 1',3-(trans-4-methylene-bicyclo[3.3.0]octane)]-2,2-dimethylcarboxylate Spiro[(4',4'-dimethyl-2',6'-dioxa-cyclohexane)- 1',3-(cis-4-methylene-bicyclo[3.3.0]octane)]-2,2-dimethylcarboxylate","","- C18 H26 O6 -","- C18 H26 O6 -","- C36 H52 O12 -","2","1","AS1138","Yamada, T.; Uekusa, H.; Ohashi, Y.; Yamago, S.; Wang, X. Q.; Nakamura, E.","<i>cis</i>- and <i>trans</i>-Dimethyl Spiro[(4',4'-dimethyl-2',6'-dioxacyclohexane)-1',3-(4-methylenebicyclo[3.3.0]octane)]-2,2-dicarboxylate","Acta Crystallographica Section C","1995","51","6","1137","1139","10.1107/S010827019401276X","","","0.71073","MoKα","","0.147","0.061","","0.198","0.154","","","","1.015","1.109","1.109","","","","","has coordinates,has disorder","198601","2020-10-21","18:00:00",""
"2003519","9.4915","0.0011","11.5618","0.0014","8.9687","0.0009","98.806","0.009","99.065","0.009","112.364","0.009","874.02","0.19","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","Spiro[(4',4'-dimethyl-2',6'-dioxa-cyclohexane)- 1',3-(cis-4-methylene-bicyclo[3.3.0]octane)]-2,2-dimethylcarboxylate","","- C18 H26 O6 -","- C18 H26 O6 -","- C36 H52 O12 -","2","1","AS1138","Yamada, T.; Uekusa, H.; Ohashi, Y.; Yamago, S.; Wang, X. Q.; Nakamura, E.","<i>cis</i>- and <i>trans</i>-Dimethyl Spiro[(4',4'-dimethyl-2',6'-dioxacyclohexane)-1',3-(4-methylenebicyclo[3.3.0]octane)]-2,2-dicarboxylate","Acta Crystallographica Section C","1995","51","6","1137","1139","10.1107/S010827019401276X","","","0.71073","MoKα","","0.123","0.054","","0.159","0.129","","","","1.01","1.129","1.129","","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2003520","4.653","0.0004","15.191","0.001","26.902","0.002","90","","90","","90","","1901.5","0.2","293","2","293","2","","","","","","","synthesized from CH~2~Cl~2~--benzene system","4","P b c 21","P 2c -2b","29","","10-Hydroxybenzo[h]quinoline","","- C13 H9 N O -","- C13 H9 N O -","- C104 H72 N8 O8 -","8","2","AS1144","Kubicki, M.; Borowiak, T.; Antkowiak, W. Z.","10-Hydroxybenzo[<i>h</i>]quinoline","Acta Crystallographica Section C","1995","51","6","1173","1175","10.1107/S010827019401379X","","","1.54178","CuKα","","0.0559","0.0383","","0.1128","0.0767","","","","1.213","1.26","1.26","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003521","15.037","0.003","9.913","0.001","12.547","0.002","90","","91.29","0.01","90","","1869.8","0.5","296","","296","","","","","","","","","4","C 1 c 1","C -2yc","9","","2-bromo-2,3-dihydro-2,3-(bibenzyl-2,2'-diyl)methano-1,4-naphthoquinone","","- C25 H17 Br O2 -","- C25 H17 Br O2 -","- C100 H68 Br4 O8 -","4","1","AS1150","Tamura, H.; Oshima, T.; Matsubayashi, G.; Nagai, T.","Two Conformational Isomers of 2-Bromo-2,3-dihydro-2,3-(bibenzyl-2,2'-diyl)methano-1,4-naphthoquinone","Acta Crystallographica Section C","1995","51","6","1148","1152","10.1107/S0108270194013806","","","0.7107","MoKα","","","0.035","","","0.035","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003522","9.165","0.001","13.155","0.001","8.85","0.001","101.58","0.01","116.59","0.01","80.77","0.01","931.69","0.18","296","","296","","","","","","","","","4","P -1","-P 1","2","","2-bromo-2,3-dihydro-2,3-(bibenzyl)methano-1,4-naphthoquinone","","- C25 H17 Br O2 -","- C25 H17 Br O2 -","- C50 H34 Br2 O4 -","2","1","AS1150","Tamura, H.; Oshima, T.; Matsubayashi, G.; Nagai, T.","Two Conformational Isomers of 2-Bromo-2,3-dihydro-2,3-(bibenzyl-2,2'-diyl)methano-1,4-naphthoquinone","Acta Crystallographica Section C","1995","51","6","1148","1152","10.1107/S0108270194013806","","","0.7107","MoKα","","","0.037","","","0.04","","","","","1.48","1.48","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003523","11.9111","0.001","16.036","0.002","13.1202","0.0009","90","","93.761","0.006","90","","2500.6","0.4","296","","","","","","","","","","Recrystallization fron ethyl acetate-heptane","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H32 O6 P2 -","- C25 H32 O6 P2 -","- C100 H128 O24 P8 -","4","1","BK1023","Elnagar, H. Y.; Layman, W. J.; Fronczek, F. R.","[4,4',6,6'-Tetramethyl-(2,2'-isobutylidenedi-<i>o</i>-phenylene)] (2,6,7-Trioxa-1-phosphabicyclo[2.2.2]oct-4-ylmethyl) Phosphite, C~25~H~32~P~2~O~6~","Acta Crystallographica Section C","1995","51","6","1177","1179","10.1107/S0108270194011169","","","1.54184","CuKα","","","0.046","","","0.056","","","","","2.762","2.762","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003524","6.418","0.001","15.864","0.003","12.269","0.002","90","","102.38","0.01","90","","1220.1","0.4","296","","","","","","","","","","Prepared by authors","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H20 Cl N O3 -","- C10 H20 Cl N O3 -","- C40 H80 Cl4 N4 O12 -","4","1","BK1049","Brouillette, W. J.; Gray, G. M.; Saeed, A.","Conformationally Defined Cyclohexyl Carnitine Analogs","Acta Crystallographica Section C","1995","51","6","1160","1164","10.1107/S0108270194010322","","","1.5418","CuKα","","","0.0507","","","0.0712","","","","","2.172","2.172","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003525","12.39","0.001","8.245","0.002","13.732","0.001","90","","121.543","0.009","90","","1195.5","0.3","295","","","","","","","","","","Prepared by authors","5","C 1 c 1","C -2yc","9","","","","- C10 H20 Cl N O3 -","- C10 H20 Cl N O3 -","- C40 H80 Cl4 N4 O12 -","4","1","BK1049","Brouillette, W. J.; Gray, G. M.; Saeed, A.","Conformationally Defined Cyclohexyl Carnitine Analogs","Acta Crystallographica Section C","1995","51","6","1160","1164","10.1107/S0108270194010322","","","1.5418","CuKα","","","0.025","","","0.0332","","","","","1.415","1.415","","","","","has coordinates","208381","2020-10-21","18:00:00",""
"2003526","7.123","0.002","11.237","0.002","14.989","0.001","90","","90","","90","","1199.7","0.4","296","","","","","","","","","","Prepared by authors","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H20 Cl N O3 -","- C10 H20 Cl N O3 -","- C40 H80 Cl4 N4 O12 -","4","1","BK1049","Brouillette, W. J.; Gray, G. M.; Saeed, A.","Conformationally Defined Cyclohexyl Carnitine Analogs","Acta Crystallographica Section C","1995","51","6","1160","1164","10.1107/S0108270194010322","","","1.5418","CuKα","","","0.03","","","0.041","","","","","1.92","1.92","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2003527","6.137","0.001","19.405","0.002","7.187","0.001","90","","104.72","0.01","90","","827.8","0.2","296","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C8 H6 N2 O2 S -","- C8 H6 N2 O2 S -","- C32 H24 N8 O8 S4 -","4","1","BK1050","Gallucci, J. C.; Mathur, N.; Shechter, H.","(<i>Z</i>)-5-(2-Thienylmethylene)-2,4-imidazolidinedione","Acta Crystallographica Section C","1995","51","6","1221","1223","10.1107/S0108270194014137","","","0.71069","MoKα","","","0.041","","","0.046","","","","","1.65","1.65","","","","","has coordinates,has disorder","200210","2020-10-21","18:00:00",""
"2003528","13.256","0.002","8.644","0.003","13.484","0.002","90","","103.23","0.01","90","","1504.1","0.6","295","1","295","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 O6 Ru2 -","- C13 H8 O6 Ru2 -","- C52 H32 O24 Ru8 -","4","1","BK1081","Capparelli, M. V.; De Sanctis, Y.; Arce, A. J.","Hexacarbonyl-1κ^4^<i>C</i>,2κ^2^<i>C</i>-[μ-1κ<i>C</i>^6^:2(η^5^)-6-methylfulvene]diruthenium(<i>Ru</i>—<i>Ru</i>), [Ru~2~(C~5~H~4~CHCH~3~)(CO)~6~]","Acta Crystallographica Section C","1995","51","6","1118","1120","10.1107/S0108270194012928","","","0.7107","MoKα","","","0.0368","","","0.0367","","","","","1.962","1.962","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003529","7.146","0.001","8.635","0.003","25.5","0.004","90","","90","","90","","1573.5","0.6","293","2","293","2","","","","","","","crystallized from ethyl alcohol","3","P 21 21 21","P 2ac 2ab","19","","2-cyano-2-methylsparteine","","- C17 H27 N3 -","- C17 H27 N3 -","- C68 H108 N12 -","4","1","BK1085","Wolska, I.; Borowiak, T.","2-Cyano-2-methylsparteine","Acta Crystallographica Section C","1995","51","6","1158","1160","10.1107/S0108270194013740","","","0.71073","MoKα","","0.0739","0.0311","","0.1161","0.0913","","","","1.088","1.197","1.197","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003530","10.9538","0.0006","11.1908","0.0008","10.77","0.005","90","","111.21","0.16","90","","1230.8","1.5","295","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C12 H20 Pt2 -","- C12 H20 Pt2 -","- C48 H80 Pt8 -","4","0.5","BK1101","Doyle, J. R.; Baenziger, N. C.","μ-(1,2,5,6-η:3,4,7,8-η)-1,3,5,7-Cyclooctatetraene-bis[dimethylplatinum(II)]","Acta Crystallographica Section C","1995","51","6","1116","1118","10.1107/S0108270194014149","","","0.71073","MoKα(intensities),CuKα~1~andCuKα~2~","","","0.047","","","0.073","","","","","1.24","1.24","","","","","has coordinates","198855","2020-10-21","18:00:00",""
"2003531","7.288","0.001","7.514","0.001","15.441","0.001","90.08","0.01","95.9","0.01","90.45","0.01","841.07","0.17","292","","292","","","","","","","","","4","P -1","-P 1","2","","Barium perrhenate hydrate","","- Ba H2 O9 Re2 -","- Ba H2 O9 Re2 -","- Ba4 H8 O36 Re8 -","4","2","BR1085","Todorov, T.; Macícek, J.","Barium Perrhenate Monohydrate","Acta Crystallographica Section C","1995","51","6","1034","1038","10.1107/S0108270194013909","","","0.71073","MoKα","","0.068","0.053","","0.062","0.062","","","","2.65","2.678","2.678","","","","","has coordinates","190396","2020-10-21","18:00:00",""
"2003532","8.374","0.002","9.935","0.002","11.139","0.002","87.84","0.02","88.13","0.02","80.61","0.02","913.3","0.3","290","2","","","","","","","","","synthesized, recrystallized from EtOAc","5","P -1","-P 1","2","","","","- C20 H23 Br N2 O2 -","- C20 H23 Br N2 O2 -","- C40 H46 Br2 N4 O4 -","2","1","CR1107","Baughman, R. G.; Chang, S.-C.; Utecht, R. E.; Lewis, D. E.","Two Related Potent Antiviral Compounds: 3-Bromo-<i>N</i>-butyl-4-butylamino-1,8-naphthalenedicarboximide (1) and 4-Amino-3-bromo-<i>N</i>-butyl-1,8-naphthalenedicarboximide (2)","Acta Crystallographica Section C","1995","51","6","1189","1193","10.1107/S0108270194011005","","","0.71073","MoKα","","","0.0379","","","0.0912","","","","","1.05","1.05","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2003533","4.514","0.002","24.87","0.01","13.054","0.004","90","","97.41","0.03","90","","1453.2","1","288","","","","","","","","","","synthesized per article, recrystallized from mesi","5","C 1 c 1","C -2yc","9","","","","- C16 H15 Br N2 O2 -","- C16 H15 Br N2 O2 -","- C64 H60 Br4 N8 O8 -","4","1","CR1107","Baughman, R. G.; Chang, S.-C.; Utecht, R. E.; Lewis, D. E.","Two Related Potent Antiviral Compounds: 3-Bromo-<i>N</i>-butyl-4-butylamino-1,8-naphthalenedicarboximide (1) and 4-Amino-3-bromo-<i>N</i>-butyl-1,8-naphthalenedicarboximide (2)","Acta Crystallographica Section C","1995","51","6","1189","1193","10.1107/S0108270194011005","","","0.71073","MoKα","","","0.048","","","0.0951","","","","","0.972","0.972","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003534","14.445","0.003","5.767","0.001","28.603","0.005","90","","90.27","0.02","90","","2382.7","0.8","213.9","","213.9","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Nitrophenyl Phenoxyformate","","- C13 H9 N O5 -","- C13 H9 N O5 -","- C104 H72 N8 O40 -","8","2","CR1151","Bryant, Jnr, G. L.; King, Jnr, J. A.","2-Nitrophenyl Phenoxyformate, C~13~H~9~NO~5~","Acta Crystallographica Section C","1995","51","6","1141","1143","10.1107/S0108270194010449","","","1.54178","CopperKα","","0.0902","0.066","","0.1007","0.087","","","","","0.91","0.91","","","","","has coordinates","198396","2020-10-21","18:00:00",""
"2003535","11.796","0.008","7.629","0.004","15.719","0.005","90","","92.65","0.04","90","","1413.1","1.3","296","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H10 Cr O4 -","- C16 H10 Cr O4 -","- C64 H40 Cr4 O16 -","4","1","CR1157","Blake, J. L.; Cook, D. J.; Squattrito, P. J.; Howell, B. A.","(Benzobicyclooctatriene)tetracarbonylchromium","Acta Crystallographica Section C","1995","51","6","1067","1069","10.1107/S0108270194013417","","","0.71073","MoKα","","","0.043","","","0.039","","","","","1.71","1.71","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003536","9.193","0.009","4.89","0.004","7.162","0.007","90","","90","","90","","322","0.5","233","2","233","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- O5 P2 -","- O5 P2 -","- O20 P8 -","4","0.5","DU1085","Stachel, D.; Svoboda, I.; Fuess, H.","Phosphorus Pentoxide at 233 K","Acta Crystallographica Section C","1995","51","6","1049","1050","10.1107/S0108270194012126","","","0.71069","MoKα","","0.085","0.039","","0.0946","0.0831","","","","1.04","1.117","1.117","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003537","14.01","0.001","7.104","0.001","34.086","0.002","90","","90","","90","","3392.5","0.6","295","","295","","","","","","","","synthesis (Yoneda, 1976)","4","P n a 21","P 2c -2n","33","lumiflavine","Lumiflavinium (7,8,10-trimethylbenzo[g] pteridine-2,4(1H,3H)-dione) nitrate.","","- C13 H14 N6 O8 -","- C13 H13 N6 O8 -","- C104 H104 N48 O64 -","8","2","DU1097","Wouters, J.; Evrard, G.; Durant, F.","Lumiflavinium (7,8,10-Trimethylisoalloxazinium) Nitrate","Acta Crystallographica Section C","1995","51","6","1223","1227","10.1107/S0108270194014265","","","1.5406","CuKα","","0.079","0.054","","0.063","0.052","","","","","2.05","2.05","","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2003538","22.9337","0.0005","5.8035","0.0006","13.7842","0.0006","90","","106.816","0.004","90","","1756.2","0.2","293","2","293","2","","","","","","","synth\`ese","5","C 1 2/c 1","-C 2yc","15","","Bis(paraphénolammonium) Diphosphate Monohydrate","","- C12 H20 N2 O10 P2 -","- C12 H22 N2 O11 P2 -","- C48 H88 N8 O44 P8 -","4","0.5","DU1100","Soumhi, E. H.; Jouini, T.","Bis(<i>para</i>-phénolammonium) Diphosphate Monohydrate","Acta Crystallographica Section C","1995","51","6","1213","1215","10.1107/S0108270194011546","","","0.71069","MoKα","","0.0545","0.0379","","0.0984","0.0926","","","","1.219","1.29","1.29","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003539","9.375","0.001","8.019","0.001","11.135","0.002","90","","100.73","0.01","90","","822.5","0.2","299","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- Ni O11 P4 -","- Ni O11 P4 -","- Ni4 O44 P16 -","4","1","DU1102","Olbertz, A.; Stachel, D.; Svoboda, I.; Fuess, H.","Nickel Ultraphosphate, NiP~4~O~11~","Acta Crystallographica Section C","1995","51","6","1047","1049","10.1107/S0108270194012680","","","0.71069","MoKα","","0.064","0.0265","","0.0683","0.0614","","","","1.026","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003540","13.5737","0.0004","13.5737","0.0004","6.6624","0.0003","90","","90","","120","","1063.06","0.07","293","","","","","","","","","","see text","4","P -3","-P 3","147","","","","- Ce K2 N6 O18 -","- Ce K2 N6 O18 -","- Ce3 K6 N18 O54 -","3","0.5","DU1103","Guillou, N.; Louër, M.; Auffrédic, J. P.; Louër, D.","Two Polymorphic Forms of Ceric Potassium Nitrate, K~2~Ce(NO~3~)~6~","Acta Crystallographica Section C","1995","51","6","1029","1032","10.1107/S0108270194014927","","","0.71073","MoKα","","","0.045","","","0.051","","","","","1.7","1.7","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003541","12.707","0.004","6.6858","0.0006","8.2535","0.0007","90","","91.547","0.008","90","","700.9","0.2","293","","","","","","","","","","see text","4","P 1 21/n 1","-P 2yn","14","","","","- Ce K2 N6 O18 -","- Ce K2 N6 O18 -","- Ce2 K4 N12 O36 -","2","0.5","DU1103","Guillou, N.; Louër, M.; Auffrédic, J. P.; Louër, D.","Two Polymorphic Forms of Ceric Potassium Nitrate, K~2~Ce(NO~3~)~6~","Acta Crystallographica Section C","1995","51","6","1029","1032","10.1107/S0108270194014927","","","0.71073","MoKα","","","0.042","","","0.061","","","","","2.2","2.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003542","13.5975","0.0008","13.5975","0.0008","13.5975","0.0008","90","","90","","90","","2514.1","0.3","293","","","","","","","","","","see text","4","P 41 3 2","P 4bd 2ab 3","213","","","","- Ce2 K3 N9 O27 -","- Ce2 K3 N9 O27 -","- Ce8 K12 N36 O108 -","4","0.166667","DU1104","Guillou, N.; Auffrédic, J. P.; Louër, D.","Cerous Potassium Nitrate, K~3~Ce~2~(NO~3~)~9~","Acta Crystallographica Section C","1995","51","6","1032","1034","10.1107/S0108270194014939","","","0.71073","MoKα","","","0.044","","","0.055","","","","","1.25","1.25","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003543","10.232","0.003","14.964","0.007","6.826","0.004","93.81","0.04","98.02","0.03","104.37","0.03","997","0.8","295","1","","","","","","","","","natural product crystallized from water","4","P 1","P 1","1","","","","- C18 H29 N O7 -","- C18 H29 N O7 -","- C36 H58 N2 O14 -","2","2","FG1006","Parvez, M.; Benn, M. H.","Senecivernine Dihydrate","Acta Crystallographica Section C","1995","51","6","1202","1204","10.1107/S0108270194012904","","","0.71069","MoKα","","","0.0802","","","0.0804","","","","","3.43","3.43","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003544","14.739","0.004","9.029","0.001","14.269","0.004","90","","115.95","0.01","90","","1707.4","0.7","293","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 Br2 Cu N8 -","- C12 H16 Br2 Cu N8 -","- C48 H64 Br8 Cu4 N32 -","4","0.5","FG1007","Parker, O. J.; Breneman, G. L.","Tetrakis(imidazole)copper(II) Dibromide, [Cu(Him)~4~]Br~2~","Acta Crystallographica Section C","1995","51","6","1097","1099","10.1107/S010827019401139X","","","0.71073","MoKα","","","0.038","","","0.05","","","","","2.09","2.09","","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2003545","10.9822","0.0022","8.0799","0.0016","15.449","0.003","90","","113.28","0.12","90","","1259.3","1.2","203","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 N2 O3 -","- C26 H22 N4 O3 -","- C104 H88 N16 O12 -","4","1","FG1010","Chebli, C.; Brisse, F.","4,4'-Azoxydianisole at 203 K","Acta Crystallographica Section C","1995","51","6","1164","1167","10.1107/S0108270194012023","","","1.54056","CuKα","","","0.052","","","0.059","","","","","2.68","2.68","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003546","10.434","0.002","13.699","0.002","25.148","0.004","90","","90","","90","","3594.5","1","293","","","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C32 H39 B F3 Mo N7 O3 S -","- C32 H39 B F3 Mo N7 O3 S -","- C128 H156 B4 F12 Mo4 N28 O12 S4 -","4","1","FG1016","Vaughan, W. M.; Bonella, J. M.; Abboud, K. A.","A Chelate-Stabilized Molybdenum‒Imido‒Alkylidene Complex, [TpMo{CHC(Me)~2~Ph}(NAr)(OTf)]","Acta Crystallographica Section C","1995","51","6","1075","1078","10.1107/S010827019401231X","","","0.71073","MoKα","","","0.053","","","0.0546","","","","","1.48","1.48","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003547","6.815","0.001","17.967","0.002","6.223","0.001","98.52","0.01","98.69","0.01","84.52","0.01","742.83","0.18","295","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H20 Cl2 Pd S2 -","- C12 H20 Cl2 Pd S2 -","- C24 H40 Cl4 Pd2 S4 -","2","1","FG1033","Parvez, M.; Primak, A.; Clark, P. D.","<i>trans</i>-Dichlorobis(7-thiabicyclo[2.2.1]heptane)palladium(II) and <i>trans</i>-Dichlorobis(7-thiabicyclo[2.2.1]heptane)platinum(II)","Acta Crystallographica Section C","1995","51","6","1099","1102","10.1107/S0108270194014861","","","0.71073","MoKα","","","0.044","","","0.059","","","","","2.81","2.81","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003548","7.934","0.003","11.759","0.003","8.256","0.002","90","","94.94","0.01","90","","767.4","0.4","295","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Cl2 Pt S2 -","- C12 H20 Cl2 Pt S2 -","- C24 H40 Cl4 Pt2 S4 -","2","0.5","FG1033","Parvez, M.; Primak, A.; Clark, P. D.","<i>trans</i>-Dichlorobis(7-thiabicyclo[2.2.1]heptane)palladium(II) and <i>trans</i>-Dichlorobis(7-thiabicyclo[2.2.1]heptane)platinum(II)","Acta Crystallographica Section C","1995","51","6","1099","1102","10.1107/S0108270194014861","","","0.71073","MoKα","","","0.035","","","0.05","","","","","3.63","3.63","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003549","7.569","0.001","9.738","0.002","9.503","0.001","90","","96.32","0.01","90","","696.18","0.19","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","[3S,4S,5R-(1β,3β,6α,7α,12aβ)]-hexahydro-1-hydroxy-6,6- dimethyl-3,13a:4,8-diepoxy-3H,6H-dioxolano[4,5-f] pyrimido[6,1-c][1,4]oxazonine-10,12(11H,13H)dione","","- C13 H16 N2 O8 -","- C13 H16 N2 O8 -","- C26 H32 N4 O16 -","2","1","FG1041","Groziak, M. P.; Lin, R.; Robinson, P. D.","An Unusual C6-Spiro-Fused Cyclouridine Derivative","Acta Crystallographica Section C","1995","51","6","1204","1207","10.1107/S0108270194012631","","","0.71069","MoKα","","","0.035","","","0.043","","","","","1.96","1.96","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003550","16.652","0.003","12.754","0.003","3.841","0.002","90","","94.39","0.02","90","","813.4","0.5","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H8 N2 O3 -","- C8 H8 N2 O3 -","- C32 H32 N8 O12 -","4","1","HA1105","Adatia, T.; Barjesteh, H.; Charalambous, J.; Choi, N.; McPartlin, M.","3-Acetylamino-1,4-benzoquinone 4-Oxime","Acta Crystallographica Section C","1995","51","6","1187","1189","10.1107/S0108270194012837","","","0.71069","MoKα","","","0.056","","","0.0545","","","","","1.37","1.37","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003551","6.003","0.005","8.301","0.006","11.432","0.01","90","","94.39","0.05","90","","568","0.8","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H7 N3 O2 -","- C4 H7 N3 O2 -","- C16 H28 N12 O8 -","4","1","HA1112","Kettmann, V.; Svetlík, J.; Schantl, J. G.","4,5-Dihydro-5,5-dimethyl-3<i>H</i>-1,2,4-triazol-3-one 1-Oxide","Acta Crystallographica Section C","1995","51","6","1133","1135","10.1107/S0108270194011947","","","0.71069","MoKα","","","0.062","","","0.074","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003552","10.888","0.002","9.329","0.001","12.628","0.001","90","","95.03","0.01","90","","1277.7","0.3","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H9 Cl N2 O2 -","- C15 H9 Cl N2 O2 -","- C60 H36 Cl4 N8 O8 -","4","1","HA1116","Kendi, E.; Özbey, S.; Ide, S.; Fun, H.-K.; Yip, B.-C.","The Phenylhydrazone Form of 2-(4-Chlorophenylazo)-1,3-indandione","Acta Crystallographica Section C","1995","51","6","1144","1146","10.1107/S0108270194012047","","","0.7107","MoKα","","","0.0476","","","0.0567","","","","","2.22","2.22","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003553","12.569","0.004","5.1148","0.0007","21.74","0.01","90","","104.04","0.04","90","","1355.9","0.8","102","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H27 P -","- C12 H27 P -","- C48 H108 P4 -","4","1","HR1046","Bruckmann, J.; Krüger, C.","Tris(<i>n</i>-butyl)phosphine, Tris(<i>tert</i>-butyl)phosphine and Tris(trimethylsilyl)phosphine","Acta Crystallographica Section C","1995","51","6","1152","1155","10.1107/S0108270194014356","","","0.71073","MoKα","","","0.041","","","0.049","","","","","2","2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003554","9.219","0.001","13.768","0.005","11.133","0.002","90","","111.36","0.01","90","","1316","0.6","102","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H27 P -","- C12 H27 P -","- C48 H108 P4 -","4","1","HR1046","Bruckmann, J.; Krüger, C.","Tris(<i>n</i>-butyl)phosphine, Tris(<i>tert</i>-butyl)phosphine and Tris(trimethylsilyl)phosphine","Acta Crystallographica Section C","1995","51","6","1152","1155","10.1107/S0108270194014356","","","0.71073","MoKα","","","0.04","","","0.045","","","","","1.8","1.8","","","","","has coordinates","278038","2022-09-21","10:28:06",""
"2003555","9.859","0.002","15.01","0.006","11.947","0.005","90","","113.91","0.02","90","","1616.2","1","102","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H27 P Si3 -","- C9 H27 P Si3 -","- C36 H108 P4 Si12 -","4","1","HR1046","Bruckmann, J.; Krüger, C.","Tris(<i>n</i>-butyl)phosphine, Tris(<i>tert</i>-butyl)phosphine and Tris(trimethylsilyl)phosphine","Acta Crystallographica Section C","1995","51","6","1152","1155","10.1107/S0108270194014356","","","0.71073","MoKα","","","0.034","","","0.046","","","","","1.9","1.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003556","21.472","0.005","9.117","0.001","5.186","0.001","90","","90","","90","","1015.2","0.3","102","","","","","","","","","","see text","3","P n m a","-P 2ac 2n","62","","","","- C3 H9 P -","- C3 H18 P2 -","- C24 H144 P16 -","8","1","HR1047","Bruckmann, J.; Krüger, C.","Trimethylphosphine and Triethylphosphine in the Solid State","Acta Crystallographica Section C","1995","51","6","1155","1158","10.1107/S0108270194014368","","","0.71069","MoKα","","","0.037","","","0.049","","","","","1.9","1.9","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003557","9.495","0.004","7.421","0.001","11.151","0.003","90","","90.71","0.02","90","","785.7","0.4","102","","","","","","","","","","see text","3","P 1 21/a 1","-P 2yab","14","","","","- C6 H15 P -","- C6 H15 P -","- C24 H60 P4 -","4","1","HR1047","Bruckmann, J.; Krüger, C.","Trimethylphosphine and Triethylphosphine in the Solid State","Acta Crystallographica Section C","1995","51","6","1155","1158","10.1107/S0108270194014368","","","0.71069","MoKα","","","0.059","","","0.068","","","","","4.7","4.7","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003558","11.152","0.003","14.767","0.004","12.816","0.003","90","","102.56","0.002","90","","2060.1","0.9","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H44 N8 O12 Zn2 -","- C36 H44 N8 O12 Zn2 -","- C72 H88 N16 O24 Zn4 -","2","0.5","HR1048","Skorsepa, J.; Györyovà, K.; Melník, M.; Smolander, K.; Ahlgrén, M.","Dimeric Bis(μ-propionato-<i>O</i>:<i>O</i>')bis[bis(nicotinamide-<i>N</i>)(propionato-<i>O</i>)zinc(II)]","Acta Crystallographica Section C","1995","51","6","1069","1071","10.1107/S0108270194014186","","","0.71073","MoKα","","","0.0499","","","0.0651","","","","","1.43","1.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003559","9.477","0.001","7.463","0.001","26.727","0.003","90","","90","","90","","1890.3","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C8 H6 K O5 -","- C8 H6 K O5 -","- C64 H48 K8 O40 -","8","1","HU1120","Kariuki, B. M.; Jones, W.","Potassium Hydrogen Phthalate Hemiperhydrate","Acta Crystallographica Section C","1995","51","6","1128","1130","10.1107/S0108270194012497","","","0.71069","MoKα","","0.1379","0.0449","","0.106","0.0859","","","","0.93","1.262","1.262","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003560","14.506","0.004","3.7329","0.001","19.245","0.003","90","","91.45","0.02","90","","1041.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Sodium o-chloro-trans-cinnamate dihydrate","","","- C9 H10 Cl Na O4 -","- C9 H10 Cl Na O4 -","- C36 H40 Cl4 Na4 O16 -","4","1","HU1125","Kariuki, B. M.; Valim, J. B.; Jones, W.; King, J.","Sodium 3-(2-Chlorophenyl)propenoate Dihydrate and Tetraaquamagnesium Bis[3-(2-hydroxyphenyl)propenoate]","Acta Crystallographica Section C","1995","51","6","1051","1053","10.1107/S0108270194012503","","","0.71069","MoKα","","0.0461","0.034","","0.1037","0.0943","","","","1.067","1.156","1.156","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003561","6.025","0.003","5.385","0.003","29.991","0.014","90","","94.46","0.04","90","","970.1","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Tetra-aqua-magnesium bis(o-hydroxy-trans-cinnamate)","","","- C18 H22 Mg O10 -","- C18 H22 Mg O10 -","- C36 H44 Mg2 O20 -","2","0.5","HU1125","Kariuki, B. M.; Valim, J. B.; Jones, W.; King, J.","Sodium 3-(2-Chlorophenyl)propenoate Dihydrate and Tetraaquamagnesium Bis[3-(2-hydroxyphenyl)propenoate]","Acta Crystallographica Section C","1995","51","6","1051","1053","10.1107/S0108270194012503","","","0.71069","MoKα","","0.0524","0.0425","","0.1171","0.1138","","","","1.107","1.177","1.177","","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2003562","12.513","0.002","17.356","0.003","10.172","0.002","90","","102.66","0.003","90","","2155.4","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H17 Cl3 O3 -","- C25 H17 Cl3 O3 -","- C100 H68 Cl12 O12 -","4","1","HU1130","Anulewicz, R.; Świrska, B.; Milart, P.","Pyrylium Salts. VII. 2,4,6-Triphenylpyrylium Trichloroacetate","Acta Crystallographica Section C","1995","51","6","1180","1182","10.1107/S0108270194012515","","","1.54178","CuKα","","0.0712","0.0681","","0.1844","0.177","","","","1.046","1.053","1.053","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003563","7.029","0.002","11.598","0.003","13.172","0.02","103.85","0.02","89.14","0.02","95.87","","1037.1","1.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Berberine Chloride tetrahydrate","","","- C20 H26 Cl N O8 -","- C20 H26 Cl N O8 -","- C40 H52 Cl2 N2 O16 -","2","1","HU1131","Kariuki, B. M.; Jones, W.","Five Salts of Berberine","Acta Crystallographica Section C","1995","51","6","1234","1240","10.1107/S010827019401259X","","","0.71069","MoKα","","0.1273","0.0701","","0.2214","0.1947","","","","0.98","1.238","1.238","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003564","7.3712","0.001","11.2724","0.001","13.3998","0.001","77.587","0.007","73.299","0.007","78.228","0.008","1029.4","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Berberine chloride ethanol solvate hemihydrate","","","- C22 H25 Cl N O5.5 -","- C22 H25 Cl N O5.5 -","- C44 H50 Cl2 N2 O11 -","2","1","HU1131","Kariuki, B. M.; Jones, W.","Five Salts of Berberine","Acta Crystallographica Section C","1995","51","6","1234","1240","10.1107/S010827019401259X","","","0.71069","MoKα","","0.126","0.0562","","0.1879","0.1534","","","","0.99","1.302","1.302","","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2003565","21.974","0.003","7.2","0.007","26.151","0.003","90","","110.18","0.01","90","","3883","4","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","Berberine bromide dihydrate","","","- C20 H22 Br N O6 -","- C20 H22 Br N O6 -","- C160 H176 Br8 N8 O48 -","8","1","HU1131","Kariuki, B. M.; Jones, W.","Five Salts of Berberine","Acta Crystallographica Section C","1995","51","6","1234","1240","10.1107/S010827019401259X","","","0.71069","MoKα","","0.1631","0.0471","","0.0971","0.0839","","","","0.831","1.189","1.189","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003566","7.0814","0.001","15.917","0.002","16.154","0.002","90","","99.126","0.01","90","","1797.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Berberine Iodide","","","- C20 H18 I N O4 -","- C20 H18 I N O4 -","- C80 H72 I4 N4 O16 -","4","1","HU1131","Kariuki, B. M.; Jones, W.","Five Salts of Berberine","Acta Crystallographica Section C","1995","51","6","1234","1240","10.1107/S010827019401259X","","","0.71069","MoKα","","0.2655","0.0666","","0.1288","0.1","","","","0.75","1.277","1.277","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003567","23.198","0.03","6.918","0.01","24.963","0.03","90","","96.65","0.09","90","","3979","9","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Bis(berberine) sulphate heptadydrate","","","- C40 H50 N2 O19 S -","- C40 H50 N2 O19 S -","- C160 H200 N8 O76 S4 -","4","1","HU1131","Kariuki, B. M.; Jones, W.","Five Salts of Berberine","Acta Crystallographica Section C","1995","51","6","1234","1240","10.1107/S010827019401259X","","","0.71069","MoKα","","0.2867","0.0764","","0.2046","0.1649","","","","0.732","1.321","1.321","","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2003568","6.11","0.001","8.205","0.001","5.868","0.001","90","","90","","90","","294.18","0.08","294","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","Mercury Selenite","Mercury(II) Selenate(IV)","","- Hg O3 Se -","- Hg O3 Se -","- Hg4 O12 Se4 -","4","0.5","HU1145","Koskenlinna, M.; Valkonen, J.","Mercury(II) Selenite","Acta Crystallographica Section C","1995","51","6","1040","1042","10.1107/S0108270194014770","","","0.71073","MoKα","","","0.026","","","0.032","","","","","0.363","0.363","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003569","15.919","0.005","10.307","0.009","16.23","0.02","90","","104.93","0.04","90","","2573","4","120","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C32 H80 P12 Th -","- C32 H80 P12 Th -","- C64 H160 P24 Th2 -","2","1","JZ1000","Coles, S. J.; Edwards, P. G.; Hursthouse, M. B.; Read, P. W.","Dimorphism in Actinide Phosphides: Tetrakis[bis(2-dimethylphosphinoethyl)phosphido]thorium(IV)","Acta Crystallographica Section C","1995","51","6","1060","1063","10.1107/S0108270194011790","","","0.71069","MoKα","","","0.0447","","","0.1026","","","","","0.515","0.515","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003570","28.058","0.006","17.315","0.002","14.962","0.001","90","","101.36","0.01","90","","7126.5","1.8","293","","","","","","","","","","see text","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H60 Ag4.46 Cu0.54 N P2 -","- C84 H60 Ag5 Cu3 N P2 -","- C336 H240 Ag20 Cu12 N4 P8 -","4","0.5","JZ1005","Al-Farhan, K. A.; Abu-Salah, O. M.; Mukhalalati, M.; Jaafar, M.","Copper Disordered Hexakis(phenylethynyl)pentaargentate(I) Cluster","Acta Crystallographica Section C","1995","51","6","1089","1092","10.1107/S0108270194014162","","","0.71073","MoKα","","","0.032","","","0.082","","","","","1.021","1.021","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003571","5.094","0.002","5.273","0.002","7.572","0.003","102.52","0.02","104.45","0.02","102.07","0.02","184.67","0.13","295","2","","","","","","","","","","5","P -1","-P 1","2","","","","- As2 Cu Fe2 H2 O10 -","- As2 Cu Fe2 H2 O10 -","- As2 Cu Fe2 H2 O10 -","1","0.5","JZ1007","Effenberger, H.","Polytypism of CuFe~2~(OH)~2~(AsO~4~)~2~: the Triclinic Modification","Acta Crystallographica Section C","1995","51","6","1042","1045","10.1107/S0108270194014617","","","0.710688","MoKα","","","0.02","","","0.019","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003572","9.594","0.005","12.43","0.005","16.893","0.009","109.71","0.02","99.13","0.03","105.9","0.03","1752.4","1.6","213","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C39 H37 Cl2 O2 P2 Re -","- C39 H37 Cl2 O2 P2 Re -","- C78 H74 Cl4 O4 P4 Re2 -","2","1","JZ1019","Abram, S.; Abram, U.; Schulz-Lang, E.; Strähle, J.","<i>trans</i>-Dichlorooxo(2-propoxido)bis(triphenylphosphine)rhenium(V)","Acta Crystallographica Section C","1995","51","6","1078","1080","10.1107/S0108270194013314","","","0.71073","MoKα","","","0.0207","","","0.0509","","","","","1.108","1.108","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003573","19.907","0.005","19.907","0.005","6.43","0.005","90","","90","","90","","2548","2","293","2","293","2","","","","","","","","4","P 4/n n c :2","-P 4a 2bc","126","Bis(phthalocyaninato)erbium","Bis[29H,31H-phthalocyaninato-N^29^,N^30^,N^31^,N^32^]erbium","","- C64 H32 Er N16 -","- C64 H32 Er N16 -","- C128 H64 Er2 N32 -","2","0.125","JZ1021","Ostendorp, G.; Werner, J.-P.; Homborg, H.","Bis(phthalocyaninato)erbium (α1 Phase)","Acta Crystallographica Section C","1995","51","6","1125","1128","10.1107/S0108270195000126","","","0.71069","MoKα","","0.0632","0.0478","","0.2013","0.1831","","","","1.274","1.37","1.37","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003574","7.223","0.003","13.913","0.0015","14.931","0.0015","100.655","0.009","101.33","0.03","90.32","0.02","1444.5","0.7","293","2","293","2","","","","","","","crystallized from water/acetone","6","P -1","-P 1","2","fac-Dipyridiniomethane-Trifluorotrichloroosmate(IV)","fac-N,N'-methylenedipyridinium trichlorotrifluoroosmate(IV)","","- C11 H12 Cl3 F3 N2 Os -","- C11 H12 Cl3 F3 N2 Os -","- C44 H48 Cl12 F12 N8 Os4 -","4","2","JZ1030","Bruhn, C.; Preetz, W.","<i>fac</i>- and <i>mer</i>-Dipyridiniomethane Trichlorotrifluoroosmate(IV), <i>fac</i>- and <i>mer</i>-[(C~5~H~5~N)~2~CH~2~][OsCl~3~F~3~]","Acta Crystallographica Section C","1995","51","6","1112","1116","10.1107/S0108270194015015","","","0.71069","MoKα","","0.0222","0.0187","","0.0525","0.0503","","","","1.199","1.199","1.199","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003575","9.676","0.005","14.046","0.003","10.476","0.003","90","","97.357","0.004","90","","1412.1","0.9","293","2","293","2","","","","","","","crystallized from water/acetone","6","P 1 21/n 1","-P 2yn","14","mer-Dipyridiniomethane-Trifluorotrichloroosmate(IV)","mer-N,N'-methylenedipyridinium trichlorotrifluoroosmate(IV)","","- C11 H12 Cl3 F3 N2 Os -","- C11 H12 Cl3 F3 N2 Os -","- C44 H48 Cl12 F12 N8 Os4 -","4","1","JZ1030","Bruhn, C.; Preetz, W.","<i>fac</i>- and <i>mer</i>-Dipyridiniomethane Trichlorotrifluoroosmate(IV), <i>fac</i>- and <i>mer</i>-[(C~5~H~5~N)~2~CH~2~][OsCl~3~F~3~]","Acta Crystallographica Section C","1995","51","6","1112","1116","10.1107/S0108270194015015","","","0.71069","MoKα","","0.035","0.0183","","0.0453","0.039","","","","1.139","1.094","1.094","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003576","10.957","0.001","12.836","0.002","16.466","0.003","90","","90","","90","","2315.8","0.6","298","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H33 N O12 -","- C23 H33 N O12 -","- C92 H132 N4 O48 -","4","1","KA1049","Urbanczyk-Lipkowska, Z.","A Morphine Metabolite: ({-})-Morphine-3-<i>O</i>-β-<small>D</small>-glucuronide Trihydrate (M3G.3H~2~O)","Acta Crystallographica Section C","1995","51","6","1184","1187","10.1107/S010827019301265X","","","0.71069","MoKα","","","0.046","","","0.039","","","","","1.348","1.348","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003577","13.342","0.001","17.709","0.002","9.723","0.002","90","","97.23","0.01","90","","2279","0.6","295","2","","","","","","","","","CH~3~CH/H~2~O","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 B2 N12 Zn -","- C18 H20 B2 N12 Zn -","- C72 H80 B8 N48 Zn4 -","4","1","KH1006","Nakata, K.; Kawabata, S.; Ichikawa, K.","Bis[hydrotris(1-pyrazolyl-<i>N</i>^2^)borato]zinc(II)","Acta Crystallographica Section C","1995","51","6","1092","1094","10.1107/S0108270194013880","","","0.71073","MoKα","","","0.0467","","","0.0476","","","","","1.79","1.79","","","","","has coordinates","190560","2020-10-21","18:00:00",""
"2003578","14.049","0.001","7.874","0.0008","15.017","0.001","90","","115.45","0.01","90","","1499.9","0.2","293","2","293","2","","","","","","","Single crystals of vanillin were grown by gel technique. Details are published elsewhere (Sureshkumar, Sivakumar & Natarajan, 1994).","3","P 1 21 1","P 2yb","4","","3-methoxy-4-hydroxybenzaldehyde","","- C8 H8 O3 -","- C8 H8 O3 -","- C64 H64 O24 -","8","4","LI1126","Velavan, R.; Sureshkumar, P.; Sivakumar, K.; Natarajan, S.","Vanillin-I","Acta Crystallographica Section C","1995","51","6","1131","1133","10.1107/S0108270194011923","","","0.71073","MoKα","","0.0426","0.025","","0.0658","0.0603","","","","0.97","1.066","1.066","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2003579","6.059","0.001","11.598","0.002","17.253","0.004","90","","90","","90","","1212.4","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-Nitrobenzaldehydephenylhydrazone","","- C13 H11 N3 O2 -","- C13 H11 N3 O2 -","- C52 H44 N12 O8 -","4","1","LI1127","Velavan, R.; Sivakumar, K.; Anbu, M.","(<i>E</i>)-4-Nitrobenzaldehyde Phenylhydrazone","Acta Crystallographica Section C","1995","51","6","1227","1229","10.1107/S0108270194012606","","","1.5418","CuKα","","0.0398","0.0368","","0.1097","0.1074","","","","1.058","1.099","1.099","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003580","13.537","0.01","14.111","0.007","12.06","0.01","99.98","0.06","90.24","0.07","94.02","0.06","2263","3","188","","","","","","","","","","crystallization from ethanol","5","P -1","-P 1","2","","","","- C94 H102 Cu4 O14 P4 -","- C94 H102 Cu4 O14 P4 -","- C94 H102 Cu4 O14 P4 -","1","0.5","MU1081","Dunaj-Jurčo, M.; Koman, M.; Valigura, D.; Ondrejovič, G.","Bis(ethanol)-1κ<i>O</i>,4κ<i>O</i>-hexakis(μ-propionato)-1κ<i>O</i>:2κ<i>O</i>';2κ^4^<i>O</i>:3κ^4^<i>O</i>';3κ<i>O</i>:4κ<i>O</i>'-tetrakis(triphenylphosphine)-1κ^2^<i>P</i>,4κ^2^<i>P</i>-tetracopper(I,II), [Cu~4~(C~3~H~5~O~2~)~6~(C~2~H~6~O)~2~(C~18~H~15~P)~4~]","Acta Crystallographica Section C","1995","51","6","1082","1084","10.1107/S0108270194009935","","","1.54178","CuKα","","","0.0697","","","0.0734","","","","","1.58","1.58","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003581","7.435","0.003","14.124","0.003","13.693","0.003","90","","111.03","0.03","90","","1342.2","0.7","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","","","bis(2-chloro-6-flourobenzoato)di(nicotinamide)copper(II)","","- C26 H18 Cl2 Cu F2 N4 O6 -","- C26 H18 Cl2 Cu F2 N4 O6 -","- C52 H36 Cl4 Cu2 F4 N8 O12 -","2","0.5","MU1108","Hoang, N. N.; Valach, F.; Dunaj-Jurčo, M.","Bis(2-chloro-6-fluorobenzoato)bis(nicotinamide)copper(II)","Acta Crystallographica Section C","1995","51","6","1095","1097","10.1107/S0108270194013922","","","0.71069","MoKα","","","0.047","","","0.045","","","","","1.13","1.13","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003582","9.494","0.001","9.494","0.001","11.203","0.002","90","","90","","90","","1009.8","0.2","293","","","","","","","","","","Et~2~O/MeCN","6","P 4/m b m","-P 4 2ab","127","","","","- C8 H12 F12 N4 P2 Pt -","- C8 H12 F12 N4 P2 Pt -","- C16 H24 F24 N8 P4 Pt2 -","2","0.125","MU1154","Crossley, J. G.; Orpen, A. G.","[<i>M</i>(CNMe)~4~](PF~6~)~2~ (<i>M</i> = Pt, Pd)","Acta Crystallographica Section C","1995","51","6","1102","1105","10.1107/S0108270194014587","","","0.71073","MoKα","","","0.0287","","","0.0339","","","","","1.2","1.2","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003583","9.434","0.002","9.434","0.002","11.27","0.003","90","","90","","90","","1003","0.4","293","","","","","","","","","","Et~2~O/MeCN solvent diffusion","6","P 4/m b m","-P 4 2ab","127","","","","- C8 H12 F12 N4 P2 Pd -","- C8 H12 F12 N4 P2 Pd -","- C16 H24 F24 N8 P4 Pd2 -","2","0.125","MU1154","Crossley, J. G.; Orpen, A. G.","[<i>M</i>(CNMe)~4~](PF~6~)~2~ (<i>M</i> = Pt, Pd)","Acta Crystallographica Section C","1995","51","6","1102","1105","10.1107/S0108270194014587","","","0.71073","MoKα","","","0.0289","","","0.0466","","","","","1.817","1.817","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003584","11.749","0.001","23.342","0.002","12.644","0.002","90","","111.32","0.01","90","","3230.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-bis(triphenylarsine)chloromethylplatinum(II)","","- C37 H33 As2 Cl Pt -","- C37 H33 As2 Cl Pt -","- C148 H132 As8 Cl4 Pt4 -","4","1","MU1156","Roodt, A.; Otto, S.; Leipoldt, J. G.","<i>trans</i>-Chloromethylbis(triphenylarsine)platinum(II)","Acta Crystallographica Section C","1995","51","6","1105","1106","10.1107/S0108270194014599","","","0.71073","MoKα","","0.0275","0.0275","","0.0696","0.0696","","","","1.066","1.066","1.066","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003585","13.747","0.009","21.08","0.04","10.3","0.01","90","","98.97","0.06","90","","2948","7","295","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H39 N O3 Si -","- C34 H39 N O3 Si -","- C136 H156 N4 O12 Si4 -","4","1","NA1106","Urtiaga, M. K.; Arriortua, M. I.; Tellitu, I.; Badía, D.; Domínguez, E.; Ochando, L.; Amigó, J. M.; Debaerdemaeker, T.","(1<i>R</i>*,3<i>S</i>*,4<i>R</i>*)-4-<i>tert</i>-Butyldiphenylsilyloxy-6,7-dimethoxy-1-methyl-3-phenyl-1,2,3,4-tetrahydroisoquinoline","Acta Crystallographica Section C","1995","51","6","1232","1234","10.1107/S0108270194012825","","","0.71073","MoKα","","","0.071","","","0.094","","","","","1.115","1.115","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003586","7.59","0.001","11.64","0.001","11.748","0.003","88","0.01","88.08","0.01","80.02","0.01","1021.2","0.3","295","","295","","","","","","","","","3","P -1","-P 1","2","","3-(4-butoxycarbonyl-phenyloxycarbonyl)-Xanthen-9-one","","- C25 H20 O6 -","- C25 H20 O6 -","- C50 H40 O12 -","2","1","NA1123","Centore, R.; Ciajolo, M. R.; Tuzi, A.; Kricheldorf, H. R.","3-(4-Butoxycarbonylphenyloxycarbonyl)-xanthen-9-one","Acta Crystallographica Section C","1995","51","6","1211","1213","10.1107/S0108270194012710","","","1.54178","CuKα","","0.05","0.044","","","0.067","","","","","3.021","3.021","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2003587","9.1706","0.0041","9.3871","0.0073","9.5577","0.0027","112.988","0.057","113.552","0.022","93.402","0.051","671.3","0.8","250","","250","","","","","","","","synthetic","7","P 1","P 1","1","","(-)-{2,2-Bis-[(r)-4'-(benzyl)-oxazolin-2'-yl]propan}-π-allyl-palladium(II)- hexa-fluorophosphat","","- C26 H31 F6 N2 O2 P Pd -","- C26 H31 F6 N2 O2 P Pd -","- C26 H31 F6 N2 O2 P Pd -","1","1","NA1124","Zehnder, M.; Neuburger, M.; von Matt, P.; Pfaltz, A.","(Allyl)palladium(II) Complexes with Chiral Ligands. I. (Allyl)palladium(II) Complexes with Methylenebis(oxazoline) Ligands","Acta Crystallographica Section C","1995","51","6","1109","1112","10.1107/S0108270194013119","","","0.71069","MoKα","","","0.0176","","","0.0206","","","","","1.0996","1.0996","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003588","12.6087","0.0025","15.2262","0.0192","18.5205","0.007","90","","90","","90","","3556","5","250","","250","","","","","","","","synthetic","7","P 21 21 21","P 2ac 2ab","19","","(-)-{2,2-Bis-[(r)-4'-(benzyl)-oxazolin-2'-yl]propan}-{π-1,3-diphenylallyl}- palladium(II)-hexafluorophosphat","","- C38 H39 F6 N2 O2 P Pd -","- C38 H39 F6 N2 O2 P Pd -","- C152 H156 F24 N8 O8 P4 Pd4 -","4","1","NA1124","Zehnder, M.; Neuburger, M.; von Matt, P.; Pfaltz, A.","(Allyl)palladium(II) Complexes with Chiral Ligands. I. (Allyl)palladium(II) Complexes with Methylenebis(oxazoline) Ligands","Acta Crystallographica Section C","1995","51","6","1109","1112","10.1107/S0108270194013119","","","0.71069","MoKα","","","0.0309","","","0.0183","","","","","1.1326","1.1326","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003589","7.256","0.001","9.3991","0.0009","30.265","0.003","90","","90","","90","","2064.1","0.4","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H32 O3 -","- C23 H32 O3 -","- C92 H128 O12 -","4","1","NA1126","Puliti, R.; De Rosa, S.; Mattia, C. A.","Crystal Studies of Avarol Derivatives. 5'-Acetylavarol from <i>Dysidea avara</i>","Acta Crystallographica Section C","1995","51","6","1195","1198","10.1107/S0108270194012722","","","1.54056","CuKα","","","0.0441","","","0.0438","","","","","0.88","0.88","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003590","11.746","0.001","16.535","0.001","24.139","0.001","90","","90","","90","","4688.3","0.5","293","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H24 N8 Ni O6 -","- C20 H24 N8 Ni O6 -","- C160 H192 N64 Ni8 O48 -","8","1","NA1132","Soriano-García, M.; Pandiyan, T.; Durán de Bazúa, C.","[<i>N</i>,<i>N</i>'-Bis(benzimidazol-2-ylethyl)-1,2-ethanediamine](nitrato-<i>O</i>,<i>O</i>')nickel(II) Nitrate","Acta Crystallographica Section C","1995","51","6","1107","1109","10.1107/S010827019401406X","","","0.71073","MoKα","","","0.034","","","0.065","","","","","1.51","1.51","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003591","7.24","0.001","14.373","0.003","7.444","0.002","90","","90","","90","","774.6","0.3","293","","","","","","","","","","see text","5","P c a 21","P 2c -2ac","29","","","","- C6 H5 B F3 K -","- C6 H5 B Ce F3 K -","- C24 H20 B4 Ce4 F12 K4 -","4","1","NA1133","Conole, G.; Clough, A.; Whiting, A.","Potassium Trifluorophenylborate","Acta Crystallographica Section C","1995","51","6","1056","1059","10.1107/S0108270194014198","","","0.71073","MoKα","","","0.0481","","","0.0501","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003592","6.537","0.004","15.04","0.009","14.572","0.01","90","","92.92","0.05","90","","1430.8","1.6","291","","291","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(±)-threo-2,3-diphenyl, 3-hydroxypropanoic acid, dimethylamide","","- C17 H19 N O2 -","- C17 H19 N O2 -","- C68 H76 N4 O8 -","4","1","NA1137","Kolev, T.; Preut, H.; Bleckmann, P.; Juchnovski, I.","(±)-<i>threo</i>-3-Hydroxy-2,3-diphenylpropanoic Acid Dimethylamide","Acta Crystallographica Section C","1995","51","6","1169","1170","10.1107/S0108270194014666","","","0.71073","MoKα","","0.0705","0.0445","","0.0916","0.068","","","","","0.73","0.73","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003593","12.705","0.004","21.68","0.006","13.013","0.004","90","","113.1","0.02","90","","3297","1.8","293","2","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Cl3 H18 N6 Ru -","- Cl3 H19 N6 Ru -","- Cl36 H228 N72 Ru12 -","12","1.5","OH1062","Engelhardt, L. M.; Reynolds, P. A.; Sobolev, A. N.","Reconciling the Crystal Structure of [Ru(NH~3~)~6~]Cl~3~ with its ESR Properties","Acta Crystallographica Section C","1995","51","6","1045","1047","10.1107/S0108270194009522","","","0.71073","MoKα","","","0.0271","","","0.0695","","","","","1.179","1.179","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003594","14.351","0.003","6.468","0.001","11.498","0.002","90","","118.42","0.01","90","","938.6","0.3","293","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- H16 Na2 O10 -","- H16 Na2 O10 -","- H64 Na8 O40 -","4","0.5","OH1071","Grehl, M.; Fröhlich, R.; Thiele, S.","Na~2~O~2~.8H~2~O","Acta Crystallographica Section C","1995","51","6","1038","1040","10.1107/S010827019401382X","","","0.71073","MoKα","","","0.0241","","","0.07","","","","","1.208","1.208","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003595","24.633","0.005","16.44","0.002","7.465","0.001","90","","92.86","0.01","90","","3019.3","0.8","293","","","","","","","","","","synthesis","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 O6 -","- C18 H15 O6 -","- C144 H120 O48 -","8","2","PA1095","Wallet, J.-C.; Cody, V.","A New Polymorph of 7-Hydroxy-2',3',4'-trimethoxyflavone","Acta Crystallographica Section C","1995","51","6","1193","1195","10.1107/S0108270194005986","","","1.54184","CuKα","","","0.052","","","0.064","","","","","2.3","2.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003596","12.258","0.007","22.289","0.004","13.297","0.006","90","","104.64","0.04","90","","3515","3","293","","293","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C30 H44 Cl2 N2 O13 -","- C30 H44 Cl2 N2 O13 -","- C120 H176 Cl8 N8 O52 -","4","1","PA1136","Lahrahar, N.; Marsau, P.; Bouas-Laurent, H.; Desvergne, J.-P.; Fages, F.","The Water Inclusion Complex of a Fluorescent Diprotonated Anthracenocryptand","Acta Crystallographica Section C","1995","51","6","1218","1221","10.1107/S0108270194013570","","","0.71073","MoKα","","","0.061","","","0.056","","","","","1.47","1.47","","","","","has coordinates","198441","2020-10-21","18:00:00",""
"2003597","30.912","0.007","7.719","0.002","6.184","0.006","95.4","0.07","87.16","0.07","94.85","0.02","1462.5","1.5","293","","293","","","","","","","","crystallized from toluene","4","P 1","P 1","1","","4-(2,2,3,3,4,4,4-heptafluorobutyloxycarbonyl)phenyl undecyloxybenzoate","","- C29 H33 F7 O5 -","- C29 H33 F7 O5 -","- C58 H66 F14 O10 -","2","2","PA1138","Kromm, P.; Allouchi, H.; Bideau, J.-P.; Cotrait, M.; Nguyen, H. T.","A Mesogenic Perfluorinated Compound","Acta Crystallographica Section C","1995","51","6","1229","1231","10.1107/S0108270194013582","","","0.71069","MoKα","","","0.0452","","","0.0459","","","","","1.229","1.229","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2003598","16.881","0.009","12.659","0.009","9.201","0.006","90","","90","","90","","1966.5","","298","","","","","","","","","","from hexane","4","P m n b","","","","","","- C19 H26 Cl2 Ti -","- C9.5 H13 Cl Ti0.5 -","- C38 H52 Cl4 Ti2 -","4","0.5","","Urazowski, I.; Mkoyan, S.; Atovmyan, L.; Gautheron, B.; Broussier, R.; Perron, P.","syn-[2,2-Bis(3-isopropyl-η^5^-cyclopentadienyl)propane]dichlorotitanium","Acta Crystallographica Section C","1995","51","6","1063","1064","10.1107/S0108270194014083","","","0.71069","MoKα","","","0.049","","","0.055","","","","","1.4","1.4","","","","","has coordinates","175029","2020-10-21","18:00:00",""
"2003599","8.017","0.002","11.103","0.003","8.263","0.003","90","","111.53","0.04","90","","684.2","0.4","293","","293","","","","","","","","from chemical synthesis","3","P 1 21 1","P 2yb","4","","2α,3α,7β,13β-diépoxy-trans-himachalane.","","- C15 H24 O2 -","- C15 H24 O2 -","- C30 H48 O4 -","2","1","PA1152","Chiaroni, A.; Riche, C.; Benharref, A.; El Jamili, H.; Lassaba, E.","2α,3α:7β,13β-Diépoxy-<i>trans</i>-himachalane","Acta Crystallographica Section C","1995","51","6","1171","1173","10.1107/S0108270194014125","","","0.7107","MoKα","","","0.057","","","0.075","","","","","1.04","1.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003600","10.785","0.005","15.709","0.006","20.884","0.008","90","","100.89","0.03","90","","3474","2","293","","293","","","","","","","","dimethylformamide/chloroform","6","P 1 21/n 1","-P 2yn","14","","1,1-Dichloro-3,3,5,5-tetraphenyl-1λ^4^,2,6,3λ^5^,5λ^5^-selena- diazadiphosphorin","","- C27 H24 Cl8 N2 P2 Se -","- C27 H24 Cl8 N2 P2 Se -","- C108 H96 Cl32 N8 P8 Se4 -","4","1","SE1064","Bolte, M.","1,1-Dichloro-3,3,5,5-tetraphenyl-1λ^4^,2,6,3λ^5^,5λ^5^-selenadiazadiphosphorin","Acta Crystallographica Section C","1995","51","6","1209","1211","10.1107/S0108270194008334","","","0.71069","MoKα","","0.18","0.1048","","0.2991","0.2524","","","","1.023","1.278","1.278","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003601","7.838","0.004","15.318","0.004","8.84","0.004","90","","116.22","0.04","90","","952.1","0.8","295","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C11 H7 N O3 -","- C11 H7 N O3 -","- C44 H28 N4 O12 -","4","1","SE1071","Steiner, T.","<i>N</i>-(Propargyloxy)phthalimide","Acta Crystallographica Section C","1995","51","6","1135","1136","10.1107/S0108270194012941","","","1.54184","CuKα","","","0.049","","","0.049","","","","","1","1","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003602","11.623","0.001","20.861","0.002","12.57","0.001","90","","116.47","0.01","90","","2728.3","0.5","173","1","173","1","","","","","","","","5","P 1 21 1","P 2yb","4","","Methyl 2-O-(Cyclohexylcarbamoyl)-6-deoxy-3,4-O- -(hexafluoroisopropylidene)-α-L-altropyranoside","","- C43 H52 F24 N2 O15 -","- C43 H52 F24 N2 O15 -","- C86 H104 F48 N4 O30 -","2","1","SE1073","Kopf, J.; Sheldrick, G.; Reinke, H.; Rentsch, D.; Miethchen, R.","The 2:1 Adduct of an α-<small>L</small>-Altropyranose Derivative with Hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-4-heptanone at 173 K","Acta Crystallographica Section C","1995","51","6","1198","1201","10.1107/S0108270194011157","","","1.54178","CuKα","","0.0489","0.0475","","0.1284","0.1246","","","","1.038","1.028","1.028","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003603","15.279","0.006","16.864","0.006","10.424","0.003","90","","90","","90","","2685.9","1.6","293","","","","","","","","","","Synthese in unserem Labor, Kristalle aus THF/n-Hexan","6","P b c n","-P 2n 2ab","60","","","","- C22 H26 Cl4 N5 O2 P3 -","- C22 H26 Cl4 N5 O2 P3 -","- C88 H104 Cl16 N20 O8 P12 -","4","0.5","SE1074","Diefenbach, U.; Allcock, H. R.; Visscher, K. B.","Strukturuntersuchungen einer anorganisch-organischen Spiroverbindung aus Cyclotriphosphazen und 9,10-Diaminophenanthren","Acta Crystallographica Section C","1995","51","6","1215","1218","10.1107/S0108270194013636","","","0.71073","MoKα","","","0.054","","","0.041","","","","","1.9","1.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003604","9.199","0.003","10.278","0.003","13.057","0.003","102.17","0.02","99.36","0.03","92.69","0.02","1186.5","0.6","300","1","300","1","","","","","","","","5","P -1","-P 1","2","","Bis-(tetraphenylphosphonium)-hexachlorodiindat(II)","","- C48 H40 Cl6 In2 P2 -","- C48 H40 Cl6 In2 P2 -","- C48 H40 Cl6 In2 P2 -","1","0.5","SE1075","Bubenheim, W.; Frenzen, G.; Müller, U.","Die Chloroindate [PPh~4~]~2~[In~2~Cl~6~] und [PPh~4~]~2~[InCl~5~].CH~3~CN","Acta Crystallographica Section C","1995","51","6","1120","1124","10.1107/S0108270194011789","","","0.71073","MoKα","","0.0443","0.0319","","0.0812","0.0758","","","","1.025","1.057","1.057","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003605","10.093","0.002","11.018","0.003","22.133","0.004","96.03","0.02","95.25","0.02","107.34","0.02","2316.8","0.9","299","2","299","2","","","","","","","","6","P -1","-P 1","2","","Tetraphenylphosphonium-pentachloroindat(III)-Acetonitril","","- C50 H43 Cl5 In N P2 -","- C49 H40 Cl5 In N0.5 P2 -","- C98 H80 Cl10 In2 N P4 -","2","1","SE1075","Bubenheim, W.; Frenzen, G.; Müller, U.","Die Chloroindate [PPh~4~]~2~[In~2~Cl~6~] und [PPh~4~]~2~[InCl~5~].CH~3~CN","Acta Crystallographica Section C","1995","51","6","1120","1124","10.1107/S0108270194011789","","","0.71073","MoKα","","0.0366","0.0297","","0.0804","0.0762","","","","1.056","1.075","1.075","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003606","8.336","0.002","18.259","0.005","15.183","0.004","90","","91.58","0.02","90","","2310.1","1","173","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 I2 P2 -","- C20 H30 I2 P2 -","- C80 H120 I8 P8 -","4","1","SH1103","Stammler, H.-G.; Jutzi, P.; Neumann, B.; Brusdeilins, N.","1,2-Diiod-1,2-bis(pentamethylcyclopentadienyl)diphosphan","Acta Crystallographica Section C","1995","51","6","1139","1141","10.1107/S0108270194013272","","","0.71073","MoKα","","0.1039","0.0703","","0.183","0.1456","","","","1.532","1.554","1.554","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003607","13.829","0.002","13.829","0.002","26.687","0.004","90","","90","","120","","4419.9","1.1","233","2","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C30 H39 O3 P S -","- C30 H39 O3 P S -","- C180 H234 O18 P6 S6 -","6","0.333333","SH1106","Büyükgüngör, O.; Odabaşoğlu, M.; Gümrükçüoğlu, İ. E.; Eichhorn, K.; Mattern, G.","Tris(<i>O</i>-4-<i>tert</i>-butylphenyl)thiophosphate, C~30~H~39~O~3~PS","Acta Crystallographica Section C","1995","51","6","1207","1209","10.1107/S0108270194013624","","","0.71069","MoKα","","","0.044","","","0.107","","","","","1.118","1.118","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003608","13.526","0.007","7.801","0.007","8.706","0.011","90","","109.14","0.05","90","","867.8","1.4","293","","","","","","","","","","see text","5","C 1 2/c 1","-C 2yc","15","","","","- C2 H10 Cr2 N2 O7 -","- C2 H10 Cr2 N2 O7 -","- C8 H40 Cr8 N8 O28 -","4","0.5","SH1107","Lorenzo-Luis, P. A.; Martín-Zarza, P.; Gili, P.; Arrieta, J. M.; Germain, G.; Dupont, L.","Ethylenediaminium Dichromate","Acta Crystallographica Section C","1995","51","6","1073","1075","10.1107/S0108270194014836","","","0.71073","MoKα","","","0.0223","","","0.0733","","","","","0.837","0.837","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003609","9.68","0.005","12.846","0.005","16.944","0.006","90","","90","","90","","2107","1.6","293","","","","","","","","","","synthesized in our own laboratory","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H26 Cl2 O Ti -","- C23 H26 Cl2 O Ti -","- C92 H104 Cl8 O4 Ti4 -","4","1","TA1007","Tian, J.; Hu, N.-H.; Shen, Q.; Huang, B.-T.","Dichloro(η^5^-cyclopentadienyl){[1-(4-methoxyphenyl)cyclohexyl]-η^5^-cyclopentadienyl}titanium(IV)","Acta Crystallographica Section C","1995","51","6","1065","1067","10.1107/S0108270194013910","","","0.71069","MoKα","","","0.066","","","0.086","","","","","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003610","14.648","0.002","9.8802","0.0005","10.9","0.001","90","","134.984","0.003","90","","1115.8","0.2","300","","","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C22 H27 Cl2 N Sn -","- C22 H27 Cl2 N Sn -","- C44 H54 Cl4 N2 Sn2 -","2","0.5","TA1012","Ng, S. W.","Tetramethylammonium Dichlorotriphenylstannate","Acta Crystallographica Section C","1995","51","6","1124","1125","10.1107/S0108270194014678","","","0.71073","MoKα","","","0.02","","","0.025","","","","","0.389","0.389","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003611","15.964","0.003","13.603","0.001","10.835","0.002","90","","97","0.007","90","","2335.4","0.6","298","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","diaqua-2,13-dimethyl-3,12,18-triaza-6,9-dioxabicyclo[12.3.1]octadeca- 1(18),2,12,14,16-pentaenemagnesium(II) perchlorate","","- C15 H25 Cl2 Mg N3 O12 -","- C15 H25 Cl2 Mg N3 O12 -","- C60 H100 Cl8 Mg4 N12 O48 -","4","0.5","TA1014","Othman, A. H.; Ng, S. W.","Diaqua[2,13-dimethyl-3,12,18-triaza-6,9-dioxa-bicyclo[12.3.1]octadeca-1(18),2,12,14,16-pentaene]magnesium(II) Diperchlorate","Acta Crystallographica Section C","1995","51","6","1059","1060","10.1107/S0108270194014848","","","0.71073","MoKα","","0.1008","0.0675","","0.1994","0.17","","","","1.062","1.099","1.099","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003612","16.38","0.003","5.5227","0.0005","17.355","0.003","90","","108.78","0.08","90","","1486.4","0.8","300","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 N2 O5 S -","- C13 H16 N2 O5 S -","- C52 H64 N8 O20 S4 -","4","1","TA1018","Ng, S. W.","<i>S</i>-Benzylisothiouronium Hydrogen 2-Oxopentanedioate, C~8~H~11~N~2~S^+^.C~5~H~5~O~5~^{-^}","Acta Crystallographica Section C","1995","51","6","1143","1144","10.1107/S0108270194012382","","","0.71073","MoKα","","","0.06","","","0.069","","","","","0.465","0.465","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003613","13.247","0.003","6.769","0.001","7.302","0.001","90","","107.39","0.02","90","","624.8","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","di-chloro-bis(1-ethyltetrazole)copper(II)","trans-di-chloro-bis(1-ethyltetrazole-N^4^)copper(II)","","- C6 H12 Cl2 Cu N8 -","- C6 H12 Cl2 Cu N8 -","- C12 H24 Cl4 Cu2 N16 -","2","0.5","VS1015","Virovets, A. V.; Podberezskaya, N. V.; Lavrenova, L. G.; Bikzhanova, G. A.","<i>trans</i>-Dichlorobis(1-ethyltetrazole-<i>N</i>^4^)copper(II)","Acta Crystallographica Section C","1995","51","6","1084","1087","10.1107/S0108270194013429","","","1.54178","CuKα","","0.0628","0.0611","","0.1663","0.1636","","","","1.065","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003614","5.335","0.002","10.625","0.002","11.886","0.002","109.36","0.02","96.47","0.02","90.56","0.02","630.8","0.3","298","","","","","","","","","","slow recrystallization from DMF","5","P -1","-P 1","2","","","","- C12 H12 N4 O2 S -","- C12 H12 N4 O2 S -","- C24 H24 N8 O4 S2 -","2","1","AB1125","Pomés Hernández, R.; Duque Rodríguez, J.; García Trimiño, M. I.; Novoa de Armas, H.; Toscano, R. A.","6-Methylamino-4-methylthio-5-nitro-2-phenylpyrimidine","Acta Crystallographica Section C","1995","51","7","1392","1394","10.1107/S0108270194013831","","","0.71069","MoKα","","","0.061","","","0.068","","","","","1.11","1.11","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2003615","10.412","0.003","12.9","0.002","16.892","0.005","81.48","0.03","73.48","0.03","79.6","0.02","2128.1","1","293","1","","","","","","","","","","3","P -1","-P 1","2","","","","- C48 H64 O2 -","- C48 H64 O2 -","- C96 H128 O4 -","2","1","AB1130","Ting, Y.; Verboom, W.; Reinhoudt, D. N.; Harkema, S.","1,3-Diethoxy-2,4-didehydroxy-<i>p</i>-<i>tert</i>-butylcalix[4]arene","Acta Crystallographica Section C","1995","51","7","1465","1467","10.1107/S0108270194014150","","","0.7107","MoKα","","","0.07","","","0.08","","","","","2.38","2.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003616","9.093","0.007","12.108","0.009","12.599","0.008","64.1","0.04","80.35","0.05","87.61","0.06","1229.4","1.6","178","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H80 Ni2 O16 Sb4 -","- C32 H80 Ni2 O16 Sb4 -","- C32 H80 Ni2 O16 Sb4 -","1","0.5","AB1151","Bemm, U.; Norrestam, R.; Nygren, M.; Westin, G.","Two Transition-Metal Antimony Ethoxides: <i>M</i>~2~Sb~4~(OEt)~16~; <i>M</i> = Ni or Mn","Acta Crystallographica Section C","1995","51","7","1260","1263","10.1107/S0108270195000783","","","0.71073","MoKα","","","0.033","","","0.038","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003617","9.143","0.004","12.318","0.004","12.798","0.004","63.65","0.02","79.9","0.02","86.86","0.02","1271.1","0.8","178","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H80 Mn2 O16 Sb4 -","- C32 H80 Mn2 O16 Sb4 -","- C32 H80 Mn2 O16 Sb4 -","1","0.5","AB1151","Bemm, U.; Norrestam, R.; Nygren, M.; Westin, G.","Two Transition-Metal Antimony Ethoxides: <i>M</i>~2~Sb~4~(OEt)~16~; <i>M</i> = Ni or Mn","Acta Crystallographica Section C","1995","51","7","1260","1263","10.1107/S0108270195000783","","","0.71073","MoKα","","","0.039","","","0.054","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003618","10.879","0.005","17.591","0.007","10.649","0.005","102.96","0.04","97.46","0.03","81.64","0.03","1954.9","1.5","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H38 P2 Pd2 S4 -","- C40 P2 Pd2 S4 -","- C80 P4 Pd4 S8 -","2","1","AB1192","Cao, R.; Hong, M.; Jiang, F.; Liu, H.","A Dinuclear Palladium Compound, [Pd~2~(PPh~3~)~2~(SC~2~H~4~S)~2~]","Acta Crystallographica Section C","1995","51","7","1280","1282","10.1107/S0108270194015076","","","0.71073","MoKα","","","0.041","","","0.047","","","","","3.327","3.327","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003619","12.841","0.007","8.113","0.004","14.219","0.007","90","","115.89","0.04","90","","1332.6","1.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","7-Hydroxy-4'-methoxy Flavanone","","- C16 H14 O4 -","- C16 H14 O4 -","- C64 H56 O16 -","4","1","AB1220","Kendi, E.; Özbey, S.; Ertan, R.; Fun, H.-K.; Yip, B.-C.","7-Hydroxy-4'-methoxyflavanone","Acta Crystallographica Section C","1995","51","7","1442","1444","10.1107/S010827019500062X","","","0.71073","MoKα","","0.1035","0.0598","","0.1868","0.1614","","","","1.075","1.276","1.276","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003620","5.894","0.003","12.954","0.001","23.602","0.002","90","","90","","90","","1802","0.9","293","","","","","","","","","","The material was supplied by Aldrich and recrystallized from toluene","3","F 2 d d","F -2d 2","43","","","","- C12 H8 F2 -","- C12 H8 F2 -","- C96 H64 F16 -","8","0.5","AB1225","Rajnikant; Watkin, D.; Tranter, G.","Disordered Fluorine in 2-Fluorobiphenyl","Acta Crystallographica Section C","1995","51","7","1452","1454","10.1107/S0108270195000631","","","1.54184","CuKα","","","0.04534","","","0.06006","","","","","0.85","0.85","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003621","5.9268","0.0002","19.6263","0.0015","22.9946","0.0024","90","","93.853","0.006","90","","2668.7","0.4","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H15 Cl3 N12 O8 -","- C19 H15 Cl3 N12 O10 -","- C76 H60 Cl12 N48 O40 -","4","1","AB1234","Llamas-Saiz, A. L.; Foces-Foces, C.; Echevarría, A.; Elguero, J.","The Relative Basicities of Tris(pyrazol-1-yl)-1,3,5-triazine (TPT), Water and the Picrate Anion in the Solid State","Acta Crystallographica Section C","1995","51","7","1401","1404","10.1107/S010827019500028X","","","1.5418","CuKα","","","0.062","","","0.071","","","","","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003622","21.8247","0.0007","21.8247","0.0007","11.1964","0.0004","90","","90","","120","","4618.5","0.3","295","","","","","","","","","","","3","P 62","P 62","171","","","","- C17 H20 O2 -","- C17 H20.5 O2 -","- C204 H246 O24 -","12","2","AB1235","Llamas-Saiz, A. L.; Foces-Foces, C.; Weber, E.; Wimmer, C.","A Crystalline Inclusion Compound and Two Host Structures Containing Chiral Molecules Derived from Lactic Acid","Acta Crystallographica Section C","1995","51","7","1447","1452","10.1107/S0108270195000801","","","1.5418","CuKα","","","0.055","","","0.074","","","","","1.05","1.05","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003623","25.5347","0.0033","17.3004","0.0014","7.6486","0.0003","90","","90","","90","","3378.8","0.5","295","","","","","","","","","","","3","I b a 2","I 2 -2c","45","","","","- C23 H20 O2 -","- C23 H20 O2 -","- C184 H160 O16 -","8","1","AB1235","Llamas-Saiz, A. L.; Foces-Foces, C.; Weber, E.; Wimmer, C.","A Crystalline Inclusion Compound and Two Host Structures Containing Chiral Molecules Derived from Lactic Acid","Acta Crystallographica Section C","1995","51","7","1447","1452","10.1107/S0108270195000801","","","1.5418","CuKα","","","0.035","","","0.039","","","","","1.15","1.15","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003624","11.6039","0.0005","31.6071","0.0019","6.2398","0.0002","90","","102.22","0.003","90","","2236.69","0.18","295","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C52 H71 N O4 -","- C52 H71 N O4 -","- C104 H142 N2 O8 -","2","1","AB1235","Llamas-Saiz, A. L.; Foces-Foces, C.; Weber, E.; Wimmer, C.","A Crystalline Inclusion Compound and Two Host Structures Containing Chiral Molecules Derived from Lactic Acid","Acta Crystallographica Section C","1995","51","7","1447","1452","10.1107/S0108270195000801","","","1.5418","CuKα","","","0.049","","","0.056","","","","","1.15","1.15","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003625","7.487","0.002","15.47","0.007","8.131","0.007","90","","109.55","0.03","90","","887.5","0.9","293","2","293","2","","","","","","","Lab. of Medicinal Chemistry, Li\`ege","5","P 1 21/a 1","-P 2yab","14","","3-amino-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-dioxide monohydrate","","- C6 H8 N4 O3 S -","- C6 H8 N4 O3 S -","- C24 H32 N16 O12 S4 -","4","1","AB1238","Dupont, L.; Pirotte, B.; de Tullio, P.; Masereel, B.; Delarge, J.","3-Amino-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-Dioxide Monohydrate and 3-<i>tert</i>-Butyl-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-Dioxide","Acta Crystallographica Section C","1995","51","7","1385","1388","10.1107/S0108270195000278","","","1.5418","CuKα","","0.0466","0.0342","","0.1035","0.1002","","","","1.062","1.173","1.173","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003626","9.802","0.009","11.682","0.009","10.384","0.016","90","","108","0.1","90","","1131","2","293","2","293","2","","","","","","","Lab. of Medicinal Chemistry, Li\`ege","5","P 1 21/a 1","-P 2yab","14","","3-tert butyl-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-dioxide","","- C10 H13 N3 O2 S -","- C10 H13 N3 O2 S -","- C40 H52 N12 O8 S4 -","4","1","AB1238","Dupont, L.; Pirotte, B.; de Tullio, P.; Masereel, B.; Delarge, J.","3-Amino-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-Dioxide Monohydrate and 3-<i>tert</i>-Butyl-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-Dioxide","Acta Crystallographica Section C","1995","51","7","1385","1388","10.1107/S0108270195000278","","","1.5418","CuKα","","0.0489","0.0443","","0.1297","0.1276","","","","1.103","1.16","1.16","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003627","9.315","0.003","12.995","0.005","8.913","0.003","105.63","0.03","104.29","0.03","69.98","0.03","961.9","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(3-chloro-1,2-propanediolato)bis(2,3-dimethyl-2,3- butanediolato)tungsten(VI)","","- C15 H29 Cl O6 W -","- C15 H29 Cl O6 W -","- C30 H58 Cl2 O12 W2 -","2","1","AB1247","Lehtonen, A.; Sillanpää, R.","(3-Chloro-1,2-propanediolato-<i>O</i>,<i>O</i>')bis(2,3-dimethyl-2,3-butanediolato-<i>O</i>,<i>O</i>')tungsten(VI)","Acta Crystallographica Section C","1995","51","7","1270","1271","10.1107/S0108270195000485","","","0.71069","MoKα","","0.0813","0.0466","","0.1225","0.1091","","","","1.056","1.076","1.076","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003628","10.352","0.002","7.119","0.001","10.652","0.002","90","","104.89","0.03","90","","758.6","0.3","130","2","130","2","","","","","","","evaporation from hexane/dichloromethane","5","P 1 21 1","P 2yb","4","","methyl (S)-2-benzenesulfonyloxy-4-bromo-4-methylpentanoate","","- C13 H17 Br O5 S -","- C13 H17 Br O5 S -","- C26 H34 Br2 O10 S2 -","2","1","AB1251","Shaw, J. P.; Tan, E. W.; Blackman, A. G.","Homochiral Methyl (<i>S</i>)-2-Benzenesulfonyloxy-4-bromo-4-methylpentanoate","Acta Crystallographica Section C","1995","51","7","1411","1412","10.1107/S0108270195001818","","","0.71073","MoKα","","0.0555","0.04","","0.0898","0.0829","","","","1.05","1.068","1.068","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003629","9.834","0.005","10.973","0.006","11.51","0.006","112.51","0.02","89.56","0.02","107.24","0.02","1087.9","1","295","2","295","2","","","","","","","","3","P -1","-P 1","2","anthracenecarboxylic anhydride","5,5'-di(anthracenecarboxylic) anhydride","","- C30 H18 O3 -","- C30 H18 O3 -","- C60 H36 O6 -","2","1","AB1274","Blake, A. J.; Grimditch, R. S.; Schröder, M.","5,5'-Di(anthracenecarboxylic) Anhydride","Acta Crystallographica Section C","1995","51","7","1472","1474","10.1107/S0108270195004306","","","0.71073","MoKα","","0.0935","0.0555","","0.1724","0.1285","","","","1.042","1.07","1.07","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003630","6.466","0.003","4.634","0.002","10.755","0.005","90","","94.74","0.04","90","","321.2","0.3","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C5 H4 N2 O4 -","- C5 H4 N2 O4 -","- C10 H8 N4 O8 -","2","1","AS1123","Stash, A. I.; Zavodnik, V. E.; Belsky, V. K.","A <i>Z</i> Isomer of 5-Nitrofuran-2-aldoxime","Acta Crystallographica Section C","1995","51","7","1303","1304","10.1107/S0108270194011042","","","0.71069","MoKα","","","0.03","","","0.08","","","","","1.13","1.13","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003631","10.086","0.003","8.829","0.002","10.503","0.002","90","","103.43","0.02","90","","909.7","0.4","296","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 O5 -","- C9 H10 O5 -","- C36 H40 O20 -","4","1","AS1143","Okabe, N.; Suga, T.; Kohyama, Y.","<small>DL</small>-4-Hydroxy-3-methoxymandelic Acid","Acta Crystallographica Section C","1995","51","7","1322","1324","10.1107/S0108270194013259","","","0.71069","MoKα","","","0.047","","","0.054","","","","","1.71","1.71","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003632","13.945","0.009","15.406","0.008","13.83","0.008","90","","90","","90","","2971","3","295","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H16 Br2 O4 -","- C13 H16 Br2 O4 -","- C104 H128 Br16 O32 -","8","1","AS1147","Satake, K.; Itoh, H.; Kimura, M.; Morosawa, S.; Kashino, S.","Dimethyl 4-<i>exo</i>,9-<i>endo</i>-Dibromobicyclo[3.3.1]non-2-ene-2,3-dicarboxylate","Acta Crystallographica Section C","1995","51","7","1397","1399","10.1107/S0108270195001235","","","0.71073","MoKα","","","0.047","","","0.03","","","","","1.53","1.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003633","11.528","0.003","9.166","0.001","14.655","0.002","90","","90","","90","","1548.5","0.5","296","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C8 H7 N3 O -","- C8 H7 N3 O -","- C64 H56 N24 O8 -","8","1","AS1148","Yang, Q.-C.; Huang, D.-M.; Chen, H.-Y.; Tang, Y.-Q.","Phenyl Carbamidonitrile","Acta Crystallographica Section C","1995","51","7","1412","1414","10.1107/S0108270194014290","","","0.71073","MoKα","","","0.0436","","","0.0455","","","","","1.51","1.51","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003634","4.867","0.002","6.895","0.002","20.2","0.006","90","","95.23","0.01","90","","675","0.4","293","","","","","","","","","","see text","3","P 1 21/n 1","-P 2yn","14","","","","- C7 H8 O3 -","- C7 H8 O3 -","- C28 H32 O12 -","4","1","AS1151","Brown, S. D.; Burgess, J.; Fawcett, J.; Parsons, S. A.; Russell, D. R.; Waltham, E.","Three Polymorphic Forms of 2-Ethyl-3-hydroxy-4-pyranone (Ethyl Maltol)","Acta Crystallographica Section C","1995","51","7","1335","1338","10.1107/S010827019401423X","","","0.71073","MoKα","","","0.077","","","0.104","","","","","1.83","1.83","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003635","20.828","0.003","20.828","0.003","7.832","0.002","90","","90","","120","","2942.4","1","293","","","","","","","","","","see text","3","R -3 :H","-R 3","148","","","","- C7 H8 O3 -","- C7 H8 O3 -","- C126 H144 O54 -","18","1","AS1151","Brown, S. D.; Burgess, J.; Fawcett, J.; Parsons, S. A.; Russell, D. R.; Waltham, E.","Three Polymorphic Forms of 2-Ethyl-3-hydroxy-4-pyranone (Ethyl Maltol)","Acta Crystallographica Section C","1995","51","7","1335","1338","10.1107/S010827019401423X","","","0.71073","MoKα","","","0.0408","","","0.057","","","","","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003636","7.144","0.003","7.641","0.002","7.7","0.004","62.13","0.01","68.28","0.01","76.39","0.01","344.2","0.3","293","","","","","","","","","","see text","3","P -1","-P 1","2","","","","- C7 H8 O3 -","- C7 H8 O3 -","- C14 H16 O6 -","2","1","","Brown, S. D.; Burgess, J.; Fawcett, J.; Parsons, S. A.; Russell, D. R.; Waltham, E.","Three Polymorphic Forms of 2-Ethyl-3-hydroxy-4-pyranone (Ethyl Maltol)","Acta Crystallographica Section C","1995","51","7","1335","1338","10.1107/S010827019401423X","","","0.71073","MoKα","","","0.0519","","","0.0733","","","","","1.1","1.1","","","","","has coordinates","175362","2020-10-21","18:00:00",""
"2003637","6.807","0.001","8.5813","0.0009","13.994","0.004","90","","98.2","0.01","90","","809.1","0.3","298","2","","","","","","","","","see text","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H8 Cl N O3 -","- C6 H8 Cl N O3 -","- C24 H32 Cl4 N4 O12 -","4","1","AS1154","Smith, G.; Byriel, K. A.; Kennard, C. H. L.","2-Carboxypyridinium Chloride Monohydrate","Acta Crystallographica Section C","1995","51","7","1425","1427","10.1107/S0108270195000175","","","0.71073","MoKα","","","0.039","","","0.095","","","","","1.01","1.01","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003638","11.356","0.002","5.358","0.001","14.122","0.002","90","","105.94","","90","","826.2","0.2","296","","","","","","","","","","evaporation from water","3","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","1","AS1155","Okabe, N.; Suga, T.","3-(<i>p</i>-Hydroxyphenyl)propionic Acid","Acta Crystallographica Section C","1995","51","7","1324","1325","10.1107/S0108270194014964","","","0.71069","MoKα","","","0.05","","","0.063","","","","","2.44","2.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003639","14.298","0.003","14.4","0.003","27.187","0.003","90","","91.54","0.01","90","","5595.5","1.8","296","1","","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C272 H224 N32 O32 -","16","2","BK0003","Akama, Y.; Shiro, M.; Ueda, T.; Kajitani, M.","Keto and Enol Tautomers of 4-Benzoyl-3-methyl-1-phenyl-5(2<i>H</i>)-pyrazolone","Acta Crystallographica Section C","1995","51","7","1310","1314","10.1107/S0108270194007389","","","1.54178","CuKα","","","0.038","","","0.056","","","","","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003640","11.44","0.004","9.11","0.007","13.51","0.009","90","","90.8","0.3","90","","1407.9","1.5","293","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","","","","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C68 H56 N8 O8 -","4","1","BK0003","Akama, Y.; Shiro, M.; Ueda, T.; Kajitani, M.","Keto and Enol Tautomers of 4-Benzoyl-3-methyl-1-phenyl-5(2<i>H</i>)-pyrazolone","Acta Crystallographica Section C","1995","51","7","1310","1314","10.1107/S0108270194007389","","","0.7107","MoKα","","","0.063","","","0.077","","","","","2.19","2.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003641","10.33","0.001","24.092","0.001","21.543","0.001","90","","97.89","0.01","90","","5310.7","0.6","127","2","127","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaquo-5,10,15,20-(Tetraphenylporphinato)iron(III) Perchlorate","","- C44 H32 Cl Fe N4 O6 -","- C44 H32 Cl Fe N4 O6 -","- C264 H192 Cl6 Fe6 N24 O36 -","6","1.5","BK1091","Cheng, B.; Scheidt, W. R.","Diaqua(5,10,15,20-tetraphenylporphinato)iron(III) Perchlorate, [Fe(C~44~H~28~N~4~)(H~2~O)~2~]ClO~4~","Acta Crystallographica Section C","1995","51","7","1271","1275","10.1107/S0108270195001028","","","0.71073","MoKα","","0.1133","0.0684","","0.1939","0.1657","","","","1.057","1.156","1.156","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003642","32.456","0.005","5.674","0.002","3.995","0.002","90","","90","","90","","735.7","0.5","296","","","","","","","","","","","3","P n n 2","P 2 -2n","34","","","","- Nb5 O17 Sr5 -","- Nb5 O17 Sr5 -","- Nb10 O34 Sr10 -","2","0.5","BR1096","Schmalle, H. W.; Williams, T.; Reller, A.; Lichtenberg, F.; Widmer, D.; Bednorz, J. G.","A Novel Semiconducting Perovskite-Related Phase: Sr~5~Nb~5~O~17~","Acta Crystallographica Section C","1995","51","7","1243","1246","10.1107/S0108270195000977","","","0.71073","MoKα","","","0.0387","","","0.0449","","","","","3.396","3.396","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003643","6.7214","0.0006","13.8558","0.0007","7.2764","0.0004","90","","105.927","0.006","90","","651.64","0.08","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- Al4 F9 K3 O8 P2 -","- Al4 F9 K3 O8 P2 -","- Al8 F18 K6 O16 P4 -","2","0.5","BR1099","Massa, W.; Yakubovich, O. V.; Karimova, O. V.; Dem'yanets, L. N.","A New Type of Mixed Anionic Framework in the Structure of K~3~[Al~4~F~9~(PO~4~)~2~]","Acta Crystallographica Section C","1995","51","7","1246","1249","10.1107/S0108270195000576","","","1.54178","CuKα","","0.0381","0.0333","","0.0912","0.0879","","","","1.03","1.056","1.056","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003644","7.479","0.002","12.221","0.005","19.306","0.006","90","","90","","90","","1764.6","1","295","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C10 H25 F2 N2 O5 P S -","- C10 H25 F2 N2 O5 P S -","- C40 H100 F8 N8 O20 P4 S4 -","4","1","CR1095","Baenziger, N. C.; Burton, D. J.; Modak, A. S.","Triethylammonium Isopropyl [(Aminosulfonyl)(difluoro)methyl]phosphonate","Acta Crystallographica Section C","1995","51","7","1355","1356","10.1107/S0108270194012254","","","0.71073","MoKα","","","0.034","","","0.056","","","","","1.17","1.17","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003645","7.37","0.001","10.919","0.002","9.887","0.001","90","","108.45","0.01","90","","754.74","0.19","293","","","","","","","","","","recrystallization from ethanol","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H4 Br N O3 -","- C6 H4 Br N O3 -","- C24 H16 Br4 N4 O12 -","4","1","CR1140","Pomés, R.; Duque, J.; Novoa, H.; Castañedo, N.; Toscano, A.","5-Bromo-2-(2-nitroethenyl)furan","Acta Crystallographica Section C","1995","51","7","1368","1369","10.1107/S0108270194012394","","","0.71069","MoKα","","","0.05","","","0.06","","","","","1.61","1.61","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003646","9.248","0.002","16.521","0.004","10.359","0.002","90","","109.31","0.01","90","","1493.7","0.6","294","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C15 H20 N2 O3 -","- C15 H20 N2 O3 -","- C60 H80 N8 O12 -","4","1","CR1149","Wireko, F. C.; Matthews, R. S.; Thoman, S. M.; Hennes, D. H.; Sickman, L. H.","An Unexpected Intermediate in the Synthesis of Substituted Pyridones","Acta Crystallographica Section C","1995","51","7","1404","1407","10.1107/S0108270195001259","","","1.5406","CuKα","","","0.052","","","0.035","","","","","2.43","2.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003647","7.986","0.001","12.798","0.003","5.481","0.001","94.08","0.02","95.45","0.01","95.81","0.01","552.94","0.18","296","","","","","","","","","","","6","P -1","-P 1","2","","","","- C6 H10 N Na O9 S -","- C6 H10 N Na O9 S -","- C12 H20 N2 Na2 O18 S2 -","2","1","CR1155","Squattrito, P. J.","Sodium 4-Hydroxy-3-nitrobenzenesulfonate Trihydrate","Acta Crystallographica Section C","1995","51","7","1282","1284","10.1107/S0108270195000849","","","0.71073","MoKα","","","0.031","","","0.032","","","","","1.74","1.74","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003648","5.502","0.001","15.384","0.001","9.918","0.002","90","","93.43","0.02","90","","838","0.2","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2',3'-dideoxy-3'-C-2'-N-[N(R)-methyl-5-(R)-ethoxycarbonyl-1,2-isoxazolidine] ribothymidine","","- C15 H21 N3 O7 -","- C15 H21 N3 O7 -","- C30 H42 N6 O14 -","2","1","CR1159","Burkhart, B. M.; Papchikhin, A.; Chattopadhyaya, J.; Sundaralingam, M.","2',3'-Dideoxy-3'-<i>C</i>,2'-<i>N</i>-[(3<i>R</i>,5<i>R</i>)-5-ethoxycarbonyl-2-methyl-1,2-isoxazolidine]ribothymidine","Acta Crystallographica Section C","1995","51","7","1462","1464","10.1107/S0108270194014332","","","0.7107","MoKα","","0.0762","0.0369","","0.1311","0.0834","","","","1.05","1.091","1.091","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003649","15.134","0.002","7.403","0.002","17.27","0.002","90","","105.25","0.01","90","","1866.7","0.6","293","","293","","","","","","","","synthesized by authors","3","P 1 21 1","P 2yb","4","cholesteryl-4-octeneoxybenzoate","cholesteryl-4-octeneoxybenzoate","","- C42 H64 O3 -","- C42 H64 O3 -","- C84 H128 O6 -","2","1","CR1163","Chabinyc, M. L.; Fratini, A. V.; Socci, E. P.; Farmer, B. L.; Bunning, T. J.; Adams, W. W.","Cholesteryl 4-(8-Octenyloxy)benzoate","Acta Crystallographica Section C","1995","51","7","1444","1447","10.1107/S010827019500093X","","","0.71073","MoKα","","0.163","0.059","","0.079","0.05","","","","1.492","1.549","1.549","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2003650","8.2796","0.0009","8.644","0.001","11.336","0.001","97.84","0.01","104.36","0.01","115.03","0.01","684.7","0.16","293","","","","","","","","","","see text","5","P -1","-P 1","2","","","","- C14 H12 Cl2 N2 O -","- C14 H12 Cl2 N2 O -","- C28 H24 Cl4 N4 O2 -","2","1","CR1173","Mague, J. T.; De, D.; Krogstad, D. J.","An Intermediate for Chloroquine Analogs: (<i>E</i>)-2-(4,7-Dichloro-2-quinolinyl)-3-(dimethylamino)-2-propenal","Acta Crystallographica Section C","1995","51","7","1423","1425","10.1107/S0108270195000151","","","0.71073","MoKα","","","0.038","","","0.049","","","","","1.56","1.56","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003651","9.418","0.006","14.31","0.01","6.303","0.007","90","","92.45","0.07","90","","848.7","1.2","295","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H9 F N O3 P -","- C6 H9 F N O3 P -","- C24 H36 F4 N4 O12 P4 -","4","1","DU1082","Khaoulani Idrissi, A.; Rafiq, M.; Gougeon, P.; Guerin, R.","Anilinium Hydrogen Monofluorophosphate, C~6~H~8~N^+^.HPO~3~F^{-^}","Acta Crystallographica Section C","1995","51","7","1359","1361","10.1107/S010827019401214X","","","0.71073","MoKα","","","0.046","","","0.049","","","","","1.165","1.165","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003652","4.904","0.001","4.904","0.001","26.186","0.01","90","","90","","120","","545.4","0.3","293","2","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Co6.3 Nb6.7 -","- Co6.3 Nb6.7 -","- Co18.9 Nb20.1 -","3","0.0833333","DU1106","Wagner, V.; Conrad, M.; Harbrecht, B.","The μ-Phase of Co~6.3~Nb~6.7~","Acta Crystallographica Section C","1995","51","7","1241","1243","10.1107/S0108270195000552","","","0.71069","MoKα","","","0.0286","","0.096","0.081","","","","","1.076","1.076","","","","","has coordinates","176342","2020-10-21","18:00:00",""
"2003653","7.2169","0.0005","7.2821","0.0006","11.5524","0.0002","82.154","0.01","87.096","0.01","64.494","0.01","542.8","0.08","293","2","293","2","","","","","","","synth\`ese","5","P -1","-P 1","2","","Ortho-phénylènediammonium Dihydrogénodiphosphate","","- C6 H12 N2 O7 P2 -","- C6 H12 N2 O7 P2 -","- C12 H24 N4 O14 P4 -","2","1","DU1108","Soumhi, E. H.; Jouini, T.","<i>o</i>-Phénylènediammonium Dihydrogénodiphosphate","Acta Crystallographica Section C","1995","51","7","1457","1459","10.1107/S0108270195000230","","","0.71069","MoKα","","0.031","0.028","","0.0808","0.0801","","","","2.817","2.925","2.925","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003654","23.512","0.004","23.861","0.004","22.417","0.004","90","","103.16","0.01","90","","12246","4","120","","","","","","","","","","Mn(O~2~CCH~3~)~2~.4H~2~O + C~5~H~5~N + 3,5-(NO~2~)~2~-C~6~H~3~CO~2~H + ^n^Bu~4~MnO~4~ in C~2~H~5~OH; crystals from acetone/ether","5","C 1 2/c 1","-C 2yc","15","","","","- C100 H84 Mn6 N22 O68 -","- C104 H78 Mn6 N22 O67 -","- C416 H312 Mn24 N88 O268 -","4","0.5","FG1000","Halcrow, M. A.; Streib, W. E.; Folting, K.; Christou, G.","[Mn~6~O~2~{O~2~C-3,5-(NO~2~)~2~-C~6~H~3~}~10~(C~5~H~5~N)~2~{(CH~3~)~2~CO}~2~].2(CH~3~)~2~CO.2(C~2~H~5~)~2~O and [Mn~6~O~2~(O~2~CC~6~H~5~)~10~(NCCH~3~)~4~]","Acta Crystallographica Section C","1995","51","7","1263","1267","10.1107/S0108270194013764","","","0.71069","MoKα","","","0.0685","","","0.0666","","","","","1.415","1.415","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003655","18.441","0.003","24.561","0.004","17.497","0.003","90","","90","","90","","7925","2","103","","","","","","","","","","Ph~4~P[Mn~4~O~2~(O~2~CPh)~9~(OH~2~)] + Na^+^(2-Me~2~N-C~6~H~4~CO~2~^-^) in MeCN at 263 K","5","P b n a","-P 2ac 2b","60","","","","- C78 H62 Mn6 N4 O22 -","- C78 H62 Mn6 N4 O22 -","- C312 H248 Mn24 N16 O88 -","4","0.5","FG1000","Halcrow, M. A.; Streib, W. E.; Folting, K.; Christou, G.","[Mn~6~O~2~{O~2~C-3,5-(NO~2~)~2~-C~6~H~3~}~10~(C~5~H~5~N)~2~{(CH~3~)~2~CO}~2~].2(CH~3~)~2~CO.2(C~2~H~5~)~2~O and [Mn~6~O~2~(O~2~CC~6~H~5~)~10~(NCCH~3~)~4~]","Acta Crystallographica Section C","1995","51","7","1263","1267","10.1107/S0108270194013764","","","0.71069","MoKα","","","0.075","","","0.064","","","","","1.072","1.072","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003656","11.968","0.002","7.34","0.001","13.539","0.002","90","","99.77","0.01","90","","1172.1","0.3","195","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H38 O2 S2 -","- C24 H38 O2 S2 -","- C48 H76 O4 S4 -","2","0.5","FG1013","Pelletier, M.; Brisse, F.; Cloutier, R.; Leclerc, M.","3,3'-Bis(octyloxy)-2,2'-bithiophene at 195 K","Acta Crystallographica Section C","1995","51","7","1394","1397","10.1107/S0108270195001090","","","1.54184","CuKα","","","0.036","","","0.046","","","","","1.749","1.749","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003657","10.345","0.001","17.316","0.002","15.94","0.002","90","","90","","90","","2855.4","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Bis(5,5-diphenylhydantoinato)diamminezinc(II) Hemihydrate","","- C30 H29 N6 O4.5 Zn -","- C30 H29 N6 O4.5 Zn -","- C120 H116 N24 O18 Zn4 -","4","0.5","FG1044","Roszak, A. W.; Milne, P.; Weaver, D. F.","Diamminebis(5,5-diphenylhydantoinato)zinc(II) Hemihydrate","Acta Crystallographica Section C","1995","51","7","1297","1300","10.1107/S0108270195000291","","","0.71069","MoKα","","0.0577","0.0423","","0.1373","0.1199","","","","1.092","1.092","1.092","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003658","11.793","0.003","23.267","0.003","12.713","0.001","90","","111.48","0.02","90","","3246","1.1","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H33 As2 Cl Pd -","- C37 H33 As2 Cl Pd -","- C148 H132 As8 Cl4 Pd4 -","4","1","FG1047","Rath, N. P.; Ladipo, F. T.; Anderson, G. K.","<i>trans</i>-Chloro(methyl)bis(triphenylarsine)palladium(II)","Acta Crystallographica Section C","1995","51","7","1289","1290","10.1107/S010827019401485X","","","0.71073","MoKα","","0.0812","0.0365","","0.0807","0.0723","","","","0.815","0.996","0.996","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003659","7.136","0.001","7.221","0.001","24.405","0.003","90","","90","","90","","1257.6","0.3","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2S,4R,5R)-(-)-3 Isopropyl-4-methyl-5-phenyl-1,2,3-oxathiazolidine 2-Oxide","","- C12 H17 N O2 S -","- C12 H17 N O2 S -","- C48 H68 N4 O8 S4 -","4","1","FG1054","Robinson, P. D.; Hua, D. H.; Chen, J.; Lagneau, N.","(2<i>S</i>,4<i>R</i>,5<i>R</i>)-({-})-3-Isopropyl-4-methyl-5-phenyl-1,2,3-oxathiazolidine 2-Oxide","Acta Crystallographica Section C","1995","51","7","1372","1374","10.1107/S010827019500076X","","","0.71069","MoKα","","","0.031","","","0.036","","","","","1.54","1.54","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003660","12.33","0.03","8.26","0.04","14.25","0.03","90","","115","0.5","90","","1315","9","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2-dimethyl-9-phenyl-1,2H-dihydropurine-6-carboxamide","","- C14 H15 N5 O -","- C14 H15 N5 O -","- C56 H60 N20 O4 -","4","1","HA1128","Beagley, B.; Booth, B. L.; Eastwood, P. R.; Kieger, S.; Pritchard, R. G.; Alves, M. J.; Carvalho, A.; Proença, M. F. J. R. P.","A Tautomeric Pair of 2,2-Dimethyl-6-carbamoyl-9-phenyldihydropurines","Acta Crystallographica Section C","1995","51","7","1467","1470","10.1107/S0108270194009558","","","0.71069","MoKα","","","0.049","","","0.052","","","","","1.49","1.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003661","11.13","0.008","7.999","0.008","15.162","0.008","90","","95.81","0.05","90","","1342.9","1.8","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2-dimethyl-9-phenyl-2,3H-dihydropurine-6-carboxamide","","- C14 H15 N5 O -","- C14 H15 N5 O -","- C56 H60 N20 O4 -","4","1","HA1128","Beagley, B.; Booth, B. L.; Eastwood, P. R.; Kieger, S.; Pritchard, R. G.; Alves, M. J.; Carvalho, A.; Proença, M. F. J. R. P.","A Tautomeric Pair of 2,2-Dimethyl-6-carbamoyl-9-phenyldihydropurines","Acta Crystallographica Section C","1995","51","7","1467","1470","10.1107/S0108270194009558","","","0.71069","MoKα","","","0.066","","","0.078","","","","","2.51","2.51","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003662","25.166","0.001","8.588","0.001","18.382","0.001","90","","136.53","0.04","90","","2733","2","296","1","","","","","","","","","recrystallization from methanol","3","C 1 2 1","C 2y","5","","","","- C17 H19 N3 -","- C17 H19 N3 -","- C136 H152 N24 -","8","2","HA1136","Baradarani, M. M.; Beddoes, R. L.; Mills, O. S.; Joule, J. A.","A Naphthalene-Fused Tricyclic Orthoamide","Acta Crystallographica Section C","1995","51","7","1345","1347","10.1107/S010827019401471X","","","0.71073","MoKα","","","0.032","","","0.041","","","","","1.12","1.12","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003663","15.988","0.004","5.715","0.001","16.097","0.004","90","","112.88","0.02","90","","1355.1","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(∓)-threo-2,3-diphenyl-3-hydroxypropanoic acid, methyl ester","","- C16 H16 O3 -","- C16 H15 O3 -","- C64 H60 O12 -","4","1","HA1137","Kolev, T.; Preut, H.; Bleckmann, P.; Juchnovski, I.","(±)-<i>threo</i>-3-Hydroxy-2,3-diphenylpropanoic Acid Methyl Ester","Acta Crystallographica Section C","1995","51","7","1350","1352","10.1107/S0108270194014277","","","0.71073","MoKα","","0.0579","0.0409","","0.1202","0.1079","","","","1.041","1.175","1.175","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003664","26.6","0.01","12.219","0.002","7.822","0.002","90","","90","","90","","2542.3","1.2","293","2","293","2","","","","","","","chemical synthesis (see Comment)","6","P b c a","-P 2ac 2ab","61","","4-[2-(methylamino)ethyl]-1,2-benzenediol 1-(dihydrogenphospate) hydrochloride","","- C9 H15 Cl N O5 P -","- C9 H15 Cl N O5 P -","- C72 H120 Cl8 N8 O40 P8 -","8","1","HA1141","Ianelli, S.; Nardelli, M.; Doggi, F.; Norcini, G.; Santangelo, F.","Hydrogen-Bonding Stabilization of <i>N</i>-Methyldopamine 4-<i>O</i>-Dihydrogenphosphate in HCl Acidic Solution: Synthesis of Z2055, a New Dopaminergic Prodrug","Acta Crystallographica Section C","1995","51","7","1338","1341","10.1107/S0108270194014721","","","1.54178","CuKα","","0.1368","0.1077","","0.2299","0.2085","","","","1.27","1.325","1.325","","","","","has coordinates","288349","2023-12-15","17:38:15",""
"2003665","10.809","0.002","9.581","0.002","10.986","0.002","90","","109.54","0.01","90","","1072.2","0.4","293","","","","","","","","","","Single crystals were obtained by slow evaporation of an aqueous ethanol solution.","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 N6 O4 -","- C8 H8 N6 O4 -","- C32 H32 N24 O16 -","4","1","HR1036","Casas, J. S.; Castiñeiras, A.; Martínez, G.; Sordo, J.; Varela, J. M.","1,1'-Dimethyl-4,5'-dinitro-2,2'-biimidazole, C~8~H~8~N~6~O~4~","Acta Crystallographica Section C","1995","51","7","1414","1416","10.1107/S0108270194014915","","","0.71073","MoKα","","","0.0515","","","0.0524","","","","","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003666","14.339","0.001","4.804","0.001","20.812","0.002","90","","101.48","0.01","90","","1404.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[1-(2`-Benzthiazolyl)-3-Carbomethoxymethyl-2-Thioxo-4-imidazolinone], C~13~H~11~N~3~O~3~S~2~","","- C13 H11 N3 O3 S2 -","- C13 H11 N3 O3 S2 -","- C52 H44 N12 O12 S8 -","4","1","HR1040","Kozísek, J.; Ulický, L.; Floch, L.; Langer, V.","1-(2-Benzothiazolyl)-3-methoxycarbonylmethyl-2-thioxo-4-imidazolidinone, C~13~H~11~N~3~O~3~S~2~","Acta Crystallographica Section C","1995","51","7","1429","1431","10.1107/S0108270195000254","","","0.71069","MoKα","","0.1772","0.0417","","0.1249","0.0905","","","","1.004","1.075","1.075","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003667","21.395","0.003","13.517","0.001","14.905","0.002","90","","107.75","0.01","90","","4105.3","0.9","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H28 N4 O5 -","- C19 H28 N4 O5 -","- C152 H224 N32 O40 -","8","1","HR1051","Hundal, G.; Hundal, M. S.; Kumar, S.; Singh, H.; Sanz-Aparicio, J.","2,3-Benzo-11-(2-cyanoethyl)-1,4-dioxa-7,11,15-triazacycloheptadec-2-ene-6,16-dione‒Water (1/1)","Acta Crystallographica Section C","1995","51","7","1459","1462","10.1107/S0108270195000424","","","1.5418","CuKα","","","0.049","","","0.058","","","","","0.54","0.54","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003668","8.537","0.004","13.936","0.002","12.839","0.003","90","","92.92","0.03","90","","1525.5","0.8","140","2","140","2","","","","","","","Aldrich","4","P 1 21/a 1","-P 2yab","14","chloroxylenol","4-chloro-3,5-dimethylphenol","","- C8 H9 Cl O -","- C8 H9 Cl O -","- C64 H72 Cl8 O8 -","8","2","HU1115","Cox, P. J.","Chloroxylenol, C~8~H~9~ClO","Acta Crystallographica Section C","1995","51","7","1361","1364","10.1107/S0108270194012588","","","0.71069","MoKα","","0.0483","0.0407","","0.1001","0.0979","","","","0.99","1.066","1.066","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003669","5.59","0.002","25.299","0.004","7.31","0.002","90","","90.9","0.02","90","","1033.7","0.5","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Z)-N-4-Fluorophenyl-C-phenylnitrone","","- C13 H10 F N O -","- C13 H10 F N O -","- C52 H40 F4 N4 O4 -","4","1","HU1138","Banks, R. E.; DuBoisson, R. A.; Pritchard, R. G.; Tipping, A. E.","(<i>Z</i>)-<i>N</i>-4-Fluorophenyl-<i>C</i>-phenylnitrone. Confirmation that the Exclusive Product of the Reaction Between Benzaldehyde and 4-Fluorophenylhydroxylamine is the <i>Z</i> Isomer","Acta Crystallographica Section C","1995","51","7","1470","1472","10.1107/S0108270194014745","","","0.71069","MoKα","","","0.0561","","","0.0695","","","","","1.478","1.478","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003670","5.556","0.002","15.332","0.004","10.427","0.004","90","","90.47","0.02","90","","888","1","296","","","","","","","","","","synthesized at UMIST","5","P 1 21 1","","","","","","- C21 H17 F N2 O3 -","- C21 H17 F N2 O3 -","- C42 H34 F2 N4 O6 -","2","1","","Banks, R. E.; DuBoisson, R. A.; Pritchard, R. G.; Tipping, A. E.","(Z)-2-(4-Fluorophenyl)-3-(3-nitrophenyl)-5-phenylisoxazolidine: the Major Isomer Formed by 1,3-Dipolar Addition of an Arylnitrone to Styrene","Acta Crystallographica Section C","1995","51","7","1434","1435","10.1107/S0108270194014757","","","0.71069","MoKα","","","0.0617","","","0.0701","","","","","1.649","1.649","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2003671","5.842","0.001","10.309","0.001","11.062","0.001","66.53","0.01","76.15","0.01","73.03","0.01","578.7","0.13","296","","296","","","","","","","","","5","P -1","-P 1","2","","N-(4-fluorophenyl)-2,3,4,5-tetrafluoro-6-hydroxybenzamide","","- C13 H6 F5 N O2 -","- C13 H6 F5 N O2 -","- C26 H12 F10 N2 O4 -","2","1","HU1141","Banks, R. E.; DuBoisson, R. A.; Pritchard, R. G.; Tipping, A. E.","2,3,4,5-Tetrafluoro-<i>N</i>-(4-fluorophenyl)-6-hydroxybenzamide: an Example of a Combined Inter- and Intramolecular O···H···O Bifurcated Hydrogen Bond","Acta Crystallographica Section C","1995","51","7","1427","1429","10.1107/S0108270194014769","","","0.71069","MoKα","","","0.0528","","","0.053","","","","","1.39","1.39","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003672","6.361","0.001","6.878","0.001","7.801","0.001","90","","108.47","0.01","90","","323.72","0.08","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","2,3-Dideoxy-D-erythro-hex-2-enono-1,5-lactone","","- C6 H8 O4 -","- C6 H8 O4 -","- C12 H16 O8 -","2","1","HU1146","Fun, H.-K.; Sivakumar, K.; Ang, H.-B.; Sam, T.-W.; Gan, E.-K.","2,3-Dideoxy-<small>D</small>-<i>erythro</i>-hex-2-enono-1,5-lactone and 1,4-Lactone Obtained from Tri-<i>O</i>-acetyl-<small>D</small>-glucal","Acta Crystallographica Section C","1995","51","7","1330","1333","10.1107/S0108270194014782","","","0.71073","MoKα","","0.0315","0.031","","0.0885","0.0879","","","","1.071","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003673","4.558","0.001","4.747","0.001","8.15","0.002","76.92","0.02","75.61","0.02","82.17","0.02","165.78","0.07","293","2","293","2","","","","","","","","3","P 1","P 1","1","","2,3-Dideoxy-D-erythro-hex-2-enono-1,4-lactone","","- C6 H8 O4 -","- C6 H8 O4 -","- C6 H8 O4 -","1","1","HU1146","Fun, H.-K.; Sivakumar, K.; Ang, H.-B.; Sam, T.-W.; Gan, E.-K.","2,3-Dideoxy-<small>D</small>-<i>erythro</i>-hex-2-enono-1,5-lactone and 1,4-Lactone Obtained from Tri-<i>O</i>-acetyl-<small>D</small>-glucal","Acta Crystallographica Section C","1995","51","7","1330","1333","10.1107/S0108270194014782","","","0.71073","MoKα","","0.0463","0.0372","","0.0944","0.0916","","","","0.946","1.046","1.046","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003674","10.216","0.006","13.236","0.006","15.534","0.007","93.89","0.03","99.92","0.03","102.28","0.03","2009.8","1.8","223","","","","","","","","","","","7","P -1","-P 1","2","","","","- C45 H38 N3 O P2 Re S2 -","- C45 H38 N3 O P2 Re S2 -","- C90 H76 N6 O2 P4 Re2 S4 -","2","1","JZ1024","Hübener, R.; Abram, U.; Strähle, J.","Isothiocyanato Complexes of Rhenium. V. <i>trans</i>-Bis(isothiocyanato)(methoxy)(phenylimido)bis(triphenylphosphine)rhenium(V)","Acta Crystallographica Section C","1995","51","7","1284","1286","10.1107/S0108270195000564","","","0.71073","MoKα","","","0.032","","","0.036","","","","","1.305","1.305","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003675","9.841","0.002","9.841","","9.841","","81.33","0.02","81.33","","81.33","","923.37","0.19","295","","295","","","","","","","","Umsetzung von Urotropiniumiodid UrHI mit iodges\""attigter Acetonitrill\""osung","4","R 3 c :R","P 3* -2n","161","Urotropin-3-Diiod","1,3,5,7-Tetraazatricyclo[3.3.1.1^3,7^]decan-3-Diiod","","- C6 H12 I6 N4 -","- C6 H12 I6 N4 -","- C12 H24 I12 N8 -","2","0.333333","JZ1025","Tebbe, K.-F.; Nagel, K.","Urotropin-3-Diiod, Ur.3I~2~","Acta Crystallographica Section C","1995","51","7","1388","1390","10.1107/S0108270194015003","","","0.71069","MoKα","","0.0295","0.0262","","0.0705","0.069","","","","1.059","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003676","7.735","0.001","8.066","0.001","14.319","0.002","103.94","0.02","98.2","0.02","107.83","0.02","802.5","0.2","300","","","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H15 N3 O2 -","- C21 H15 N3 O2 -","- C42 H30 N6 O4 -","2","1","JZ1027","Krieger, C.; Peraus, G.; Neugebauer, F. A.","Pair Stacking of 10-(4-Nitrophenyl)-5(10<i>H</i>)-phenazinyl Radicals","Acta Crystallographica Section C","1995","51","7","1420","1423","10.1107/S0108270195000941","","","0.71073","MoKα","","","0.033","","","0.035","","","","","1.14","1.14","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003677","15.685","0.007","25.364","0.009","7.579","0.004","90","","90","","90","","3015","2","143","","","","","","","","","","Ethanol","3","P c c n","-P 2ab 2ac","","","","","- C18 H22 O2 -","- C18 H22 O2 -","- C144 H176 O16 -","8","1","KA1025","Yufit, D. S.; Struchkov, Yu. T.; Kozhushkov, S. I.; De Meijere, A.","Ethyl Pentaspiro[2.0.2.0.0.2.0.2.0.1]tetradeca-14-ylideneacetate, C~18~H~22~O~2~","Acta Crystallographica Section C","1995","51","7","1325","1327","10.1107/S0108270194013971","","","0.71073","MoKα","","","0.063","","","0.06","","","","","1.52","1.52","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003678","8.919","0.004","14.128","0.003","14.079","0.006","90","","104.58","0.05","90","","1716.9","1.2","243","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H34 F12 N6 O12 S4 -","- C16 H32 F12 N6 O12 S4 -","- C32 H64 F24 N12 O24 S8 -","2","0.5","KA1089","Thuéry, P.; Keller, N.; Lance, M.; Vigner, J.-D.; Nierlich, M.","(H~4~-Hexaaza-18-crown-6)^4+^.4CF~3~SO~3~^{-^} and its Hydrated Form","Acta Crystallographica Section C","1995","51","7","1407","1411","10.1107/S0108270194014241","","","0.71073","MoKα","","","0.058","","","0.06","","","","","2.09","2.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003679","8.984","0.005","31.147","0.012","13.357","0.003","90","","106.98","0.06","90","","3575","3","295","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H36 F12 N6 O13 S4 -","- C16 H32 F12 N6 O13 S4 -","- C64 H128 F48 N24 O52 S16 -","4","1","KA1089","Thuéry, P.; Keller, N.; Lance, M.; Vigner, J.-D.; Nierlich, M.","(H~4~-Hexaaza-18-crown-6)^4+^.4CF~3~SO~3~^{-^} and its Hydrated Form","Acta Crystallographica Section C","1995","51","7","1407","1411","10.1107/S0108270194014241","","","0.71073","MoKα","","","0.074","","","0.077","","","","","4.48","4.48","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003680","5.976","0.001","13.146","0.001","25.883","0.003","90","","93.84","0.01","90","","2028.8","0.4","213","1","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H30 O2 S -","- C24 H30 O2 S -","- C96 H120 O8 S4 -","4","1","KA1094","Kraus, G. A.; Su, Q.; Young, Jnr, V. G.","Construction of the Tetracyclic Skeleton of Leucothol A. 1,2,4a,5,6,7,8,9,10,10a,11,11a-Dodecahydro-11-hydroxy-11-methyl-7-phenylthiomethyl-5a<i>H</i>-5a,8-methanocyclohepta[<i>b</i>]naphthalen-10-one","Acta Crystallographica Section C","1995","51","7","1366","1368","10.1107/S0108270194014071","","","1.54178","CuKα","","0.046","0.0399","","0.1","0.0957","","","","1.044","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003681","19.158","0.003","19.029","0.003","6.377","0.002","90","","90","","90","","2324.8","0.9","296","","298","","","","","","","","crystallized from ethanol-water","3","P 21 21 21","P 2ac 2ab","19","","","","- C29 H32 O3 -","- C29 H32 O3 -","- C116 H128 O12 -","4","1","KA1098","Böcskei, Z.; Simon, K.; Ambrus, G.; Ilköy, E.","On the Isostructural Molecular Compound Formation of a Steroid with α- and β- Naphthols","Acta Crystallographica Section C","1995","51","7","1319","1322","10.1107/S0108270194013442","","","1.5418","CuKα","","","0.088","","","0.062","","","","","1.32","1.32","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003682","19.058","0.002","19.209","0.002","6.275","0.001","90","","90","","90","","2297.2","0.5","298","","298","","","","","","","","crystallized from ethanol-water","3","P 21 21 21","P 2ac 2ab","19","","","","- C29 H32 O3 -","- C29 H32 O3 -","- C116 H128 O12 -","4","1","KA1098","Böcskei, Z.; Simon, K.; Ambrus, G.; Ilköy, E.","On the Isostructural Molecular Compound Formation of a Steroid with α- and β- Naphthols","Acta Crystallographica Section C","1995","51","7","1319","1322","10.1107/S0108270194013442","","","1.5418","CuKα","","0.0831","0.0513","","0.052","0.0456","","","","","4.581","4.581","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003683","7.937","0.004","11.249","0.006","15.144","0.006","99.59","0.04","98","0.04","110.59","0.04","1219.1","1.1","295","2","295","2","","","","","","","synthesis","6","P -1","-P 1","2","","","","- C28 H16 Cu N8 O S -","- C28 H16 Cu N8 O S -","- C56 H32 Cu2 N16 O2 S2 -","2","1","KA1099","Potočňák, I.; Dunaj-Jurčo, M.; Mikloš, D.; Kabešová, M.; Jäger, L.","Isothiocyanatobis(1,10-phenanthroline)copper(II) Dicyanonitrosomethanide","Acta Crystallographica Section C","1995","51","7","1291","1293","10.1107/S0108270195001946","","","0.71073","MoKα","","0.1041","0.0506","","0.1318","0.1112","","","","1.024","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003684","8.082","0.002","3.954","0.001","16.103","0.003","90","","98.54","0.03","90","","508.9","0.2","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H9 N O2 -","- C14 H12 N2 O2 -","- C28 H24 N4 O4 -","2","0.5","KA1101","Janczak, J.","2-Aminoanthraquinone","Acta Crystallographica Section C","1995","51","7","1381","1382","10.1107/S0108270194014885","","","1.54184","CuKα","","","0.0616","","","0.0563","","","","","0.55","0.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003685","14.662","0.003","5.419","0.001","21.475","0.004","90","","101.66","0.03","90","","1671.1","0.6","289","2","289","2","","","","","","","grown from ethanol","4","P 1 21 1","P 2yb","4","","6-(3,5-Di-O-acetyl-β-D-2-deoxyribofuranosyl)-3,4-dihydro-8-H-pyrimido[4,5-c][1,2]oxazin-7-one","","- C15 H19 N3 O7 -","- C15 H19 N3 O7 -","- C60 H76 N12 O28 -","4","2","","Van Meervelt, Luc; Kong Thoo Lin, Paul; Brown, Daniel M.","6-(3,5-Di-O-acetyl-β-D-2-deoxyribofuranosyl)-3,4-dihydro-8-H-pyrimido[4,5-c][1,2]oxazin-7-one","Acta Crystallographica Section C","1995","51","7","1347","1350","10.1107/S0108270195000096","","","1.54184","CuKα","","0.1235","0.0692","","0.1726","0.1468","","","","1.073","1.313","1.313","","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"2003686","17.589","0.003","10.164","0.001","16.807","0.004","90","","84.16","0.01","90","","2989.1","0.9","213","2","213","2","","","","","","","[ReNCl~2~(Me~2~PhP)~3~] + HOSO~2~CF~3~","9","P 1 21/c 1","-P 2ybc","14","","chlorotris(dimethylphenylphosphine)nitrido(trifluoromethanesulfonato)rhenium(V)","","- C25 H33 Cl F3 N O3 P3 Re S -","- C25 H33 Cl F3 N O3 P3 Re S -","- C100 H132 Cl4 F12 N4 O12 P12 Re4 S4 -","4","1","KA1103","Abram, U.; Walker, I.","<i>mer</i>,<i>cis</i>-Chlorotris(dimethylphenylphosphine)nitrido(trifluoromethylsulfonato)rhenium(V)","Acta Crystallographica Section C","1995","51","7","1250","1251","10.1107/S0108270195000692","","","0.7093","MoKα","","0.0829","0.0513","","0.1469","0.1201","","","","1.097","1.046","1.046","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003687","12.584","0.003","3.894","0.001","6.955","0.001","90","","90","","90","","340.81","0.13","295","","","","","","","","","","see text","3","P m n 21","P 2ac -2","31","","","","- C8 H4 N2 -","- C8 H4 N2 -","- C16 H8 N4 -","2","0.5","KA1110","Janczak, J.; Kubiak, R.","1,2-Dicyanobenzene. A Precursor of Phthalocyanines","Acta Crystallographica Section C","1995","51","7","1399","1401","10.1107/S0108270195001387","","","0.71073","MoKα","","","0.0501","","","0.0614","","","","","0.61","0.61","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003688","14.788","0.004","7.47","0.002","24.188","0.004","90","","90","","90","","2672","1.1","293","2","293","2","","","","","","","recrystallized from benzene at room temperature","3","P b c a","-P 2ac 2ab","61","α-naphthoflavone","","","- C19 H12 O2 -","- C19 H12 O2 -","- C152 H96 O16 -","8","1","KA1111","Panneerselvam, K.; Soriano-García, M.","α-Naphthoflavone","Acta Crystallographica Section C","1995","51","7","1418","1420","10.1107/S0108270195000680","","","1.54178","CuKα","","0.05","0.0399","","0.1034","0.096","","","","1.112","1.142","1.142","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003689","15.347","0.007","17.493","0.005","15.0003","0.0008","102.8","0.03","116.77","0.03","79.94","0.03","3493","2","296","","","","","","","","","","","7","P -1","-P 1","2","","","","- C148 H130 Cl4 Co6 O P8 S8 -","- C148 H114 Cl6 Co6 O2 P10 S8 -","- C148 H114 Cl6 Co6 O2 P10 S8 -","1","0.5","KH1003","Jiang, F.; Huang, X.; Cao, R.; Hong, M.; Liu, H.","A Hexacobalt Sulfide Cluster Compound, [Co~6~(μ-S)~8~(PPh~3~)~6~].2PPh~3~.2C~2~H~4~Cl~2~.H~2~O","Acta Crystallographica Section C","1995","51","7","1275","1278","10.1107/S0108270194014873","","","0.71073","MoKα","","","0.058","","","0.069","","","","","1.4","1.4","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003690","14.611","0.002","5.423","0.006","12.191","0.002","90","","96.89","0.01","90","","959","1.1","297","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C11 H9 N O -","- C11 H9 N O -","- C44 H36 N4 O4 -","4","1","KH1007","Suh, M. C.; Kim, S. N.; Lee, H. J.; Shim, S. C.; Suh, I.-H.; Lee, J.-H.; Park, J.-R.","6-(2-Pyridyl)-3,5-hexadiyn-1-ol","Acta Crystallographica Section C","1995","51","7","1416","1418","10.1107/S0108270195001089","","","0.71073","MoKα","","","0.0664","","","0.0633","","","","","2.713","2.713","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003691","6.4574","0.0012","11.1198","0.0024","6.2652","0.0011","90","","114.382","0.014","90","","409.75","0.14","291","2","","","","","","","","","Furneaux, Mason & Miller (1984), compound (9)","3","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 O4 -","- C10 H8 O4 -","- C20 H16 O8 -","2","0.5","KH1010","Gainsford, G. J.; Furneaux, R. H.; Mason, J. M.; Miller, I. J.","Adducts from the Pyrolysis of Cellulose: (1α,2β,6β,7α)-3,8-Dioxatricyclo[5.3.1.1^2,6^]dodeca-4,9-diene-11,12-dione and (1<i>R</i>)-(1α,2β,3α,6α,8β,9α)-5,13,14-Trioxatetracyclo[7.3.1.1^3,6^.0^2,8^]tetradec-10-ene-7,12-dione","Acta Crystallographica Section C","1995","51","7","1369","1372","10.1107/S0108270195000242","","","0.71073","MoKα","","","0.041","","","0.1","","","","","1.038","1.038","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003692","5.154","0.002","12.257","0.008","16.034","0.008","90","","90","","90","","1012.9","0.9","291","2","","","","","","","","","Furneaux, Mason & Miller (1984), compound (17)","3","P 21 21 21","P 2ac 2ab","19","","","","- C11 H10 O5 -","- C11 H10 O5 -","- C44 H40 O20 -","4","1","KH1010","Gainsford, G. J.; Furneaux, R. H.; Mason, J. M.; Miller, I. J.","Adducts from the Pyrolysis of Cellulose: (1α,2β,6β,7α)-3,8-Dioxatricyclo[5.3.1.1^2,6^]dodeca-4,9-diene-11,12-dione and (1<i>R</i>)-(1α,2β,3α,6α,8β,9α)-5,13,14-Trioxatetracyclo[7.3.1.1^3,6^.0^2,8^]tetradec-10-ene-7,12-dione","Acta Crystallographica Section C","1995","51","7","1369","1372","10.1107/S0108270195000242","","","0.71069","MoKα","","","0.0461","","","0.0621","","","","","1.17","1.17","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003693","11.8054","0.001","5.0922","0.001","20.0693","0.0013","90","","90","","90","","1206.5","0.3","293","1","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H9 N O2 Se -","- C14 H9 N O2 Se -","- C56 H36 N4 O8 Se4 -","4","1","KH1013","Fong, M. C.; Gable, R. W.; Schiesser, C. H.","3-Phenyl-1,3(4<i>H</i>)-benzoselenazine-2,4(3<i>H</i>)-dione","Acta Crystallographica Section C","1995","51","7","1333","1335","10.1107/S0108270194014563","","","1.5418","CuKα","","","0.0333","","","0.0894","","","","","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003694","8.651","0.002","11.534","0.003","8.878","0.003","90","","93.6","0.02","90","","884.1","0.4","291","1","291","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2'-Oxybispyridine","","- C10 H8 N2 O -","- C10 H8 N2 O -","- C40 H32 N8 O4 -","4","1","KH1016","Dunne, S. J.; von Nagy-Felsobuki, E. I.; Mackay, M. F.","2,2'-Oxybispyridine and 2,2'-Selenobispyridine","Acta Crystallographica Section C","1995","51","7","1454","1457","10.1107/S010827019500014X","","","1.5418","CopperKα","","","0.057","","","0.075","","","","","1.52","1.52","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003695","12.37","0.001","5.977","0.001","13.909","0.001","90","","113.1","0.01","90","","945.9","0.2","291","1","291","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2,2'-Selenobispyridine","","- C10 H8 N2 Se -","- C10 H8 N2 Se -","- C40 H32 N8 Se4 -","4","1","KH1016","Dunne, S. J.; von Nagy-Felsobuki, E. I.; Mackay, M. F.","2,2'-Oxybispyridine and 2,2'-Selenobispyridine","Acta Crystallographica Section C","1995","51","7","1454","1457","10.1107/S010827019500014X","","","1.5418","CopperKα","","","0.041","","","0.056","","","","","3.71","3.71","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003696","8.531","0.002","9.406","0.001","9.759","0.002","75.92","0.01","78.44","0.02","68.71","0.01","702.3","0.2","293","","299","","","","","","","","","4","P -1","-P 1","2","","1,3,4,10b-tetrahydro-4-phenylpyrido[2,1-a]isoindole-2,6-dione","","- C18 H15 N O2 -","- C18 H15 N O2 -","- C36 H30 N2 O4 -","2","1","KH1018","Beckwith, A. L. J.; Joseph, S. P.; Mayadunne, R. T. A.; Willis, A. C.","1,3,4,10b-Tetrahydro-4-phenylpyrido[2,1-<i>a</i>]isoindole-2,6-dione","Acta Crystallographica Section C","1995","51","7","1438","1440","10.1107/S0108270195001132","","","1.5418","CuKα","","0.056","0.047","","0.072","0.069","","","","1.674","1.789","1.789","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003697","6.926","0.001","15.054","0.003","14.471","0.002","90","","99.94","0.01","90","","1486.2","0.4","293","2","293","2","","","","","","","chemical synthesis","4","P 1 21/c 1","-P 2ybc","14","","N-3-methoxyphenyl-2-(5-methoxyindole)carboxamide","","- C17 H16 N2 O3 -","- C17 H16 N2 O3 -","- C68 H64 N8 O12 -","4","1","LI1132","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Caubère, C.; Caubère, P.","Conformation at the Amide N Atom of 1-Carboxamide Indole Derivatives","Acta Crystallographica Section C","1995","51","7","1341","1345","10.1107/S0108270195000837","","","1.54056","CuKα~1~","","0.0651","0.0375","","0.1096","0.0923","","","","0.921","0.968","0.968","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003698","11.311","0.008","10.22","0.007","6.586","0.001","79.59","0.02","79.2","0.04","78.86","0.03","725.5","0.7","293","2","293","2","","","","","","","chemical synthesis","4","P -1","-P 1","2","","N-methyl-N-phenyl-2-(5-methoxyindole)carboxamide","","- C17 H16 N2 O2 -","- C17 H16 N2 O2 -","- C34 H32 N4 O4 -","2","1","LI1132","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Caubère, C.; Caubère, P.","Conformation at the Amide N Atom of 1-Carboxamide Indole Derivatives","Acta Crystallographica Section C","1995","51","7","1341","1345","10.1107/S0108270195000837","","","0.71069","MoKα","","0.0964","0.0374","","0.0672","0.0594","","","","0.767","0.994","0.994","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003699","7.611","0.002","11.808","0.002","12.609","0.002","103.86","0.01","103.12","0.01","103.48","0.01","1020.7","0.4","294","1","","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H18 Cl Mn N2 O10 -","- C17 H18 Cl Mn N2 O10 -","- C34 H36 Cl2 Mn2 N4 O20 -","2","1","MU1128","Tan, X.-S.; Chen, J.; Zheng, P.-J.; Tang, W.-X.","<i>trans</i>-Diaqua(bipyridyl)(salicylato)manganese(III) Perchlorate Monohydrate","Acta Crystallographica Section C","1995","51","7","1268","1269","10.1107/S0108270195000539","","","0.71073","MoKα","","","0.044","","","0.048","","","","","1.094","1.094","","","","","has coordinates","199741","2020-10-21","18:00:00",""
"2003700","10.235","0.005","10.249","0.008","11.81","0.003","86.88","0.04","80.46","0.03","66.59","0.06","1121.1","1.2","218","","","","","","","","","","evaporation from water","5","P -1","-P 1","2","","","","- C15 H37 Ge Na O8 -","- C15 H37 Ge Na O8 -","- C30 H74 Ge2 Na2 O16 -","2","1","MU1145","Chiang, H.-C.; Hwang, S.-F.; Ueng, C.-H.","Sodium Bis(2,3-dimethylbutane-2,3-diolato)hydroxogermanate(IV)‒Methanol (1/3)","Acta Crystallographica Section C","1995","51","7","1258","1260","10.1107/S0108270194013934","","","0.71073","MoKα","","","0.032","","","0.039","","","","","2.59","2.59","","","","","has coordinates","190596","2020-10-21","18:00:00",""
"2003701","11.119","0.006","16.062","0.003","12.027","0.004","90","","100.72","0.03","90","","2110.5","1.4","296","","","","","","","","","","Crystals were obtained by slow evaporation at room temperature of solutions in 50% ethanol","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 Al N6 O6 -","- C18 H15 Al N6 O6 -","- C72 H60 Al4 N24 O24 -","4","1","MU1149","Okabe, N.; Tamaki, K.; Suga, T.; Kohyama, Y.","Aluminium Cupferronate, [Al(C~6~H~5~N~2~O~2~)~3~]","Acta Crystallographica Section C","1995","51","7","1295","1297","10.1107/S0108270195000102","","","0.71069","MoKα","","","0.076","","","0.067","","","","","1.65","1.65","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003702","14.985","0.006","17.375","0.006","16.437","0.006","90","","92.23","0.04","90","","4276","3","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H48 In K N6 O5 S4 -","- C34 H48 In K N6 O5 S4 -","- C136 H192 In4 K4 N24 O20 S16 -","4","1","MU1159","Carmalt, C. J.; Clegg, W.; Elsegood, M. R. J.; Kneisel, B. O.; Norman, N. C.","Two Anionic Indium(III)‒Thiocyanate Complexes with Potassium-Centred Complex Cations","Acta Crystallographica Section C","1995","51","7","1254","1258","10.1107/S0108270195000527","","","0.71073","MoKα","","0.0692","0.0472","","0.1313","0.1089","","","","1.067","1.048","1.048","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003703","8.941","0.002","9.682","0.002","13.113","0.003","87.25","0.03","72.33","0.02","89.05","0.02","1080.3","0.4","160","2","160","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H44 In K N8 O6 S4 -","- C36 H44 In K N8 O6 S4 -","- C36 H44 In K N8 O6 S4 -","1","0.5","MU1159","Carmalt, C. J.; Clegg, W.; Elsegood, M. R. J.; Kneisel, B. O.; Norman, N. C.","Two Anionic Indium(III)‒Thiocyanate Complexes with Potassium-Centred Complex Cations","Acta Crystallographica Section C","1995","51","7","1254","1258","10.1107/S0108270195000527","","","0.71073","MoKα","","0.0285","0.0207","","0.0674","0.0508","","","","1.06","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003704","11.069","0.002","14.426","0.003","16.561","0.004","81.64","0.02","105.19","0.02","94.05","0.02","2523.5","1","293","2","","","","","","","","","see text","5","P -1","-P 1","2","","","","- C59 H51 O4 P4 Rh -","- C59 H51 O4 P4 Rh -","- C118 H102 O8 P8 Rh2 -","2","1","MU1160","Smit, D. M. C.; Basson, S. S.; Roodt, A.; Steynberg, E. C.","Carbonyl-κ<i>C</i>-[tris(diphenylphosphinoyl)methanido-κ^2^<i>O</i>,<i>O</i>'][tris(<i>o</i>-tolyl)phosphine-κ<i>P</i>]rhodium(I), [Rh(C{P(O)Ph~2~}~3~)(CO){P(<i>o</i>-Tol)~3~}]","Acta Crystallographica Section C","1995","51","7","1278","1280","10.1107/S0108270195000515","","","1.5418","CuKα","","0.0359","0.0359","","0.0973","0.0973","","","","1.044","1.044","1.044","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003705","9.083","0.006","31.918","0.002","8.594","0.003","90","","93.1","0.2","90","","2487.9","1.9","293","","","","","","","","","","crystallization from the original solution","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H48 Cu9 N24 Se6 -","- C24 H48 Cu9 N24 Se6 -","- C48 H96 Cu18 N48 Se12 -","2","0.5","NA1103","Vrábel, V.; Kellö, E.; Garaj, J.; Lokaj, J.","Tris[bis(ethylenediamine)copper(II)] Poly[hexakis(μ-cyano)hexakis(μ-selenocyanato)hexacopper(I)], [Cu^II^en~2~]~3~[Cu^I^~6~(CN)~6~(SeCN)~6~]","Acta Crystallographica Section C","1995","51","7","1286","1288","10.1107/S0108270194014976","","","1.54178","CuKα","","","0.03","","","0.034","","","","","0.94","0.94","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003706","5.333","0.0004","5.633","0.0006","21.203","0.003","90","","90","","90","","636.95","0.12","293","","293","","","","","","","","Norwich Eaton Pharmaceuticals, Inc. (Norwich, New York)","4","P 21 21 21","P 2ac 2ab","19","","5-nitro-2-aldoxime","","- C5 H4 N2 O4 -","- C5 H4 N2 O4 -","- C20 H16 N8 O16 -","4","1","NA1116","Olszak, T. A.; Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","5-Nitrofuran-2-aldoxime","Acta Crystallographica Section C","1995","51","7","1304","1306","10.1107/S0108270194008425","","","0.71069","MoKα","","0.0371","0.0255","","0.0719","0.0685","","","","1.035","1.101","1.101","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003707","6.504","0.002","13.121","0.002","22.192","0.002","90","","92.37","0.02","90","","1892.2","0.7","295","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2,4-dichlorophenyl)-5-(4-chlorophenyl)-3-etoxycarbonyl- 2-methyl-pyrrole","","- C20 H16 Cl3 N O2 -","- C20 H16 Cl3 N O2 -","- C80 H64 Cl12 N4 O8 -","4","1","NA1117","Bachechi, F.; Gavuzzo, E.; Cerreto, F.; Scalzo, M.","A 1,5-Diarylpyrrole Derivative","Acta Crystallographica Section C","1995","51","7","1431","1434","10.1107/S0108270195000734","","","1.54178","CuKα","","","0.048","","","0.064","","","","","2.36","2.36","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2003708","8.653","0.001","11.418","0.005","18.018","0.002","90","","90","","90","","1780.2","0.8","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(3aRS,9aSR,9bSR)-Octahydro-1H-furo[3',4':4,5]isoxazolo[2,3-a] pyridin-1-one.","","- C9 H13 N O3 -","- C9 H13 N O3 -","- C72 H104 N8 O24 -","8","1","NA1129","Alvarez-Larena, A.; Piniella, J. F.; Cid, P.; de March, P.; Figueredo, M.; Font, J.; Milán, S.; Soria, A.","Three Lactone Fused Perhydroisoxazolo[2,3-<i>a</i>]pyridines: a Conformational Study","Acta Crystallographica Section C","1995","51","7","1314","1319","10.1107/S0108270194013661","","","0.70926","MoKα","","0.0702","0.0378","","0.1182","0.0968","","","","1.075","1.073","1.073","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003709","6.765","0.003","8.93","0.002","16.166","0.005","90","","90","","90","","976.6","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4aRS,10aRS,10bRS)-Octahydro-1H,3H-pyrano[3',4':4,5]isoxazolo[2,3-a]pyridin- 1-one.","","- C10 H15 N O3 -","- C10 H15 N O3 -","- C40 H60 N4 O12 -","4","1","NA1129","Alvarez-Larena, A.; Piniella, J. F.; Cid, P.; de March, P.; Figueredo, M.; Font, J.; Milán, S.; Soria, A.","Three Lactone Fused Perhydroisoxazolo[2,3-<i>a</i>]pyridines: a Conformational Study","Acta Crystallographica Section C","1995","51","7","1314","1319","10.1107/S0108270194013661","","","0.70926","MoKα","","0.0373","0.0281","","0.0779","0.0719","","","","1.088","1.089","1.089","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003710","6.0456","0.0007","16.735","0.003","10.786","0.002","90","","98.84","0.01","90","","1078.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(5aRS,11aRS,11bRS)-Decahydro-1H-oxepino[3',4':4,5]isoxazolo[2,3-a]pyridin-1-one","","- C11 H17 N O3 -","- C11 H17 N O3 -","- C44 H68 N4 O12 -","4","1","NA1129","Alvarez-Larena, A.; Piniella, J. F.; Cid, P.; de March, P.; Figueredo, M.; Font, J.; Milán, S.; Soria, A.","Three Lactone Fused Perhydroisoxazolo[2,3-<i>a</i>]pyridines: a Conformational Study","Acta Crystallographica Section C","1995","51","7","1314","1319","10.1107/S0108270194013661","","","0.70926","MoKα","","0.0538","0.0367","","0.1005","0.0879","","","","1.089","1.092","1.092","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003711","6.755","0.005","7.068","0.007","40.62","0.05","90","","90","","90","","1939","3","288","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H30 O5 S -","- C19 H30 O5 S -","- C76 H120 O20 S4 -","4","1","NA1130","Adams, H.; Bailey, N. A.; Jones, D. N.; Aversa, M. C.; Bonaccorsi, P.; Giannetto, P.","An Enantiopure Isobornylsulfinylcyclohexene Derivative, C~19~H~30~O~5~S","Acta Crystallographica Section C","1995","51","7","1357","1359","10.1107/S0108270195000746","","","0.71073","MoKα","","","0.0766","","","0.0773","","","","","1.71","1.71","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003712","3.851","0.001","15.077","0.002","9.99","0.002","90","","95.2","0.1","90","","577.6","0.2","295","2","","","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H6 Br2 Cl2 Cu N4 -","- C6 H6 Br2 Cl2 Cu N4 -","- C12 H12 Br4 Cl4 Cu2 N8 -","2","0.5","NA1136","Valle, G.; Ettorre, R.; Peruzzo, V.","Bis(4-bromopyrazole)dichlorocopper(II)","Acta Crystallographica Section C","1995","51","7","1293","1295","10.1107/S0108270195000163","","","0.71073","MoKα","","","0.048","","","0.048","","","","","0.71","0.71","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003713","9.973","0.001","17.101","0.002","25.496","0.003","90","","90","","90","","4348.3","0.8","293","","293","","","","","","","","Janssen Research Foundation, Beerse, Belgium","5","P c a b","-P 2bc 2ac","61","","4-(9,10-Dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thien-4-ylidene)- 1-methylpiperidinium hydrogen malate","","- C23 H27 N O5 S -","- C27 H32 N O10 S -","- C216 H256 N8 O80 S8 -","8","1","NA1139","Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","4-(9,10-Dihydro-4<i>H</i>-benzo[4,5]cyclohepta[1,2-<i>b</i>]thien-4-ylidene)-1-methylpiperidinium Hydrogen Malate","Acta Crystallographica Section C","1995","51","7","1435","1438","10.1107/S0108270194015088","","","1.54184","CuKα","","0.1952","0.0561","","0.1411","0.0909","","","","1.136","1.415","1.415","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003714","30.328","0.003","15.279","0.002","12.499","0.004","90","","90","","90","","5792","2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","6-butyl-2-methyl-3-[[3-(methoxycarbonyl)thien-2-yl]methyl]- -5-[[2'-(1H-tetrazol-5-yl)]][1,1'-biphenyl)-4-yl]methyl]pyrimidin-4(3H)-one","","- C30 H30 N6 O3 S -","- C30 H30 N6 O3 S -","- C240 H240 N48 O24 S8 -","8","1","NA1145","Destro, R.; Soave, R.","A New Non-Peptide Angiotensin II Receptor Antagonist","Acta Crystallographica Section C","1995","51","7","1383","1385","10.1107/S0108270195000722","","","0.71073","MoKα","","0.2153","0.0777","","0.153","0.1281","","","","0.903","1.279","1.279","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003715","12.044","0.007","12.461","0.007","13.73","0.008","104.33","0.03","94.47","0.03","101","0.03","1943","2","293","","293","","","","","","","","synth\`ese","5","P -1","-P 1","2","","1,7-diéthoxycarbonyl-3a-méthyl-4a-phényl- 3,5-diparanitrophényl-3a,4,4a,5-tétrahydro-3H-bis[1,2,4] triazolo[4,3-a:3',4'-d][1,5]benzodiazépine","","- C37 H33 Cl3 N8 O8 -","- C37 H33 Cl3 N8 O8 -","- C74 H66 Cl6 N16 O16 -","2","1","PA1151","Chiaroni, A.; Riche, C.; Baouid, A.; Hasnaoui, A.; Benharref, A.; Lavergne, J.-P.","1,7-Bis(éthoxycarbonyl)-3a-méthyl-4a-phényl-3,5-bis(<i>p</i>-nitrophényl)-3a,4,4a,5-tétrahydro-3<i>H</i>-bis-[1,2,4]triazolo[4,3-<i>a</i>:3',4'-<i>d</i>][1,5]benzodiazépine, C~36~H~32~N~8~O~8~.CHCl~3~","Acta Crystallographica Section C","1995","51","7","1352","1355","10.1107/S0108270194014113","","","0.7107","MoKα","","","0.088","","","0.111","","","","","1.34","1.34","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003716","9.891","0.002","6.492","0.001","14.84","0.002","90","","90","","90","","952.9","0.3","293","","","","","","","","","","produit Aldrich, recristallis\'e en refroidissant \`a 253 K","4","P b c a","-P 2ac 2ab","61","","","","- C3 H5 N3 O2 -","- C3 H5 N3 O2 -","- C24 H40 N24 O16 -","8","1","PA1153","Tenon, J. A.; Carles, M.; Aycard, J.-P.","4-Méthyl-1,2,4-triazolidine-3,5-dione (Méthylurazole)","Acta Crystallographica Section C","1995","51","7","1440","1442","10.1107/S0108270195000199","","","0.71073","MoKα","","","0.051","","","0.051","","","","","1.01","1.01","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003717","7.244","0.005","14.863","0.008","27.308","0.012","90","","90","","90","","2940","3","293","","293","","","","","","","","from chemical synthesis","5","P 21 21 21","P 2ac 2ab","19","","4-benzyl-6-methoxy-3-propylsulfonyl-2-(2,2,2',2'-tetramethyl-[4,4'] bi{[1,3]dioxolanyl}-5-yl)-1-aza-bicyclo[3.2.0]heptane-7-one","","- C27 H39 N O8 S -","- C30 H46 N O8 S -","- C120 H184 N4 O32 S4 -","4","1","PA1154","Chiaroni, A.; Riche, C.; Adonias, M.; Anaya, J.; Géro, S. D.; Tachdjian, C.","Two Methyl-Substituted Carbapenem Antibiotic Precursors","Acta Crystallographica Section C","1995","51","7","1306","1310","10.1107/S0108270194014423","","","1.5418","CuKα","","","0.068","","","0.093","","","","","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003718","10.136","0.006","10.136","0.006","25.026","0.012","90","","90","","90","","2571","2","293","","293","","","","","","","","from chemical synthesis","5","P 41","P 4w","76","","3-ethylsulfuryl-4-furan-2-yl-methyl-6-methoxy-2- (2,2,2',2'-tetramethyl-[4,4']bi[[1,3] dioxolanyl]-5-yl) -1-aza-bicyclo[3.2.0] heptane-7-one","","- C24 H35 N O7 S -","- C26 H40 N O7 S -","- C104 H160 N4 O28 S4 -","4","1","PA1154","Chiaroni, A.; Riche, C.; Adonias, M.; Anaya, J.; Géro, S. D.; Tachdjian, C.","Two Methyl-Substituted Carbapenem Antibiotic Precursors","Acta Crystallographica Section C","1995","51","7","1306","1310","10.1107/S0108270194014423","","","1.5418","CuKα","","","0.048","","","0.052","","","","","0.61","0.61","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003719","7.304","0.001","15.437","0.003","10.65","0.004","90","","109.47","0.01","90","","1132.1","0.5","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Carnidazole","O-Methyl[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl]thiocarbamate","","- C8 H12 N4 O3 S -","- C8 H12 N4 O3 S -","- C32 H48 N16 O12 S4 -","4","1","PA1156","Bernardinelli, G.; Berclaz, T.; Geoffroy, M.; Rajalakshmi, N.","Anhydrous Form of Carnidazole, C~8~H~12~N~4~O~3~S","Acta Crystallographica Section C","1995","51","7","1390","1392","10.1107/S0108270195000217","","","0.7093","MoKα","","0.138","0.067","","0.056","0.032","","","","3.06","2","2","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003720","9.8098","0.0005","16.5788","0.001","19.1759","0.0008","90","","90","","90","","3118.7","0.3","293","2","293","2","","","","","","","Laboratory of Medicinal Chemistry, Li\`ege","3","P c a b","-P 2bc 2ac","61","","11-(4-methylpiperazin-1-yl)-5H-pyrido[4,3-b][1,5]benzodiazepine","","- C17 H19 N5 -","- C17 H19 N5 -","- C136 H152 N40 -","8","1","PA1158","Dupont, L.; Liégeois, J.-F.; Rogister, F.; Delarge, J.","11-(4-Methylpiperazin-1-yl)-5<i>H</i>-pyrido[4,3-<i>b</i>][1,5]benzodiazepine","Acta Crystallographica Section C","1995","51","7","1379","1381","10.1107/S0108270194014459","","","1.5418","CuKα","","0.0534","0.037","","0.1154","0.1027","","","","1.095","1.224","1.224","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2003721","15.749","0.004","14.283","0.006","19.01","0.005","90","","90.35","0.02","90","","4276","2","293","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H46 F6 O21 S2 U -","- C30 H40 F6 O21 S2 U -","- C120 H160 F24 O84 S8 U4 -","4","1","PA1160","Thuéry, P.; Nierlich, M.; Keller, N.; Lance, M.; Vigner, J.-D.","A Complex Between Uranyl Trifluoromethanesulfonate Hydrate and Benzo-15-crown-5","Acta Crystallographica Section C","1995","51","7","1300","1302","10.1107/S0108270195000138","","","0.71073","MoKα","","","0.04","","","0.05","","","","","2.02","2.02","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003722","4.842","0.002","16.848","0.004","13.489","0.003","90","","90.56","0.02","90","","1100.4","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","methyl 3,5-nitro-trans-cinnamate","","","- C10 H8 N2 O6 -","- C10 H8 N2 O6 -","- C40 H32 N8 O24 -","4","1","SE1059","Sharma, C. V. K.; Panneerselvam, K.; Desiraju, G. R.; Pilati, T.","Methyl 3,5-Dinitro-<i>trans</i>-cinnamate","Acta Crystallographica Section C","1995","51","7","1364","1366","10.1107/S010827019500237X","","","0.71069","MoKα","","0.0938","0.0476","","0.1295","0.1175","","","","0.998","1.228","1.228","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003723","5.743","0.001","13.036","0.002","8.431","0.003","90","","103.66","0.02","90","","613.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","DL-Glutamic acid","","- C5 H9 N O4 -","- C5 H9 N O4 -","- C20 H36 N4 O16 -","4","1","SE1069","Dunitz, J. D.; Schweizer, W. B.","Anhydrous <small>DL</small>-Glutamic Acid","Acta Crystallographica Section C","1995","51","7","1377","1379","10.1107/S0108270195001648","","","0.71069","MoKα","","0.1022","0.038","","0.1563","0.1132","","","","1.22","1.195","1.195","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2003724","43.851","0.008","9.588","0.001","8.788","0.002","90","","90","","90","","3694.9","1.1","299","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","sodium cyclododecanephosphonic acid monoethylester trihydrate","","- C14 H34 Na O6 P -","- C14 H34 Na O6 P -","- C112 H272 Na8 O48 P8 -","8","1","SE1077","Rudert, R.; Czichocki, G.; Weiland, B.; Vollhardt, D.","Sodium Cyclododecylphosphonic Acid Monoethyl Ester Trihydrate","Acta Crystallographica Section C","1995","51","7","1252","1254","10.1107/S0108270195000412","","","1.54184","CuKα","","","0.06","","","0.069","","","","","2.518","2.518","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003725","18.959","0.003","13.339","0.003","19.684","0.002","90","","90","","90","","4978","1.5","297","","","","","","","","","","Acetone","3","P b c a","-P 2ac 2ab","61","","","","- C16 H10 O3 -","- C16 H10 O3 -","- C256 H160 O48 -","16","2","TA1003","Yoon, M.; Kim, Y. H.; Cho, D. W.; Suh, I.-H.; Lee, J.-H.; Ryu, B.-Y.; Park, J.-R.","2,3-Diphenylmaleic Anhydride, an Analogue of <i>cis</i>-Stilbene","Acta Crystallographica Section C","1995","51","7","1374","1377","10.1107/S0108270194013892","","","0.71069","MoKα","","","0.0657","","","0.0657","","","","","3.0897","3.0897","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003726","7.572","0.001","13.25","0.002","17.376","0.002","90","","90","","90","","1743.3","0.4","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 O3 -","- C20 H26 O3 -","- C80 H104 O12 -","4","1","VJ1011","Bidyasagar, M.; Ravikumar, K.; Rama Rao, A. V.; Sarma, B. V. N. B. S.; Singh, A. K.","Structural Studies of Intermediates in the Synthesis of Mifepristone (RU 486). III. 3,3-Ethylenedioxy-5(10),9(11)-estradien-17-one","Acta Crystallographica Section C","1995","51","7","1327","1330","10.1107/S010827019401468X","","","0.71069","MoKα","","","0.041","","","0.049","","","","","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003727","5.083","0.002","15.551","0.006","13.647","0.005","90","","98.94","0.03","90","","1065.6","0.7","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H12 N2 O2 -","- C11 H12 N2 O2 -","- C44 H48 N8 O8 -","4","1","AB1059","Pomés Hernández, R.; Duque Rodriguez, J.; Villena Rodriguez, R.; Soriano Garcia, M.","Two Cyanacrylamides","Acta Crystallographica Section C","1995","51","8","1575","1577","10.1107/S0108270194000442","","","1.5406","CuKα","","","0.045","","","0.057","","","","","3.16","3.16","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003728","9.876","0.003","10.325","0.004","3.87","0.008","93.86","0.02","97.61","0.02","103.52","0.03","378.3","0.8","293","","","","","","","","","","Recrystallized from ethanol","4","P -1","-P 1","2","","","","- C8 H6 N2 O2 -","- C8 H6 N2 O2 -","- C16 H12 N4 O4 -","2","1","AB1059","Pomés Hernández, R.; Duque Rodriguez, J.; Villena Rodriguez, R.; Soriano Garcia, M.","Two Cyanacrylamides","Acta Crystallographica Section C","1995","51","8","1575","1577","10.1107/S0108270194000442","","","1.5406","CuKα","","","0.064","","","0.067","","","","","1.19","1.19","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2003729","7.08","0.002","14.245","0.001","12.072","0.003","90","","95.86","0.02","90","","1211.2","0.5","294","","","","","","","","","","recrystallization from methanol","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H9 Cl N4 O -","- C13 H9 Cl N4 O -","- C52 H36 Cl4 N16 O4 -","4","1","AB1133","Wang, X.; Wang, W.; Liu, H.-X.; Tan, M.-Y.; Li, M.","A Derivative of 1,3,4-Oxadiazole","Acta Crystallographica Section C","1995","51","8","1585","1587","10.1107/S010827019400510X","","","1.5418","CuKα","","","0.052","","","0.068","","","","","1.88","1.88","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003730","14.3658","0.0012","11.0537","0.0006","19.3767","0.0007","90","","128.707","0.005","90","","2401.1","0.3","150","","150","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[C,O-(2-acetylbicyclohept[2.2.1]-3-yl)palladium(II)(2,2'-bipyridyl)] trifluoromethanesulfonate 0.5 diethylether solvate","","- C44 H52 F6 N4 O9 Pd2 S2 -","- C22 H26 F3 N2 O4.5 Pd S -","- C88 H104 F12 N8 O18 Pd4 S4 -","4","1","AB1183","Spek, A. L.; Markies, B. A.; Kruis, D.; Boersma, J.; van Koten, G.","(2-Acetylbicyclo[2.2.1]heptyl-<i>C</i>^3^,<i>O</i>)(2,2'-bipyridyl)palladium(II) Trifluoromethanesulfonate 0.5-Diethyl Ether Solvate","Acta Crystallographica Section C","1995","51","8","1535","1537","10.1107/S0108270194004245","","","0.71073","MoKα","","","0.037","","","0.043","","","","","1.4","1.4","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003731","8.14","0.002","9.672","0.003","27.079","0.004","90","","94.26","0.02","90","","2126","0.9","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H26 N2 O14 Zn2 -","- C15 H14 N2 O14 Zn2 -","- C60 H56 N8 O56 Zn8 -","4","1","AB1187","Hernandez-Padilla, M.; Dominguez, S.; Mederos, A.; Arrieta, J. M.","Tetraaqua(3,4-toluenediamine-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetraacetato)dizinc(II)‒Water (1/2)","Acta Crystallographica Section C","1995","51","8","1549","1552","10.1107/S0108270195000758","","","0.71069","MoKα","","","0.0526","","","0.0571","","","","","1.31","1.31","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003732","9.776","0.002","10.74","0.002","15.135","0.003","71.69","0.02","87.93","0.02","63.48","0.02","1339.7","0.6","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H18 Br4 Cd N4 O4 -","- C22 H18 Br4 Cd N4 O4 -","- C44 H36 Br8 Cd2 N8 O8 -","2","1","AB1188","Ravikumar, K.; Venkata Lakshmi, N.; Swamy, G. Y. S. K.; Chandra Mohan, K.","Water-Bridged Molecular Adduct of Tetrabromocadmate(II) with Protonated Dafone (4,5-Diazafluoren-9-one), (C~11~H~7~N~2~O)~2~[CdBr~4~].2H~2~O","Acta Crystallographica Section C","1995","51","8","1556","1558","10.1107/S0108270194013867","","","0.71073","MoKα","","","0.034","","","0.039","","","","","0.913","0.913","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003733","8.234","0.004","7.678","0.005","15.345","0.008","90","","99.94","0.04","90","","955.6","0.9","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-methyl-1-phenyl-4-nitroimidazole","","- C10 H9 N3 O2 -","- C10 H9 N3 O2 -","- C40 H36 N12 O8 -","4","1","AB1197","Kowalski, A.","2-Methyl-4-nitro-1-phenylimidazole and 2-Methyl-1-(<i>p</i>-methylphenyl)-4-nitroimidazole","Acta Crystallographica Section C","1995","51","8","1670","1672","10.1107/S0108270195001831","","","1.54178","CuKα","","0.0567","0.0364","","0.1214","0.1021","","","","1.069","1.188","1.188","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003734","8.259","0.002","7.805","0.002","16.774","0.003","90","","103.58","0.03","90","","1051","0.4","293","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-methyl-1-(p-methylphenyl)-4-nitroimidazole","","- C11 H11 N3 O2 -","- C11 H11 N3 O2 -","- C44 H44 N12 O8 -","4","1","AB1197","Kowalski, A.","2-Methyl-4-nitro-1-phenylimidazole and 2-Methyl-1-(<i>p</i>-methylphenyl)-4-nitroimidazole","Acta Crystallographica Section C","1995","51","8","1670","1672","10.1107/S0108270195001831","","","1.54178","CuKα","","0.1029","0.0466","","0.164","0.1369","","","","1.042","1.266","1.266","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003735","12.328","0.004","8.596","0.004","13.294","0.005","90","","97.21","0.03","90","","1397.6","1","295","","","","","","","","","","see text","6","P 1 21/a 1","-P 2yab","14","","","","- C6 H14 N2 O8 S U -","- C9 N2 O8 S U -","- C36 N8 O32 S4 U4 -","4","1","AB1210","Thuéry, P.; Keller, N.; Lance, M.; Vigner, J.-D.; Nierlich, M.","Bis(<i>N</i>,<i>N</i>-dimethylformamide)(μ-sulfato)dioxouranium(VI)","Acta Crystallographica Section C","1995","51","8","1526","1529","10.1107/S0108270194014411","","","0.71073","MoKα","","","0.035","","","0.043","","","","","1.2","1.2","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003736","5.2983","0.0006","9.2529","0.0008","11.261","0.002","90","","101.85","0.014","90","","540.3","0.13","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","disilver-cis-butene-dicarboxylate","","- C4 H2 Ag2 O4 -","- C4 H2 Ag2 O4 -","- C16 H8 Ag8 O16 -","4","1","AB1232","Eriksson, L.; Kritikos, M.","Disilver <i>cis</i>-Butenedioate","Acta Crystallographica Section C","1995","51","8","1508","1510","10.1107/S0108270195000606","","","0.7106","MoKα","","0.0395","0.0234","","0.0543","0.0493","","","","1.055","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003737","10.471","0.005","16.433","0.005","11.426","0.004","90","","92.67","0.03","90","","1963.9","1.3","293","","","","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Cl2 Si Zr -","- C20 H26 Cl2 Si Zr -","- C80 H104 Cl8 Si4 Zr4 -","4","1","AB1236","Luttikhedde, H. J. G.; Leino, R. P.; Näsman, J. H.; Ahlgrén, M.; Pakkanen, T.","Racemic Dichloro{(<i>R</i>,<i>R</i>)-3,3'-(dimethylsilanediyl)bis[(1,2,3,3a,7a-η)-4,5,6,7-tetrahydro-1-indenyl]}zirconium","Acta Crystallographica Section C","1995","51","8","1488","1490","10.1107/S0108270195000266","","","0.71073","MoKα","","","0.047","","","0.05","","","","","1.25","1.25","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003738","9.539","0.002","9.684","0.001","10.218","0.001","90","","106.26","0.01","90","","906.1","0.2","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H12 N8 Ni2 S4 -","- C8 H12 N8 Ni2 S4 -","- C16 H24 N16 Ni4 S8 -","2","0.5","AB1237","Zhu, Y.; Lu, S.; Huang, X.; Wu, Q.; Yu, R.; Huang, J.","A Novel Nickel-Containing Chain-Like Polymer: [{Ni(NH~3~)~4~}Ni{S~2~C= C(CN)~2~}~2~]~{∞~}","Acta Crystallographica Section C","1995","51","8","1515","1517","10.1107/S010827019500182X","","","0.71073","MoKα","","","0.043","","","0.053","","","","","1.28","1.28","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003739","5.502","0.005","7.036","0.007","27.688","0.024","90","","93.57","0.07","90","","1069.8","1.7","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Z-ethyl 2-cyano-3-methylsulfinyl-3-methylthio propenoate","","- C8 H11 N O3 S2 -","- C8 H11 N O3 S2 -","- C32 H44 N4 O12 S8 -","4","1","AB1239","Singh, S. K.; Kumar, N.; Kumar, A.; Bisht, K. S.; Parmar, V. S.; Errington, W.","(<i>Z</i>)-Ethyl 2-Cyano-3-methylsulfinyl-3-methylthiopropenoate","Acta Crystallographica Section C","1995","51","8","1630","1632","10.1107/S0108270195002538","","","0.71073","MoKα","","0.0582","0.0398","","0.1062","0.0937","","","","1.031","1.057","1.057","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2003740","12.43","0.003","7.601","0.002","15.219","0.005","90","","108.1","0.04","90","","1366.7","0.7","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaqua-[2-ethylphenyl(N-carboxymethyl)glycinato-O,O',N]copper(II)","","- C12 H17 Cu N O6 -","- C12 H17 Cu N O6 -","- C48 H68 Cu4 N4 O24 -","4","1","AB1241","Hidalgo, M. A.; Romero, J.; Suárez-Varela, J.; Avila-Rosón, J. C.; Martín-Ramos, J. D.","Diaqua[<i>N</i>-(2-ethylphenyl)-<i>N</i>-(carboxymethyl)glycinato-<i>N</i>,<i>O</i>,<i>O</i>'']copper(II)","Acta Crystallographica Section C","1995","51","8","1512","1514","10.1107/S0108270195002009","","","0.71069","MoKα","","0.0333","0.0315","","0.0391","0.0385","","","","","1.22","1.22","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003741","9.9342","0.0008","13.0495","0.0013","15.3141","0.0014","96.612","0.0009","102.291","0.001","105.039","0.008","1842.5","0.3","291","1","293","","","","","","","","synthesised by the authors","9","P -1","-P 1","2","","closo-[(3-tert-Butylisocyanide)-3,8-bis(dimethylphenylphosphine)- octahydro-1,2-diarsenanonaborato(1-)-3-palladium(II)(1+)] Hexafluoroantimonate","","- C21 H39 As2 B9 F6 N P2 Pd Sb -","- C21 H39 As2 B9 F6 N P2 Pd Sb -","- C42 H78 As4 B18 F12 N2 P4 Pd2 Sb2 -","2","1","AB1248","Ferguson, G.; Li, Y.; Spalding, T. R.; Patterson, J. C.","(3-<i>tert</i>-Butyl isocyanide)-3,8-bis(dimethylphenylphosphine)octahydro-1,2-diarsa-3-pallada-<i>closo</i>-dodecaboron(1+) Hexafluoroantimonate","Acta Crystallographica Section C","1995","51","8","1498","1500","10.1107/S0108270195002198","","","0.7107","MolybdenumKα","","0.0899","0.043","","0.1176","0.1071","","","","1.026","1.216","1.216","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003742","5.824","0.006","23.038","0.003","10.589","0.005","90","","103.59","0.05","90","","1381","1.6","293.2","","293.2","","","","","","","","synthesized by authors","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 O4 S2 -","- C13 H12 O4 S2 -","- C52 H48 O16 S8 -","4","1","AB1250","Glidewell, C.; Lightfoot, P.; Patterson, I. L. J.","Bis(phenylsulfonyl)methane, (PhSO~2~)~2~CH~2~, and Dibromobis(phenylsulfonyl)methane, (PhSO~2~)~2~CBr~2~","Acta Crystallographica Section C","1995","51","8","1648","1651","10.1107/S0108270195002095","","","0.7107","MoKα","","","0.033","","","0.045","","","","","1.95","1.95","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003743","8.215","0.001","10.234","0.001","18.589","0.001","90","","93.72","0.01","90","","1559.5","0.3","293.2","","293.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 Br2 O4 S2 -","- C13 H10 Br2 O4 S2 -","- C52 H40 Br8 O16 S8 -","4","1","AB1250","Glidewell, C.; Lightfoot, P.; Patterson, I. L. J.","Bis(phenylsulfonyl)methane, (PhSO~2~)~2~CH~2~, and Dibromobis(phenylsulfonyl)methane, (PhSO~2~)~2~CBr~2~","Acta Crystallographica Section C","1995","51","8","1648","1651","10.1107/S0108270195002095","","","0.7107","MoKα","","","0.029","","","0.03","","","","","2.86","2.86","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003744","12.759","0.001","10.027","0.001","14","0.001","90","","90","","90","","1791.1","0.3","293","1","293","1","","","","","","","","4","P c a 21","P 2c -2ac","29","","5-Imino-1,4,4-triphenylimidazolidin-2-one","","- C21 H17 N3 O -","- C21 H17 N3 O -","- C84 H68 N12 O4 -","4","1","AB1252","Kopf, J.; Heuer, J. R. P.; Schweim, H. G.","5-Imino-1,4,4-triphenylimidazolidin-2-one: an Imidazolidine with an Exocyclic Imino Group","Acta Crystallographica Section C","1995","51","8","1583","1585","10.1107/S0108270195002630","","","1.54178","CuKα","","0.033","0.0328","","0.0924","0.0919","","","","1.033","1.031","1.031","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003745","8.2971","0.0011","10.0909","0.0013","13.863","0.004","78.33","0.014","86.203","0.014","87.326","0.008","1133.5","0.4","293","","294","","","","","","","","synthesized by the authors","7","P -1","-P 1","2","","Di-μ-bromo-3:3'κ^4^Br-bis[μ-(2-phenyl-3-phenylamino-3-sulfido-2-azonia prop-2-en-1-yl-3κS:8κC^1^)-1,2-dicarba-3-rhodadodecaborane].","","- C32 H46 B18 Br2 N4 Rh2 S2 -","- C32 H46 B18 Br2 N4 Rh2 S2 -","- C32 H46 B18 Br2 N4 Rh2 S2 -","1","0.5","AB1253","Ferguson, G.; Spalding, T. R.; McEneaney, P. A.","Di-μ-bromo-3:3'κ^4^<i>Br</i>-bis[μ-(2-phenyl-3-phenylamino-3-sulfido-2-azoniaprop-2-en-1-yl-3κ<i>S</i>:8κ<i>C</i>^1^)-1,2-dicarba-3-rhoda-<i>closo</i>-dodecaborane], a Novel Dimeric Metallacarborane Containing a Rh~2~Br~2~ Bridging Section and the {‒SC(NHPh)‒N(Ph)CH~2~‒} Ligand","Acta Crystallographica Section C","1995","51","8","1501","1503","10.1107/S0108270195002101","","","0.7107","MolybdenumKα","","0.06","0.027","","0.038","0.033","","","","","0.97","0.97","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003746","78.98","0.04","5.836","0.003","43.68","0.02","90","","96.89","0.03","90","","19988","17","170","","","","","","","","","","GE speciality chemicals","4","C 1 2/c 1","-C 2yc","15","","","","- C33 H50 O6 P2 -","- C33 H50 O6 P2 -","- C792 H1200 O144 P48 -","24","3","AS1091","Barren, J. P.; Bryant, G. L.; Garbauskas, M. F.; Mahood, J. A.","Bis(2,4-di-<i>tert</i>-butylphenyl) Pentaerythritol Diphosphite","Acta Crystallographica Section C","1995","51","8","1636","1639","10.1107/S0108270195000965","","","1.54178","CuKα","","0.0553","0.0423","","0.1185","0.1099","","","","","1.185","1.185","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003747","13.3863","0.0009","13.5141","0.0007","24.227","0.002","90","","90","","90","","4382.8","0.5","298","3","","","","","","","","","","6","C c m 21","C 2c -2c","36","","","","- C12 H32 Cl2 N6 Ni O8 -","- C12 H32 Cl2 N6 Ni O8 -","- C96 H256 Cl16 N48 Ni8 O64 -","8","1","AS1130","Tahirov, T. H.; Lu, T.-H.; Lan, W.-J.; Lai, C.-Y.; Chi, T.-Y.; Chung, C.-S.","(Ethylenediamine-<i>N</i>,<i>N</i>')(1,4,7,11-tetraazacyclotetradecane-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')nickel(II) Diperchlorate","Acta Crystallographica Section C","1995","51","8","1531","1533","10.1107/S0108270195001223","","","0.71073","MoKα","","","0.045","","","0.064","","","","","1.4","1.4","","","","","has coordinates","190662","2020-10-21","18:00:00",""
"2003748","8.582","0.003","9.702","0.002","15.004","0.004","93.75","0.02","98","0.03","114.38","0.02","1116.3","0.6","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H9 N5 O11 S4 -","- C16 H9 N5 O11 S4 -","- C32 H18 N10 O22 S8 -","2","1","AS1133","Yu, W.-T.; Fang, Q.; Xu, D.; Jiang, M.-H.; Lei, H.","4,5-Bis(2,4-dinitrophenylthio)-1,3-dithiol-2-one Nitromethane Solvate (BNPT-DTO.CH~3~NO~2~)","Acta Crystallographica Section C","1995","51","8","1602","1604","10.1107/S0108270195001429","","","0.71073","MoKα","","","0.0466","","","0.0466","","","","","0.973","0.973","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003749","8.153","0.001","8.482","0.001","20.638","0.002","90","","92.45","0.01","90","","1425.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Cyclohexyl-3(2-tolyl)thiourea","","- C14 H20 N2 S -","- C14 H20 N2 S -","- C56 H80 N8 S4 -","4","1","AS1160","Akilan, R.; Sivakumar, K.; Subramanian, K.; Janarthanan, N.; Ramadas, K.; Fun, H.-K.","1-Cyclohexyl-3-(2-tolyl)thiourea","Acta Crystallographica Section C","1995","51","8","1627","1629","10.1107/S0108270195001211","","","0.71073","MoKα","","0.0571","0.0383","","0.1145","0.1065","","","","0.95","1.064","1.064","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003750","7.996","0.003","20.077","0.002","7.733","0.002","90","","90","","90","","1241.4","0.6","269","","","","","","","","","","Crystallised from methanol solution","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H14 I N O4 -","- C10 H14 I N O4 -","- C40 H56 I4 N4 O16 -","4","1","AS1168","Okabe, N.; Suga, T.","3-Iodo-<small>L</small>-tyrosine Methanol Solvate (1/1)","Acta Crystallographica Section C","1995","51","8","1700","1701","10.1107/S010827019500271X","","","0.71069","MoKα","","","0.027","","","0.036","","","","","1.49","1.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003751","14.212","0.003","17.39","0.004","14.84","0.001","90","","96.1","0.01","90","","3646.9","1.2","193","","","","","","","","","","THF/heptane","6","P 1 21/a 1","-P 2yab","","","","","- C46 H28 F3 Fe N4 O2 -","- C46.57 H28 F1.71 Fe N4 O3 -","- C186.28 H112 F6.84 Fe4 N16 O12 -","4","1","BK0001","Moy, S. A.; González, J. A.; Wilson, L. J.","Molecular Stereochemistry of [Fe^III^(TPP)(OCOCF~3~)]","Acta Crystallographica Section C","1995","51","8","1490","1494","10.1107/S010827019401334X","","","0.71073","MoKα","","","0.064","","","0.083","","","","","1.95","1.95","","","","","has coordinates","192016","2020-10-21","18:00:00",""
"2003752","7.609","0.002","7.587","0.002","9.414","0.002","90","","105.24","0.03","90","","524.4","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","1-Methylimidazolium D-Tartrate","1-Methylimidazolium D-Tartrate","","- C8 H12 N2 O6 -","- C8 H12 N2 O6 -","- C16 H24 N4 O12 -","2","1","BK1056","Fuller, J.","The Influence of Hydrogen Bonding on the Structure of 1-Methylimidazolium <small>D</small>-Tartrate","Acta Crystallographica Section C","1995","51","8","1680","1683","10.1107/S0108270195002514","","","0.71073","MoKα","","0.0584","0.0435","","0.1245","0.1095","","","","1.07","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003753","10.259","0.003","12.016","0.004","8.42","0.003","93.23","0.03","96.52","0.03","78.22","0.02","1008.9","0.6","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H64 Ni P2 S2 -","- C36 Ni P2 S2 -","- C36 Ni P2 S2 -","1","0.5","BK1083","Cao, R.; Jiang, F.; Hong, M.; Li, H.; Liu, H.","Bis(phenylthiolato-<i>S</i>)bis(tri-<i>n</i>-butylphosphine-<i>P</i>)nickel(II), [Ni(SPh)~2~(P^<i>n^</i>Bu~3~)~2~]","Acta Crystallographica Section C","1995","51","8","1552","1554","10.1107/S0108270194014940","","","0.71073","MoKα","","","0.05","","","0.063","","","","","1.55","1.55","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003754","13.401","0.002","13.5794","0.001","8.695","0.001","90","0.01","90","0.01","90","0.01","1582.3","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","exo-2-(eta-6-Hexamethylbenzene)-endo-2-chloro-2-ruthena-arachno-tetraborane","","- C12 H26 B3 Cl Ru -","- C12 H26 B3 Cl Ru -","- C48 H104 B12 Cl4 Ru4 -","4","1","BK1106","Bown, M.; Ingham, S. L.; Norris, G. E.; Waters, J. M.","<i>exo</i>-2-(η^6^-Hexamethylbenzene)-<i>endo</i>-2-chloro-2-ruthena-<i>arachno</i>-tetraborane(8)","Acta Crystallographica Section C","1995","51","8","1503","1505","10.1107/S0108270195001272","","","0.71073","MoKα","","0.0353","0.0253","","0.0796","0.072","","","","1.023","1.017","1.017","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003755","7.312","0.003","8.349","0.004","10.358","0.002","98.82","0.03","96.98","0.03","114.7","0.04","555.4","0.4","297","","","","","","","","","","","4","P -1","-P 1","2","","3-(3-Nitroanilino)cyclohex-2-en-1-one","","- C12 H12 N2 O3 -","- C12 H12 N2 O3 -","- C24 H24 N4 O6 -","2","1","BK1107","Huang, K.-S.; Britton, D.; Etter, M. C.","3-(3-Nitroanilino)cyclohex-2-en-1-one: an Unexpected Product from the Co-Crystallization of <i>m</i>-Nitroaniline with 1,3-Cyclohexanedione","Acta Crystallographica Section C","1995","51","8","1661","1663","10.1107/S0108270195001740","","","0.71073","MoKα","","","0.062","","","0.079","","","","","2.15","2.15","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2003756","9.8537","0.001","14.2586","0.0013","14.7465","0.0014","90","","90","","90","","2071.9","0.3","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H25 N O2 -","- C25 H25 N O2 -","- C100 H100 N4 O8 -","4","1","BK1114","Clegg, W.; Ranelli, M.; Jackson, R. F. W.","An Epoxyamide","Acta Crystallographica Section C","1995","51","8","1604","1606","10.1107/S0108270195001260","","","1.54184","CuKα","","0.0512","0.048","","0.151","0.1369","","","","1.04","1.046","1.046","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003757","14.454","0.002","6.305","0.0006","15.085","0.003","90","","112.03","0.02","90","","1274.4","0.4","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","? #Bis(pentafluorophenyl)boron Chloride","","- C12 B Cl F10 -","- C12 B Cl F10 -","- C48 B4 Cl4 F40 -","4","1","BK1115","Piers, W. E.; von Spence, R. E.; MacGillivray, L. R.; Zaworotko, M. J.","Bis(pentafluorophenyl)boron Chloride","Acta Crystallographica Section C","1995","51","8","1688","1689","10.1107/S0108270195002526","","","0.7107","MoKα","","0.066","0.035","","0.034","0.033","","","","","2.11","2.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003758","9.349","0.008","13.439","0.008","11.703","0.008","90","","108.16","0.03","90","","1397.1","1.8","293","","","","","","","","","","see text","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H20 N8 S4 Zn2 -","- C28 H20 N8 S4 Zn2 -","- C56 H40 N16 S8 Zn4 -","2","0.5","BM0001","Gronlund, P. J.; Wacholtz, W. F.; Mague, J. T.","A Mixed-Ligand Zinc(II) Complex Containing a Bridging Dithiolate Ligand","Acta Crystallographica Section C","1995","51","8","1540","1543","10.1107/S0108270195001995","","","0.71073","MoKα","","","0.071","","","0.083","","","","","2.42","2.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003759","8.684","0.003","12.239","0.004","8.974","0.002","90","","93.91","0.02","90","","951.6","0.5","173","1","173","1","","","","","","","","5","P 1 21 1","P 2yb","4","","(-)-(2S,5R)-2-[(1'R)-1'-(N,N-dimethylsulfamoyl)-2'-methyl-1'-phenylprop- 2'-yl]-5-methylcyclohexan-1-one","","- C19 H29 N O3 S -","- C19 H29 N O3 S -","- C38 H58 N2 O6 S2 -","2","1","BM1003","Linden, A.; Stanchev, S.","Absolute Configurations of Two Enantiomers of a Substituted Cyclohexanone","Acta Crystallographica Section C","1995","51","8","1697","1699","10.1107/S0108270195002356","","","0.71069","MoKα","","0.0481","0.0368","","0.0363","0.0353","","","","","1.754","1.754","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003760","12.457","0.001","12.457","0.001","10.505","0.002","90","","90","","120","","1411.7","0.3","173","1","173","1","","","","","","","","5","P 32","P 32","145","","(+)-(2S,5R)-2-[(1'S)-1'-(N,N-dimethylsulfamoyl)-2'-methyl-1'-phenylprop- 2'-yl]-5-methylcyclohexan-1-one","","- C19 H29 N O3 S -","- C19 H29 N O3 S -","- C57 H87 N3 O9 S3 -","3","1","BM1003","Linden, A.; Stanchev, S.","Absolute Configurations of Two Enantiomers of a Substituted Cyclohexanone","Acta Crystallographica Section C","1995","51","8","1697","1699","10.1107/S0108270195002356","","","0.71069","MoKα","","0.0338","0.0295","","0.0297","0.0292","","","","","1.768","1.768","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003761","10.609","0.003","10.879","0.003","13.419","0.001","90","","100.14","0.01","90","","1524.6","0.6","173","1","173","1","","","","","","","(I) was prepared as described by Stanchev, Christov, Simova, Mladenova & Linden (1995). Suitable crystals were obtained by recrystallisation from CHCl~3~/hexane.","5","P 1 21 1","P 2yb","4","","(-)-(1S,2S,5R)-1-(N,N-Dimethylsulfamoylmethyl)-2-isopropyl-5-methylcyclohexan- 1-ol","","- C13 H27 N O3 S -","- C13 H27 N O3 S -","- C52 H108 N4 O12 S4 -","4","2","BM1004","Linden, A.; Stanchev, S.","Absolute Configuration of a Substituted Cyclohexanol","Acta Crystallographica Section C","1995","51","8","1694","1696","10.1107/S0108270195002368","","","0.71069","MoKα","","0.0448","0.0335","","0.0318","0.0309","","","","","1.705","1.705","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2003762","9.415","0.001","9.415","0.001","7.078","0.001","90","","90","","120","","543.35","0.11","298","","298","","","","","","","","","3","P -6 2 m","P -6 -2","189","","σ-Dibarium Diphosphate","","- Ba2 O7 P2 -","- Ba2 O9 P2 -","- Ba6 O27 P6 -","3","0.25","BR1095","ElBelghitti, A. A.; Elmarzouki, A.; Boukhari, A.; Holt, E. M.","σ-Dibarium Pyrophosphate","Acta Crystallographica Section C","1995","51","8","1478","1480","10.1107/S0108270195001739","","","0.71073","MoKα","","","0.0254","","","0.0333","","","","","0.9","0.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003763","7.786","0.002","8.984","0.003","11.696","0.004","108.21","0.02","95.13","0.02","109.79","0.02","713.6","0.4","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H11 Cl4 Cu N3 -","- C10 H11 Cl4 Cu N3 -","- C20 H22 Cl8 Cu2 N6 -","2","1","CR1092","Willett, R. D.","2,2'-Iminodipyridinium Tetrachlorocuprate(II)","Acta Crystallographica Section C","1995","51","8","1517","1519","10.1107/S0108270195002149","","","1.54178","CuKα","","","0.064","","","0.109","","","","","1.74","1.74","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2003764","9.5781","0.0008","16.3763","0.0018","17.4396","0.0014","90","","90","","90","","2735.5","0.4","295","","","","","","","","","","","3","F d d d","-F 2uv 2vw","","","","","- C12 F14 O2 -","- C1.5 F1.5 O0.5 -","- C12 F12 O4 -","8","","CR1096","Baenziger, N. C.; Burton, D. J.; Tortelli, V.","2,3,5,6-Tetrakis(trifluoromethyl)terephthaloyl Difluoride","Acta Crystallographica Section C","1995","51","8","1663","1665","10.1107/S0108270195002125","","","1.5418","CuKα","","","0.051","","","0.087","","","","","1.032","1.032","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003765","11.011","0.002","11.395","0.002","11.491","0.002","114.5","0.2","101.8","0.1","93.3","0.2","1268","2","296","","","","","","","","","","Recrystallized","3","P -1","-P 1","2","","","","- C32 H30 O2 -","- C32 H30 O2 -","- C64 H60 O4 -","2","1","CR1131","Chen, C.-F.; Xu, J.-H.; Zhu, Y.; Liu, Y.-C.","(±)-3,4-Bis(4-methylphenyl)-1,6-diphenyl-1,6-hexanedione","Acta Crystallographica Section C","1995","51","8","1712","1714","10.1107/S0108270195000850","","","1.5418","CuKα","","","0.069","","","0.068","","","","","0.854","0.854","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003766","7.853","0.003","11.025","0.001","22.708","0.005","90","","95.96","0.01","90","","1955.4","0.9","296","","","","","","","","","","Recrystallized","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H10 Cl5 N O2 -","- C19 H10 Cl5 N O2 -","- C76 H40 Cl20 N4 O8 -","4","1","CR1132","Chen, C.-F.; Xu, J.-H.; Liu, Y.-C.; Xu, C.","2,3,5,6-Tetrachloro-4-hydroxyphenyl <i>N</i>-(4-Chlorophenyl)benzenecarboximidate","Acta Crystallographica Section C","1995","51","8","1709","1711","10.1107/S0108270195001247","","","0.7107","MoKα","","","0.05","","","0.047","","","","","1.35","1.35","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003767","13.663","0.004","15.342","0.003","23.557","0.005","90","","97.64","0.03","90","","4894","2","298","","","","","","","","","","MeOH evaporation","5","P 1 21 1","P 2yb","4","","","","- C42 H68 Br N5 O12 -","- C42 H68 Br N5 O12 -","- C168 H272 Br4 N20 O48 -","4","2","CR1144","Mayer, S. C.; Carroll, P. J.; Joullié, M. M.","The Cyclic Depsipeptide Backbone of the Didemnins","Acta Crystallographica Section C","1995","51","8","1609","1614","10.1107/S0108270194013405","","","1.54184","CuKα","","","0.065","","","0.077","","","","","2.49","2.49","","","","","has coordinates","203832","2020-10-21","18:00:00",""
"2003768","6.8102","0.0014","9.8841","0.0018","11.2926","0.0018","74.487","0.016","77.343","0.015","83.58","0.023","713.5","0.2","278","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H17 Cl N4 O3 -","- C12 H17 Cl N4 O3 -","- C24 H34 Cl2 N8 O6 -","2","1","CR1154","Brownstein, S. K.; Enright, G. D.","2,3-Diamino-5-hydrophenazinium Chloride Trihydrate","Acta Crystallographica Section C","1995","51","8","1579","1581","10.1107/S010827019500103X","","","1.54056","CuKα","","","0.06","","","0.07","","","","","2.3","2.3","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2003769","5.9355","0.0006","11.258","0.001","13.7293","0.0007","113.667","0.006","98.617","0.007","91.947","0.008","826.27","0.13","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H18 N4 O4 S3 -","- C10 H18 N4 O4 S3 -","- C20 H36 N8 O8 S6 -","2","1","CR1160","Ammon, H. L.; Seymour, R. J.; Huffman, W. M.; D'Silva, T. D. J.","Thiodicarb","Acta Crystallographica Section C","1995","51","8","1619","1621","10.1107/S0108270195000795","","","1.54178","CuKα","","","0.037","","","0.05","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003770","7.182","0.001","8.947","0.001","18.277","0.002","90","","91.89","0.01","90","","1173.8","0.2","293","","","","","","","","","","synthesis","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H13 N3 O4 -","- C10 H16 N3 O4 -","- C40 H64 N12 O16 -","4","1","CR1161","Abboud, K. A.; Summers, S. P.; Palenik, G. J.","Salicylaldehyde Semicarbazone‒Acetic Acid Hydrogen-Bonded Complex","Acta Crystallographica Section C","1995","51","8","1707","1709","10.1107/S0108270195002113","","","0.71073","MoKα","","","0.042","","","0.041","","","","","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003771","5.21","0.002","9.527","0.003","16.524","0.006","90","","90","","90","","820.2","0.5","295","","","","","","","","","","crystallized from CH~3~CN","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H4 I N S2 -","- C6 H4 I N S2 -","- C24 H16 I4 N4 S8 -","4","1","CR1162","Oakley, R. T.; von Spence, R. E.; Richardson, J. F.","Benzo-1,3,2-dithiazolium Iodide","Acta Crystallographica Section C","1995","51","8","1654","1655","10.1107/S0108270195000862","","","0.71073","MoKα","","","0.026","","","0.03","","","","","1.159","1.159","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003772","9.288","0.002","10.809","0.002","13.379","0.002","90","","100.91","0.01","90","","1318.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","tetrachlorophenyl","","","- C12 H5 Cl4 N S -","- C12 H5 Cl4 N S -","- C48 H20 Cl16 N4 S4 -","4","1","CR1176","Zhang, H.; Refat, H. M.; Biehl, E.","α-(2,3,5,6-Tetrachlorophenyl)-α-(3-thienyl)acetonitrile and α-(3-Methoxyphenyl)-α-(2,3,4,5,6-pentachlorophenyl)acetonitrile","Acta Crystallographica Section C","1995","51","8","1667","1670","10.1107/S0108270195004288","","","0.71073","MoKα","","0.058","0.043","","0.131","0.114","","","","1.036","1.079","1.079","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003773","7.681","0.002","8.78","0.002","12.761","0.003","100.24","0.02","99.65","0.02","108.39","0.02","780.2","0.4","293","2","230","2","","","","","","","","5","P -1","-P 1","2","pentachlorophenyl","","","- C15 H8 Cl5 N O -","- C15 H8 Cl5 N O -","- C30 H16 Cl10 N2 O2 -","2","1","CR1176","Zhang, H.; Refat, H. M.; Biehl, E.","α-(2,3,5,6-Tetrachlorophenyl)-α-(3-thienyl)acetonitrile and α-(3-Methoxyphenyl)-α-(2,3,4,5,6-pentachlorophenyl)acetonitrile","Acta Crystallographica Section C","1995","51","8","1667","1670","10.1107/S0108270195004288","","","0.71073","MoKα","","0.144","0.056","","0.105","0.075","","","","1.016","1.161","1.161","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003774","9.2037","0.0006","11.114","0.002","30.012","0.005","90","","90","","90","","3069.9","0.8","295","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- Mo8 O14 Pr -","- Mo8 O14 Pr -","- Mo96 O168 Pr12 -","12","1.5","DU1118","Kerihuel, G.; Gougeon, P.","PrMo~8~O~14~, a Fourth Crystalline Form of the Series <i>R</i>Mo~8~O~14~ (<i>R</i> = La, Ce, Pr, Nd, Sm)","Acta Crystallographica Section C","1995","51","8","1475","1478","10.1107/S0108270195002423","","","0.71073","MoKα","","","0.042","","","0.044","","","","","1.649","1.649","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003775","12.884","0.005","13.675","0.006","9.844","0.006","104.77","0.04","111.99","0.03","73.95","0.04","1523.1","1.4","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H27 B N6 O2 Zn -","- C34 H27 B N6 O2 Zn -","- C68 H54 B2 N12 O4 Zn2 -","2","1","FG1030","Kawabata, S.; Nakata, K.; Ichikawa, K.","Benzoato[hydrotris(3-phenylpyrazol-1-yl-<i>N</i>^2^)borato]zinc(II)","Acta Crystallographica Section C","1995","51","8","1554","1556","10.1107/S0108270195001302","","","1.54184","CuKα","","","0.051","","","0.083","","","","","2.38","2.38","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003776","12.0905","0.0015","12.0619","0.0013","13.97","0.002","89.416","0.008","81.601","0.008","75.202","0.008","1947.8","0.4","200","1","200","1","","","","","","","","6","P -1","-P 1","2","","1-triphenylphosphine-μ^3^-(2,7,11)-triphenylphosphinecupradihydrido-closo- 1,2-selenacupraoctahydrododecaborane","","- C36 H40 B10 Cu2 P2 Se -","- C36 H40 B10 Cu2 P2 Se -","- C72 H80 B20 Cu4 P4 Se2 -","2","1","FG1040","Thornton-Pett, M.; Kennedy, J. D.; Breen, S. P.; Spalding, T. R.","<i>exo</i>-2,7,11-μ~3~-[Dihydro(triphenylphosphine)cuprio-2<i>Cu</i>,7<i>H</i>,11<i>H</i>]-2-triphenylphosphine-<i>closo</i>-1,2-selenacupradodecaborane(8)","Acta Crystallographica Section C","1995","51","8","1496","1498","10.1107/S0108270194012011","","","0.71069","MoKα","","0.0307","0.0246","","0.067","0.0641","","","","1.09","1.115","1.115","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003777","14.383","0.004","9.579","0.002","20.122","0.005","90","","90","","90","","2772.3","1.2","293","2","293","2","","","","","","","moved to publ/section/exptl/prep","3","P b c a","-P 2ac 2ab","61","","(+)-1-Acetoxy-8-hydroxy-1,4,4a,9a-tetrahydro-anthraquinone","","- C16 H14 O5 -","- C16 H14 O5 -","- C128 H112 O40 -","8","1","FG1057","Bolaños-García, V. M.; Jaramillo-Flores, M. E.; Panneerselvam, K.; Soriano-García, M.","(±)-1-Acetoxy-8-hydroxy-1,4,4a,9a-tetrahydroanthraquinone","Acta Crystallographica Section C","1995","51","8","1641","1643","10.1107/S0108270195001107","","","1.54178","CuKα","","0.0545","0.0478","","0.1427","0.1344","","","","1.081","1.104","1.104","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003778","8.502","0.002","21.675","0.013","8.741","0.003","90","","115.76","0.02","90","","1450.7","1.1","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1(R)-methyl-4(1'(R)-phenylethyl)-1H-2,3-benzodiazepine","","- C18 H18 N2 -","- C18 H18 N2 -","- C72 H72 N8 -","4","1","HA1139","Blake, A. J.; Harding, M.; Sharp, J. T.","4-Substituted 1-Methyl-1<i>H</i>-2,3-benzodiazepine Compounds","Acta Crystallographica Section C","1995","51","8","1621","1627","10.1107/S0108270195001120","","","0.71073","MoKα","","0.0559","0.0452","","0.1281","0.1194","","","","1.033","1.065","1.065","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003779","11.7871","0.0009","10.3877","0.0007","12.4807","0.0008","90","","102.276","0.006","90","","1493.21","0.18","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1(R)-methyl-4(1'(R),2',2'-trimethylpropyl)-1H-2,3-benzodiazepine","","- C16 H22 N2 -","- C16 H22 N2 -","- C64 H88 N8 -","4","1","HA1139","Blake, A. J.; Harding, M.; Sharp, J. T.","4-Substituted 1-Methyl-1<i>H</i>-2,3-benzodiazepine Compounds","Acta Crystallographica Section C","1995","51","8","1621","1627","10.1107/S0108270195001120","","","0.71073","MoKα","","0.0863","0.0435","","0.1226","0.1133","","","","1.035","1.219","1.219","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003780","12.852","0.006","10.605","0.005","12.331","0.006","90","","111.07","0.03","90","","1568.3","1.3","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1(R)-methyl-4(1'(R)-ethyl-2',2'-dimethylpropyl)-1H-2,3-benzodiazepine","","- C17 H24 N2 -","- C17 H24 N2 -","- C68 H96 N8 -","4","1","HA1139","Blake, A. J.; Harding, M.; Sharp, J. T.","4-Substituted 1-Methyl-1<i>H</i>-2,3-benzodiazepine Compounds","Acta Crystallographica Section C","1995","51","8","1621","1627","10.1107/S0108270195001120","","","0.71073","MoKα","","0.1076","0.0486","","0.1433","0.1251","","","","1.054","1.208","1.208","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003781","6.35","0.005","10.954","0.008","21.118","0.018","90","","90","","90","","1469","2","150","0.2","150","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-methyl-4(1'-methoxy-benzyl)-1H-2,3-benzodiazepine","","- C18 H18 N2 O -","- C18 H18 N2 O -","- C72 H72 N8 O4 -","4","1","HA1139","Blake, A. J.; Harding, M.; Sharp, J. T.","4-Substituted 1-Methyl-1<i>H</i>-2,3-benzodiazepine Compounds","Acta Crystallographica Section C","1995","51","8","1621","1627","10.1107/S0108270195001120","","","0.71073","MoKα","","0.0691","0.0552","","0.1591","0.1379","","","","1.035","1.057","1.057","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003782","7.7357","0.0009","9.4583","0.001","11.0128","0.0013","102.929","0.008","101.797","0.006","100.792","0.005","745.48","0.15","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","1(S)-methyl-4(1'(R)-methoxy-2',2'-dimethylpropyl)-1H-2,3-benzodiazepine","","- C16 H22 N2 O -","- C16 H22 N2 O -","- C32 H44 N4 O2 -","2","1","HA1139","Blake, A. J.; Harding, M.; Sharp, J. T.","4-Substituted 1-Methyl-1<i>H</i>-2,3-benzodiazepine Compounds","Acta Crystallographica Section C","1995","51","8","1621","1627","10.1107/S0108270195001120","","","0.71073","MoKα","","0.037","0.0336","","0.0991","0.0925","","","","1.096","1.132","1.132","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003783","12.962","0.002","13.4604","0.0008","22.2464","0.0015","90","","90","","90","","3881.4","0.7","298","2","298","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","1(R)-methyl-4(1'(R)-benzoyloxy-2',2'-dimethylpropyl)-1H-2,3-benzodiazepine","","- C22 H24 N2 O2 -","- C22 H24 N2 O2 -","- C176 H192 N16 O16 -","8","1","HA1139","Blake, A. J.; Harding, M.; Sharp, J. T.","4-Substituted 1-Methyl-1<i>H</i>-2,3-benzodiazepine Compounds","Acta Crystallographica Section C","1995","51","8","1621","1627","10.1107/S0108270195001120","","","0.71073","MoKα","","0.046","0.0345","","0.0992","0.0938","","","","1.069","1.118","1.118","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003784","10.3302","0.0003","10.638","0.0002","9.7044","0.0002","90","","90","","90","","1066.44","0.04","293","","293","","","","","","","","Associated Octel Company Ltd","4","P 21 21 21","P 2ac 2ab","19","2,6-dichlorophenylguanidinium chloride","2,6-dichlorophenylguanidinium chloride","","- C7 H8 Cl3 N3 -","- C7 H8 Cl3 N3 -","- C28 H32 Cl12 N12 -","4","1","HA1140","Barker, J.; Powell, H. R.","2,6-Dichlorophenylguanidinium Chloride","Acta Crystallographica Section C","1995","51","8","1714","1716","10.1107/S0108270195002150","","","1.5418","CuKα","","0.0417","0.0405","","0.0432","0.0429","","","","","1.0991","1.0991","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003786","10.828","0.006","16.339","0.003","15.034","0.006","90","","125.5","0.02","90","","2165.4","1.6","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H16 Cl Cu N5 S -","- C25 H16 Cl Cu N5 S -","- C100 H64 Cl4 Cu4 N20 S4 -","4","1","HR1027","Parker, O. J.; Breneman, G. L.","<i>cis</i>-Chloro(isothiocyanato)bis(1,10-phenanthroline)copper(II), <i>cis</i>-[CuCl(NCS)(phen)~2~]","Acta Crystallographica Section C","1995","51","8","1529","1531","10.1107/S0108270194007109","","","0.71073","MoKα","","","0.043","","","0.046","","","","","1.26","1.26","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2003787","12.384","0.002","7.684","0.002","15.739","0.003","90","","111.65","0.03","90","","1392","0.6","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,6-DIMETHYLPHENYL(CARBOXYMETHYL)GLYCINATOCOPPER(II)MONOAQUOMONOAMMIN.","","- C12 H18 Cu N2 O5 -","- C12 H18 Cu N2 O5 -","- C48 H72 Cu4 N8 O20 -","4","1","HR1039","Hidalgo, M. A.; Romerosa, A.; Suárez-Varela, J.; Avila-Rosón, J. C.; Martín-Ramos, J. D.","(Ammine)(aqua)[<i>N</i>-(2,6-dimethylphenyl)-<i>N</i>-(carboxymethyl)glycinato-<i>N</i>,<i>O</i>,<i>O</i>'']copper(II)","Acta Crystallographica Section C","1995","51","8","1510","1512","10.1107/S0108270194015064","","","0.71069","MoKα","","0.2751","0.0387","","0.2601","0.0459","","","","","1.9165","1.9165","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003788","12.195","0.001","12.1952","","6.713","0.002","90","","90","","120","","864.6","0.3","293","","293","","","","","","","","The literature synthesis (Peringer, 1980) produced (1) in crystalline form","6","P -3","-P 3","147","","","","- C14 H36 F6 Hg O12 S8 -","- C14 H36 F6 Hg O12 S8 -","- C14 H36 F6 Hg O12 S8 -","1","0.166667","HR1049","Hook, J. M.; Dean, P. A. W.; Hockless, D. C. R.","Hexakis(dimethyl sulfoxide)mercury(II) Trifluoromethanesulfonate, a Standard for Solid-State ^199^Hg NMR","Acta Crystallographica Section C","1995","51","8","1547","1549","10.1107/S010827019500196X","","","1.5418","CuKalpha","","","0.036","","","0.046","","","","","2.69","2.69","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003789","9.534","0.004","14.283","0.004","24.02","0.005","90","","90","","90","","3270.9","1.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","oleandrin dihydrate","16ß-(Acetyloxy)-3ß-[(2,6-dideoxy-3-o-mothyl-L-arabino- hexopyranosyl)oxy]-14-hydroxycard-20-(22)-enolide.dihydrate","","- C32 H52 O11 -","- C32 H52 O11 -","- C128 H208 O44 -","4","1","HR1054","Panneerselvam, K.; Soriano-García, M.","16β-(Acetyloxy)-3β-[(2,6-dideoxy-3-<i>O</i>-methyl-<small>L</small>-<i>arabino</i>-hexopyranosyl)oxy]-14-hydroxycard-20(22)-enolide Dihydrate","Acta Crystallographica Section C","1995","51","8","1646","1648","10.1107/S0108270195002216","","","1.54178","CuKα","","0.0393","0.0383","","0.1044","0.1033","","","","1.109","1.117","1.117","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003790","11.679","0.001","11.31","0.001","7.847","0.001","90","","90","","90","","1036.51","0.18","238","5","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H16 O4 S -","- C8 H16 O4 S -","- C32 H64 O16 S4 -","4","1","HU1071","Hellier, D. G.; Motevalli, M.","5-<i>tert</i>-Butyl-5-methyl-1,3,2-dioxathiane 2,2-Dioxide","Acta Crystallographica Section C","1995","51","8","1701","1703","10.1107/S0108270193012314","","","0.71069","MoKα","","0.0257","0.0248","","0.0574","0.057","","","","1.011","1.017","1.017","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003791","8.418","0.001","5.676","0.001","13.403","0.002","90","","94.81","0.01","90","","638.15","0.17","300","","300","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bis-cupferronato copper(II)","bis-(N-nitroso-N-phenylhydroxylaminato) copper(II)","","- C12 H10 Cu N4 O4 -","- C12 H10 Cu N4 O4 -","- C24 H20 Cu2 N8 O8 -","2","0.5","HU1103","Elerman, Y.; Atakol, O.; Svoboda, I.; Geselle, M.","Bis(cupferronato)copper(II), [Cu(C~6~H~5~N~2~O~2~)~2~]","Acta Crystallographica Section C","1995","51","8","1520","1522","10.1107/S0108270195002770","","","0.71069","MoKα","","0.0461","0.0292","","0.0632","0.0617","","","","2.308","2.558","2.558","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003792","9.148","0.002","11.461","0.002","10.22","0.002","90","","90.271","0.015","90","","1071.5","0.4","296","","","","","","","","","","Recrystallized from a CH~2~Cl~2~/acetone","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H28 N4 Ni2 P4 -","- C14 H28 N4 Ni2 P4 -","- C28 H56 N8 Ni4 P8 -","2","0.5","HU1128","Manojlovic-Muir, Lj.; Muir, K. W.; Rennie, M.-A.","<i>trans</i>,<i>trans</i>-[Ni~2~(CN)~4~(Me~2~PCH~2~PMe~2~)~2~]","Acta Crystallographica Section C","1995","51","8","1533","1535","10.1107/S0108270194014733","","","0.71069","MoKα","","","0.029","","","0.033","","","","","1.79","1.79","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003793","17.473","0.003","10.926","0.002","16.163","0.003","90","","91.17","0.03","90","","3085","1","295","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Cl2 N6 O8 Zn -","- C30 H24 Cl2 N6 O8 Zn -","- C120 H96 Cl8 N24 O32 Zn4 -","4","0.5","JZ1001","Chen, X.-M.; Wang, R.-Q.; Yu, X.-L.","Tris(2,2'-bipyridine)zinc(II) Perchlorate","Acta Crystallographica Section C","1995","51","8","1545","1547","10.1107/S0108270195000321","","","0.71073","MoKα","","","0.047","","","0.0646","","","","","2.05","2.05","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003794","20.32","0.003","18.618","0.004","5.095","0.002","90","","90","","90","","1927.5","0.9","294","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C10 H12 N2 O2 -","- C10 H12 N2 O2 -","- C80 H96 N16 O16 -","8","1","JZ1016","Sudha, L.; Subramanian, K.; Sivaraman, J.; Sriraghavan, K.; Steiner, Th.","5-Amino-8-methyl-2-quinolone Monohydrate","Acta Crystallographica Section C","1995","51","8","1689","1691","10.1107/S0108270195001867","","","1.54184","CuKα","","","0.054","","","0.062","","","","","1.22","1.22","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003795","9.441","0.001","9.441","0.002","39.253","0.005","90","","90","","90","","3498.7","0.9","295","","","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C19 H23 N O4 -","- C19 H23 N O4 -","- C152 H184 N8 O32 -","8","1","KA1093","Stankovic, S.; Lazar, D.; Petrovic, J.; Miljovic, D.; Pejanovic, V.; Courseille, C.","17β-Hydroxy-3-methoxyestra-1,3,5(10)-triene-6,7-dione 7-Oxime","Acta Crystallographica Section C","1995","51","8","1581","1583","10.1107/S0108270195001375","","","1.54184","CuKα","","","0.06","","","0.063","","","","","1.9","1.9","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003796","24.612","0.006","60.31","0.008","9.131","0.007","90","","90","","90","","13554","11","293","2","293","2","","","","","","","synthesis","4","F d d 2","F 2 -2d","43","Depogen","","","- C33 H43 N5 O9 -","- C33 H43 N5 O9 -","- C528 H688 N80 O144 -","16","1","KA1104","Böcskei, Z.; Simon, K.; Friesz, A.; Hermecz, I.","Depogen, a Haemorheological Agent","Acta Crystallographica Section C","1995","51","8","1587","1590","10.1107/S0108270195000709","","","1.5418","CuKα","","0.1266","0.0581","","0.2132","0.1556","","","","1.024","1.126","1.126","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2003797","8.869","0.001","21.561","0.003","9.014","0.001","90","","98.33","0.02","90","","1705.5","0.4","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 N3 O4 S -","- C18 H15 N3 O4 S -","- C72 H60 N12 O16 S4 -","4","1","KA1106","Główka, M. L.; Olubek, Z.; Olczak, A.","3-Nitro-<i>N</i>-phenyl-4-(phenylamino)benzenesulfonamide","Acta Crystallographica Section C","1995","51","8","1639","1641","10.1107/S0108270195001776","","","1.54178","CuKα","","","0.039","","","0.062","","","","","1.072","1.072","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003798","5.522","0.005","19.389","0.017","8.208","0.006","90","","92.68","0.07","90","","877.8","1.3","293","1","293","1","","","","","","","","4","P 1 21 1","P 2yb","4","","L-(+)-α-Bromobenzeneacetic acid, (-)-Menthyl ester","","- C18 H25 Br O2 -","- C18 H25 Br O2 -","- C36 H50 Br2 O4 -","2","1","KA1107","Kolev, T.; Preut, H.; Koniczek, L.; Bleckmann, P.; Juchnovski, I.; Mladenova, M.","<small>L</small>-(+)-α-Bromobenzeneacetic Acid ({-})-Menthyl Ester","Acta Crystallographica Section C","1995","51","8","1634","1636","10.1107/S0108270195001430","","","0.71073","MoKα","","0.0406","0.0292","","0.0401","0.0299","","","","","0.68","0.68","","","","","has coordinates","288531","2023-12-23","23:35:59",""
"2003799","7.032","0.001","7.443","0.001","19.574","0.004","90","","90","","90","","1024.5","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-(2-Methoxyphenyl)pyridine-N-oxide","","- C12 H11 N O2 -","- C12 H11 N O2 -","- C48 H44 N4 O8 -","4","1","KA1113","Wolska, I.; Kubicki, M.; Gawron, M.; Borowiak, T.; Antkowiak, W. Z.","2-(2-Methoxyphenyl)pyridine 1-Oxide and its 3-Methyl Derivative","Acta Crystallographica Section C","1995","51","8","1590","1593","10.1107/S0108270195002083","","","1.54178","CuKα","","0.0413","0.0398","","0.1164","0.1157","","","","1.098","1.113","1.113","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003800","10.677","0.002","7.75","0.001","13.961","0.003","90","","104.77","0.01","90","","1117.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2-methoxyphenyl)-3-methylpyridine-1-oxide","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C52 H52 N4 O8 -","4","1","KA1113","Wolska, I.; Kubicki, M.; Gawron, M.; Borowiak, T.; Antkowiak, W. Z.","2-(2-Methoxyphenyl)pyridine 1-Oxide and its 3-Methyl Derivative","Acta Crystallographica Section C","1995","51","8","1590","1593","10.1107/S0108270195002083","","","1.54178","CuKα","","0.0444","0.0371","","0.1047","0.0981","","","","1.176","1.205","1.205","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003801","11.028","0.002","11.308","0.003","10.988","0.003","117.1","0.02","114.48","0.02","77.16","0.02","1109.2","0.5","294","","","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H44 Cl6 Er2 N4 O40 -","- C12 Cl6 Er2 N4 O40 -","- C12 Cl6 Er2 N4 O40 -","1","0.5","KH1001","Hu, N.-H.; Wang, Z.-L.; Niu, C.-J.; Ni, J.-Z.","Tetrakis(μ-<small>DL</small>-alanine-<i>O</i>:<i>O</i>')octaaquadierbium(III) Hexaperchlorate","Acta Crystallographica Section C","1995","51","8","1565","1568","10.1107/S0108270194013752","","","0.71073","MoKα","","","0.03","","","0.033","","","","","1.39","1.39","","","","","has coordinates","208885","2020-10-21","18:00:00",""
"2003802","7.9455","0.0011","5.8831","0.0007","12.56","0.002","90","","100.822","0.011","90","","576.67","0.14","293","1","293","1","","","","","","","Lowe & Tsanaktsidis","3","P 1 21/c 1","-P 2ybc","14","","(1) Dimethyl 2-methylcubane-1,4-dicarboxylate","","- C13 H14 O4 -","- C13 H14 O4 -","- C26 H28 O8 -","2","0.5","KH1021","Cristiano, D.; Gable, R. W.; Lowe, D. A.; Tsanaktsidis, J.","Dimethyl 2-Methylcubane-1,4-dicarboxylate and Dimethyl 2,3-Dimethylcubane-1,4-dicarboxylate","Acta Crystallographica Section C","1995","51","8","1658","1661","10.1107/S0108270195002411","","","0.71069","MoKα","","0.0551","0.0465","","0.1279","0.1233","","","","1.088","1.179","1.179","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003803","6.5835","0.0012","9.487","0.002","10.546","0.002","74.1","0.02","83.81","0.02","87.89","0.02","629.8","0.2","293","1","293","1","","","","","","","Cristiano & Tsanaktsidis","3","P -1","-P 1","2","","(2) Dimethyl 2,3 Dimethylcubane-1,4-dicarboxylate","","- C14 H16 O4 -","- C14 H16 O4 -","- C28 H32 O8 -","2","1","KH1021","Cristiano, D.; Gable, R. W.; Lowe, D. A.; Tsanaktsidis, J.","Dimethyl 2-Methylcubane-1,4-dicarboxylate and Dimethyl 2,3-Dimethylcubane-1,4-dicarboxylate","Acta Crystallographica Section C","1995","51","8","1658","1661","10.1107/S0108270195002411","","","0.71069","MoKα","","0.0551","0.0439","","0.133","0.1256","","","","1.064","1.144","1.144","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003804","10.527","0.003","12.163","0.003","12.653","0.005","107.36","0.03","104.31","0.03","108.6","0.02","1356.5","0.9","133","","133","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H58 Cu4 N18 S4 -","- C50 H58 Cu4 N18 S4 -","- C50 H58 Cu4 N18 S4 -","1","0.5","KH1024","Brooker, S.; Carter, B. M.","Synthesis and Structure of a Tetracopper(II) Complex of a Pyrrole-Containing Unsymmetrical Binucleating Ligand: [Cu~2~<i>L</i>(NCS)~2~]~2~","Acta Crystallographica Section C","1995","51","8","1522","1524","10.1107/S0108270195001363","","","0.71073","MoKα","","0.0807","0.045","","0.0966","0.0838","","","","1.052","1.103","1.103","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003805","8.128","0.003","10.174","0.003","11.191","0.004","115.19","0.03","97.27","0.03","105.55","0.03","775.4","0.6","298","","","","","","","","","","see text","5","P -1","-P 1","2","","","","- C40 H28 N2 Ni O6 -","- C40 H28 N2 Ni O6 -","- C40 H28 N2 Ni O6 -","1","0.5","LI1124","Farina, Y.; Yamin, B. M.; Fun, H.-K.; Yip, B.-C.; Teoh, S.-G.","<i>trans</i>-Bis(3-hydroxy-2-phenyl-4<i>H</i>-1-benzopyran-4-onato)bis(pyridine)nickel(II)","Acta Crystallographica Section C","1995","51","8","1537","1540","10.1107/S0108270195000825","","","0.7107","MoKα","","","0.0389","","","0.0477","","","","","1.24","1.24","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003806","13.188","0.002","7.722","0.001","21.178","0.003","90","","90","","90","","2156.7","0.5","298","","","","","","","","","","prepared in the laboratory","5","P b c a","-P 2ac 2ab","61","","","","- C13 H9 N O S -","- C13 H9 N O S -","- C104 H72 N8 O8 S8 -","8","1","LI1128","Teo, S.-B.; Okechuckwu, R. C.; Teoh, S.-G.; Fun, H.-K.; Chinnakali, K.","2-(4-Hydroxyphenyl)benzothiazole","Acta Crystallographica Section C","1995","51","8","1629","1630","10.1107/S0108270195002071","","","0.71069","MoKα","","","0.0371","","","0.0573","","","","","1.34","1.34","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003807","7.242","0.003","8.454","0.003","12.23","0.006","74.53","0.03","74.15","0.03","78.64","0.03","688","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Mono-[N-(3-aminopropyl)-1,3-propanediamine] diaquasulfatonickel(II) monohydrate","","- C6 H23 N3 Ni O7 S -","- C6 H23 N3 Ni O7 S -","- C12 H46 N6 Ni2 O14 S2 -","2","1","LI1131","Mukherjee, M.; Mukherjee, A. K.; Pariya, C.; Ray Chaudhuri, N.","[<i>N</i>-(3-Aminopropyl)-1,3-propanediamine]diaquasulfatonickel(II) Monohydrate, [Ni(SO~4~)(dpt)(H~2~O)~2~].H~2~O [dpt = NH~2~(CH~2~)~3~NH(CH~2~)~3~NH~2~]","Acta Crystallographica Section C","1995","51","8","1543","1545","10.1107/S0108270195000813","","","0.71073","MoKα","","0.0329","0.0246","","0.0789","0.0579","","","","0.944","0.947","0.947","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003808","10.06","0.002","13.953","0.005","23.804","0.004","90","","95.27","0.01","90","","3327.2","1.5","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H38 La2 O16 -","- C24 H38 La2 O16 -","- C96 H152 La8 O64 -","4","0.5","MU1143","Lu, W.-M.; Wu, J.-B.; Dong, N.; Chun, W.-G.; Gu, J.-M.; Liang, K.-L.","<i>catena</i>-Diaquatris(α-methylacrylato)lanthanum(III)","Acta Crystallographica Section C","1995","51","8","1568","1570","10.1107/S0108270194013223","","","0.71073","MoKα","","","0.0471","","","0.056","","","","","5.991","5.991","","","","","has coordinates","191094","2020-10-21","18:00:00",""
"2003809","25.64","0.005","8.4901","0.0008","17.662","0.002","90","","94.22","0.01","90","","3834.3","0.9","298","","","","","","","","","","evaporation from CH~2~Cl~2~/n-hexane","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H30 Cr2 O10 P2 -","- C39 H30 Cr2 O10 P2 -","- C156 H120 Cr8 O40 P8 -","4","0.5","MU1146","Ueng, C.-H.; Shih, G.-Y.","[<i>M</i>~2~(CO)~10~(μ-dppp~e~)] [<i>M</i> = Cr, W; dppp~e~ = Ph~2~P(CH~2~)~5~PPh~2~]","Acta Crystallographica Section C","1995","51","8","1524","1526","10.1107/S0108270194014605","","","0.71073","MoKα","","","0.034","","","0.029","","","","","3.13","3.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003810","25.956","0.004","8.553","0.001","17.784","0.003","90","","94.04","0.01","90","","3938.3","1","298","","","","","","","","","","evaporation from CH~2~Cl~2~/n-hexane","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H30 O10 P2 W2 -","- C39 H30 O10 P2 W2 -","- C156 H120 O40 P8 W8 -","4","0.5","MU1146","Ueng, C.-H.; Shih, G.-Y.","[<i>M</i>~2~(CO)~10~(μ-dppp~e~)] [<i>M</i> = Cr, W; dppp~e~ = Ph~2~P(CH~2~)~5~PPh~2~]","Acta Crystallographica Section C","1995","51","8","1524","1526","10.1107/S0108270194014605","","","0.71073","MoKα","","","0.028","","","0.026","","","","","2.92","2.92","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003811","11.002","0.006","8.857","0.004","12.246","0.005","90","","91.38","0.03","90","","1193","1","293","","","","","","","","","","see text","4","P 1 21/a 1","-P 2yab","14","","","","- C12 H10 As I -","- C12 H10 As I -","- C48 H40 As4 I4 -","4","1","MU1163","Begley, M. J.; Sowerby, D. B.; Silaghi-Dumitrescu, L.","Diphenylarsenic(III) Iodide","Acta Crystallographica Section C","1995","51","8","1632","1634","10.1107/S0108270195001466","","","0.71073","MoKα","","","0.039","","","0.045","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003812","19.656","0.003","35.939","0.002","12.149","0.002","90","","90","","90","","8582","2","298","","","","","","","","","","see text","6","F d d 2","F 2 -2d","43","","","","- C10 H28 La N2 Na O16 -","- C10 H16 La N2 Na O16 -","- C160 H256 La16 N32 Na16 O256 -","16","1","MU1164","Nakamura, K.; Kurisaki, T.; Wakita, H.; Yamaguchi, T.","Sodium Triaqua(ethylenediaminetetraacetato)lanthanate(III) Pentahydrate and the Isomorphous Neodymium(III) and Europium(III) Salts","Acta Crystallographica Section C","1995","51","8","1559","1563","10.1107/S0108270195001843","","","0.71073","MoKα","","","0.027","","","0.034","","","","","1.93","1.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003813","19.543","0.005","35.683","0.008","12.142","0.005","90","","90","","90","","8467","5","298","","","","","","","","","","see text","6","F d d 2","F 2 -2d","43","","","","- C10 H28 N2 Na Nd O16 -","- C10 N2 Na Nd O16 -","- C160 N32 Na16 Nd16 O256 -","16","1","MU1164","Nakamura, K.; Kurisaki, T.; Wakita, H.; Yamaguchi, T.","Sodium Triaqua(ethylenediaminetetraacetato)lanthanate(III) Pentahydrate and the Isomorphous Neodymium(III) and Europium(III) Salts","Acta Crystallographica Section C","1995","51","8","1559","1563","10.1107/S0108270195001843","","","0.71073","MoKα","","","0.025","","","0.031","","","","","1.56","1.56","","","","","has coordinates","191094","2020-10-21","18:00:00",""
"2003814","19.46","0.003","35.583","0.003","12.127","0.003","90","","90","","90","","8397","3","298","","","","","","","","","","see text","6","F d d 2","F 2 -2d","43","","","","- C10 H28 Eu N2 Na O16 -","- C10 Eu N2 Na O16 -","- C160 Eu16 N32 Na16 O256 -","16","1","MU1164","Nakamura, K.; Kurisaki, T.; Wakita, H.; Yamaguchi, T.","Sodium Triaqua(ethylenediaminetetraacetato)lanthanate(III) Pentahydrate and the Isomorphous Neodymium(III) and Europium(III) Salts","Acta Crystallographica Section C","1995","51","8","1559","1563","10.1107/S0108270195001843","","","0.71073","MoKα","","","0.028","","","0.032","","","","","1.97","1.97","","","","","has coordinates","191094","2020-10-21","18:00:00",""
"2003815","7.494","0.001","7.538","0.003","38.3","0.09","90","","90","","90","","2164","5","293","2","293","2","","","","","","","chemical synthesis","5","P 21 21 21","P 2ac 2ab","19","","(1S)-2-[(1R,1'R)-bis(1-Methylpropyl)amino]-1-[(5S)-1-(2-chlorophenyl) methyl-2-oxo-5-pyrrolidinyl]ethanol","","- C21 H33 Cl N2 O2 -","- C21 H33 Cl N2 O2 -","- C84 H132 Cl4 N8 O8 -","4","1","MU1165","Ianelli, S.; Nardelli, M.; Fraire, C.; Grancini, G.; Napoletano, M.; Santangelo, F.","Three Stereoisomers of a Novel and Selective μ-Opioid Analgesic","Acta Crystallographica Section C","1995","51","8","1675","1680","10.1107/S0108270195001478","","","1.54056","CuKα","","0.2612","0.0784","","0.327","0.2139","","","","0.904","1.236","1.236","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003816","17.224","0.003","17.224","0.003","7.416","0.002","90","","90","","90","","2200.1","0.8","293","2","293","2","","","","","","","chemical synthesis","5","P 43","P 4cw","78","","(1S)-2-[(1S,1'S)-bis(1-Methylpropyl)amino]-1-[(5S)-1-(2-chlorophenyl) methyl-2-oxo-5-pyrrolidinyl]ethanol","","- C21 H33 Cl N2 O2 -","- C21 H33 Cl N2 O2 -","- C84 H132 Cl4 N8 O8 -","4","1","MU1165","Ianelli, S.; Nardelli, M.; Fraire, C.; Grancini, G.; Napoletano, M.; Santangelo, F.","Three Stereoisomers of a Novel and Selective μ-Opioid Analgesic","Acta Crystallographica Section C","1995","51","8","1675","1680","10.1107/S0108270195001478","","","1.54178","CuKα","","0.1211","0.0616","","0.1876","0.1527","","","","0.958","1.139","1.139","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003817","13.627","0.002","7.298","0.002","11.527","0.002","90","","108.16","0.01","90","","1089.3","0.4","293","2","293","2","","","","","","","chemical synthesis","5","P 1 21 1","P 2yb","4","","(1S)-2-[(1R,1'S)-bis(1-Methylpropyl)amino]-1-[(5S)-1-(2-chlorophenyl) methyl-2-oxo-5-pyrrolidinyl]ethanol","","- C21 H33 Cl N2 O2 -","- C21 H33 Cl N2 O2 -","- C42 H66 Cl2 N4 O4 -","2","1","MU1165","Ianelli, S.; Nardelli, M.; Fraire, C.; Grancini, G.; Napoletano, M.; Santangelo, F.","Three Stereoisomers of a Novel and Selective μ-Opioid Analgesic","Acta Crystallographica Section C","1995","51","8","1675","1680","10.1107/S0108270195001478","","","1.54178","CuKα","","0.072","0.0369","","0.0924","0.0831","","","","0.795","0.997","0.997","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003818","10.567","0.003","11.156","0.003","9.54","0.002","90","","95.42","0.04","90","","1119.6","0.5","293","","","","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H11 N3 O5 S2 -","- C6 H11 N3 O5 S2 -","- C24 H44 N12 O20 S8 -","4","1","MU1166","Kubiak, M.; Glowiak, T.; Raper, E. S.","(2-Oxo-1,3-thiazolidin-3-yl)carbonylthioethylammonium Nitrate, C~6~H~11~N~2~O~2~S~2~^+^.NO~3~^{-^}","Acta Crystallographica Section C","1995","51","8","1691","1693","10.1107/S010827019500148X","","","0.71069","MoKα","","","0.038","","","0.041","","","","","3.81","3.81","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003819","8.235","0.002","8.602","0.001","19.604","0.001","90","","90","","90","","1388.7","0.4","293","","","","","","","","","","synthesis and recrystallization","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H17 Cl2 Cu N3 -","- C12 H17 Cl2 Cu N3 -","- C48 H68 Cl8 Cu4 N12 -","4","1","MU1170","Wong, W.-T.; Leung, W.-H.; Chan, E. Y. Y.","Dichloro[(1<i>R</i>,2<i>R</i>)-<i>N</i>-(2-pyridylmethylene)-1,2-cyclohexanediamine]copper(II)","Acta Crystallographica Section C","1995","51","8","1519","1520","10.1107/S010827019500223X","","","0.71073","MoKα","","","0.031","","","0.042","","","","","1.034","1.034","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2003820","13.029","0.002","25.722","0.009","13.791","0.006","90","","90","","90","","4622","3","293","","","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C17 H24 Cl2 Cr F6 N4 P -","- C17 H24 Cl2 Cr F6 N4 P -","- C136 H192 Cl16 Cr8 F48 N32 P8 -","8","1","MU1171","Wong, W.-T.; Leung, W.-H.","<i>cis</i>-Dichloro[<i>N</i>,<i>N</i>'-dimethyl-<i>N</i>,<i>N</i>'-bis(2-pyridylmethyl)-1,3-propanediamine]chromium(III) Hexafluorophosphate","Acta Crystallographica Section C","1995","51","8","1494","1495","10.1107/S0108270195002241","","","0.71073","MoKα","","","0.074","","","0.088","","","","","3.061","3.061","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003821","25.975","0.003","8.013","0.002","14.051","0.002","90","","110.34","0.02","90","","2742.2","0.9","299","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H14 Cl3 Hg N2 -","- C10 H14 Cl3 Hg N2 -","- C80 H112 Cl24 Hg8 N16 -","8","1","NA1108","Zouari, F.; Ben Salah, A.; Hovestreydt, E. R.","Phenylpiperazinium Trichloromercurate","Acta Crystallographica Section C","1995","51","8","1563","1565","10.1107/S0108270194013454","","","0.71073","MoKα","","","0.0529","","","0.0615","","","","","1.14","1.14","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003822","19.1","0.002","9.826","0.001","13.411","0.001","90","","129.53","0.06","90","","1941.3","1.7","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H11 Cl N6 -","- C8 H11 Cl N6 -","- C64 H88 Cl8 N48 -","8","2","NA1131","Carugo, O.; Castellani, C. B.; Perotti, A.","Mono- and Diprotonated 1,4-Dihydrazinophthalazine: C~8~H~11~N~6~^+^.Cl^{-^} and C~8~H~12~N~6~^2+^.2Cl^{-^}.2H~2~O","Acta Crystallographica Section C","1995","51","8","1683","1687","10.1107/S0108270195000187","","","1.54184","CuKα","","","0.047","","","0.031","","","","","0.899","0.899","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2003823","9.819","0.001","21.581","0.002","7.027","0.001","90","","113.88","0.06","90","","1361.6","0.7","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H16 Cl2 N6 O2 -","- C8 H16 Cl2 N6 O2 -","- C32 H64 Cl8 N24 O8 -","4","1","NA1131","Carugo, O.; Castellani, C. B.; Perotti, A.","Mono- and Diprotonated 1,4-Dihydrazinophthalazine: C~8~H~11~N~6~^+^.Cl^{-^} and C~8~H~12~N~6~^2+^.2Cl^{-^}.2H~2~O","Acta Crystallographica Section C","1995","51","8","1683","1687","10.1107/S0108270195000187","","","1.54184","CuKα","","","0.039","","","0.03","","","","","0.935","0.935","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2003824","34.342","0.009","12.642","0.002","34.23","0.009","90","","119.43","0.02","90","","12943","6","295","","","","","","","","","","see text","5","C 1 2/c 1","-C 2yc","15","","","","- C120 H190 N8 O17 U2 -","- C122 N8 O17 U2 -","- C488 N32 O68 U8 -","4","0.5","NA1138","Thuéry, P.; Keller, N.; Lance, M.; Vigner, J.-D.; Nierlich, M.","A Bimetallic Complex Between Uranyl and <i>p</i>-<i>tert</i>-Butylcalix[8]arene","Acta Crystallographica Section C","1995","51","8","1570","1574","10.1107/S0108270195000710","","","0.71073","MoKα","","","0.052","","","0.073","","","","","2.92","2.92","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003825","7.624","0.002","10.027","0.002","12.001","0.003","97.46","0.01","106.79","0.01","108.76","0.01","806.2","0.3","294","2","294","2","","","","","","","","5","P 1","P 1","1","","[(Aqua)(L-serinato)(1,10-phenantroline) copper(II)] nitrate.","","- C15 H16 Cu N4 O7 -","- C15 H16 Cu N4 O7 -","- C30 H32 Cu2 N8 O14 -","2","2","NA1141","Moreno-Esparza, R.; Molins, E.; Briansó-Penalva, J. L.; Ruiz-Ramírez, L.; Redón, R.","Aqua(1,10-phenanthroline)(<small>L</small>-serinato)copper(II) Nitrate","Acta Crystallographica Section C","1995","51","8","1505","1508","10.1107/S0108270195002010","","","0.71073","MoKα","","0.0516","0.0383","","0.107","0.1018","","","","1.046","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003826","7.9463","0.0015","9.549","0.005","26.364","0.006","90","","90","","90","","2000.5","1.2","293","2","293","2","","","","","","","slow evaporation of aqueous solution at 293K","4","P b c a","-P 2ac 2ab","61","","Potassium_hydrogen_cis-4-cyclohexene-1,2-dicarboxylate_monohydrate","","- C8 H11 K O5 -","- C8 H11 K O5 -","- C64 H88 K8 O40 -","8","1","NA1143","Kim, S. A.","Potassium Hydrogen <i>cis</i>-4-Cyclohexene-1,2-dicarboxylate Monohydrate","Acta Crystallographica Section C","1995","51","8","1486","1488","10.1107/S0108270195001673","","","0.71069","MoKα","","0.0674","0.0434","","0.1286","0.1121","","","","1.026","1.081","1.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003827","6.988","0.002","14.11","0.003","30.133","0.006","90","","90","","90","","2971.1","1.2","293","2","293","2","","","","","","","recrystallized from an aqueous solution at room temperature","5","P b c a","-P 2ac 2ab","61","","3-[(2-benzotrifluoride)-2-hydroxy-3H-naphth-3-ylidene)methyl]aldamine","","- C18 H12 F3 N O -","- C18 H12 F3 N O -","- C144 H96 F24 N8 O8 -","8","1","NA1150","Fernández-G., J. M.; Rodríguez-Romero, A.; Panneerselvam, K.; Soriano-García, M.","Two 2,3-Naphthalenic Schiff Bases","Acta Crystallographica Section C","1995","51","8","1643","1646","10.1107/S0108270195001417","","","1.54178","CuKα","","0.0588","0.0554","","0.1543","0.1497","","","","1.181","1.212","1.212","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003828","6.076","0.002","14.055","0.006","15.087","0.009","90","","90","","90","","1288.4","1","293","2","293","2","","","","","","","recrystallized from an aqueous solution at room temperature","4","P 21 21 21","P 2ac 2ab","19","","3-[(tertbutyl)-2-Hydroxy-3H-Naphth-3-ylidene)methyl]aldamine","","- C15 H17 N O -","- C15 H17 N O -","- C60 H68 N4 O4 -","4","1","NA1150","Fernández-G., J. M.; Rodríguez-Romero, A.; Panneerselvam, K.; Soriano-García, M.","Two 2,3-Naphthalenic Schiff Bases","Acta Crystallographica Section C","1995","51","8","1643","1646","10.1107/S0108270195001417","","","1.54178","CuKα","","0.0585","0.0554","","0.1643","0.1597","","","","1.153","1.164","1.164","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003829","12.139","0.003","14.635","0.003","27.951","0.007","90","","90","","90","","4966","2","293","","","","","","","","","","?","3","P 21 21 21","P 2ac 2ab","19","","","","- C27 H40 O4 -","- C27 H40 O4 -","- C216 H320 O32 -","8","2","","Puliti, R.; Mattia, C. A.; Mazzarella, L.","Scalaradial, a Sesterterpenoid Metabolite from the Marine Sponge Cacospongia mollior","Acta Crystallographica Section C","1995","51","8","1703","1707","10.1107/S0108270195002034","","","1.54056","CuKα","","","0.04","","","0.039","","","","","0.89","0.89","","","","","has coordinates","175356","2020-10-21","18:00:00",""
"2003830","8.166","0.002","8.845","0.002","5.934","0.001","102.54","0.02","94.37","0.02","113.57","0.02","377.05","0.16","297","","","","","","","","","","hydrothermal synthesis","4","P -1","-P 1","2","","","","- Cu9 H2 O20 P4 -","- Cu9 H2 O20 P4 -","- Cu9 H2 O20 P4 -","1","0.5","OH1045","Yamashita, A.; Kawahara, A.; Sasaki, N.","Synthetic Copper Monophosphate","Acta Crystallographica Section C","1995","51","8","1483","1485","10.1107/S0108270193008145","","","0.71069","MoKα","","","0.042","","","0.057","","","","","1.77","1.77","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003831","22.288","0.002","22.288","0.002","22.288","0.002","90","","90","","90","","11071.7","1.7","295","","","","","","","","","","synthesis","5","F d -3 c","-F 4ud 2vw 3","","","","","- Cl5 Cr Cu H18 N6 -","- Cl5 Cr Cu H18 N6 -","- Cl160 Cr32 Cu32 H576 N192 -","32","","OH1078","Ohba, S.; Fujita, T.; Bernal, I.","Phase Transition of Hexaamminechromium(III) Pentachlorocuprate(II)","Acta Crystallographica Section C","1995","51","8","1481","1483","10.1107/S0108270195001521","","","0.71073","MoKα","","","0.03","","","0.031","","","","","1.82","1.82","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003832","22.155","0.003","22.155","0.003","22.181","0.006","90","","90","","90","","10887","4","120","","","","","","","","","","synthesis","5","F 41/a d c","-I 4bd 2c (1/2*x+1/2*y,-1/2*x+1/2*y,z)","142","","","","- Cl5 Cr Cu H18 N6 -","- Cl5 Cr Cu H18 N6 -","- Cl160 Cr32 Cu32 H576 N192 -","32","","OH1078","Ohba, S.; Fujita, T.; Bernal, I.","Phase Transition of Hexaamminechromium(III) Pentachlorocuprate(II)","Acta Crystallographica Section C","1995","51","8","1481","1483","10.1107/S0108270195001521","","","0.71073","MoKα","","","0.1","","","0.092","","","","","6.73","6.73","","","","","has coordinates","206090","2020-10-21","18:00:00",""
"2003833","6.999","0.001","7.787","0.002","26.933","0.003","91.68","0.02","89.54","0.01","105.37","0.02","1414.8","0.5","293","","293","","","","","","","","","5","P -1","-P 1","2","","2-(4,5-dimethyl-1,3-dithiol-2-ylidene)-5,6-dihydro-1,3-dithiolo[4,5-b]-1,4- dithiin tetrafluoroborate (2:1)","","- C20 H20 B F4 S12 -","- C20 H16 B F4 S12 -","- C40 H32 B2 F8 S24 -","2","1","OH1079","Saitoh, H.; Saito, K.; Itoh, H.; Mochiduki, T.; Kikuchi, K.; Ikemoto, I.","Organic Metal (DIMET)~2~BF~4~","Acta Crystallographica Section C","1995","51","8","1656","1658","10.1107/S0108270195001806","","","0.71068","MoKα","","","0.04","","","0.043","","","","","4.38","4.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003834","10.021","0.003","5.991","0.002","18.094","0.006","90","","101.1","0.03","90","","1066","0.6","298","","","","","","","","","","synthesis","4","P 1 21/c 1","-P 2ybc","","","","","- C13 H11 N O2 -","- C13 H11 N O2 -","- C52 H44 N4 O8 -","4","1","PA1059","Mansilla-Koblavi, F.; Tenon, J. A.; Toure, S.; Ebby, N.; Lapasset, J.; Carles, M.","Une Serie de <i>N</i>-(2,3-Dihydroxybenzilidene)amines: Manifestation d'Equilibres Tautomères","Acta Crystallographica Section C","1995","51","8","1595","1602","10.1107/S0108270194002945","","","0.71069","MoKα","","","0.037","","","0.037","","","","","0.83","0.83","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003835","11.28","0.05","7.92","0.03","13.45","0.05","90","","105.16","0.08","90","","1160","8","298","","","","","","","","","","synthesis","4","P 1 21/c 1","-P 2ybc","","","","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C56 H52 N4 O8 -","4","1","PA1059","Mansilla-Koblavi, F.; Tenon, J. A.; Toure, S.; Ebby, N.; Lapasset, J.; Carles, M.","Une Serie de <i>N</i>-(2,3-Dihydroxybenzilidene)amines: Manifestation d'Equilibres Tautomères","Acta Crystallographica Section C","1995","51","8","1595","1602","10.1107/S0108270194002945","","","0.71069","MoKα","","","0.072","","","0.072","","","","","0.98","0.98","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003836","7.236","0.007","7.714","0.003","21.663","0.007","90","","112.34","0.06","90","","1118.4","1.3","298","","","","","","","","","","synthesis","5","P 1 21/c 1","-P 2ybc","","","","","- C13 H10 Cl N O2 -","- C13 H10 Cl N O2 -","- C52 H40 Cl4 N4 O8 -","4","1","PA1059","Mansilla-Koblavi, F.; Tenon, J. A.; Toure, S.; Ebby, N.; Lapasset, J.; Carles, M.","Une Serie de <i>N</i>-(2,3-Dihydroxybenzilidene)amines: Manifestation d'Equilibres Tautomères","Acta Crystallographica Section C","1995","51","8","1595","1602","10.1107/S0108270194002945","","","0.71069","MoKα","","","0.046","","","0.046","","","","","1.34","1.34","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003837","10.749","0.009","9.509","0.003","17.977","0.005","90","","146.08","0.07","90","","1025","2","298","","","","","","","","","","synthesis","4","P 1 21/c 1","-P 2ybc","","","","","- C10 H13 N O2 -","- C10 H13 N O2 -","- C40 H52 N4 O8 -","4","1","PA1059","Mansilla-Koblavi, F.; Tenon, J. A.; Toure, S.; Ebby, N.; Lapasset, J.; Carles, M.","Une Serie de <i>N</i>-(2,3-Dihydroxybenzilidene)amines: Manifestation d'Equilibres Tautomères","Acta Crystallographica Section C","1995","51","8","1595","1602","10.1107/S0108270194002945","","","0.71069","MoKα","","","0.034","","","0.034","","","","","0.046","0.046","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003838","9.8","0.02","15.88","0.05","9.38","0.02","96.08","0.08","105.8","0.08","77.3","0.1","1369","6","100","","","","","","","","","","synthesis","4","P -1","-P 1","2","","","","- C10 H11 N O2 -","- C10 H11 N O2 -","- C60 H66 N6 O12 -","6","3","PA1059","Mansilla-Koblavi, F.; Tenon, J. A.; Toure, S.; Ebby, N.; Lapasset, J.; Carles, M.","Une Serie de <i>N</i>-(2,3-Dihydroxybenzilidene)amines: Manifestation d'Equilibres Tautomères","Acta Crystallographica Section C","1995","51","8","1595","1602","10.1107/S0108270194002945","","","1.5428","CuKα","","","0.066","","","0.066","","","","","1.22","1.22","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2003839","9.598","0.001","11.636","0.002","12.759","0.002","110.64","0.02","107.07","0.02","96.58","0.02","1236.3","0.4","25","","","","","","","","","","methanol solution","4","P -1","-P 1","2","","","","- C10 H20 N2 O3 -","- C10 H19 N2 O3 -","- C40 H76 N8 O12 -","4","2","PA1103","Aubry, A.; Dupont, V.; Marraud, M.","^<i>t^</i>BuCO-ψ[CO-N(OH)]-Gly-NH^<i>i^</i>Pr","Acta Crystallographica Section C","1995","51","8","1577","1579","10.1107/S0108270194006025","","","1.5406","CuKα","","","0.074","","","0.087","","","","","10.3","10.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003840","14.078","0.003","9.473","0.002","14.899","0.003","90","","79.51","0.03","90","","1953.7","0.7","293","","293","","","","","","","","grown from heptane solution","4","P 1 21/a 1","-P 2yab","14","Spiro[azatricycloundecane-naphthoxazine]","8-methyl-spiro[syn-10,11-benzo-8-azatricyclo[5,2,2,0^1,5^] undecane-9-3'[3H]naphth[1,2b][1,4]oxazine","","- C26 H24 N2 O -","- C26 H24 N2 O -","- C104 H96 N8 O4 -","4","1","PA1155","Pèpe, G.; Laréginie, P.; Samat, A.; Guglielmetti, R.; Zaballos, E.","8-Methylspiro(<i>syn</i>-10,11-benzo-8-azatricyclo[5.2.2.0^1,5^]undec-10-ene)-9,3'-[3<i>H</i>]naphth[1,2-<i>b</i>][1,4]oxazine","Acta Crystallographica Section C","1995","51","8","1617","1619","10.1107/S0108270195000205","","","1.5418","CuKα","","0.0442","0.0442","","0.0442","0.0442","","","","","0.71","0.71","","","","","has coordinates","198477","2020-10-21","18:00:00",""
"2003841","7.957","0.005","11.92","0.003","21.533","0.003","90","","99.72","0.01","90","","2013","1.4","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","8-ethoxy-2-methylspiro(syn-5,6-benzo-2-azabicyclo[2,2,2] octane-3,3'-[3H]naphth[2,1,b][1,4]oxazine)","","- C25 H24 N2 O2 -","- C25 H24 N2 O2 -","- C100 H96 N8 O8 -","4","1","PA1159","Reboul, J.-P.; Samat, A.; Laréginie, P.; Lokshin, V.; Guglielmetti, R.; Pèpe, G.","Photochromic 8-Ethoxy-2-methylspiro(<i>syn</i>-5,6-benzo-2-azabicyclo[2.2.2]oct-5-ene-3,3'-[3<i>H</i>]naphth[2,1-<i>b</i>][1,4]oxazine)","Acta Crystallographica Section C","1995","51","8","1614","1617","10.1107/S0108270195000229","","","1.5418","CuKα","","0.052","0.052","","0.052","0.052","","","","0.19","0.19","0.19","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2003842","9.299","0.003","9.592","0.004","13.263","0.005","79.42","0.03","69.85","0.03","62.55","0.03","985.1","0.7","293","","","","","","","","","","","3","P -1","-P 1","2","","","","- C27 H18 S2 -","- C27 H18 S2 -","- C54 H36 S4 -","2","1","PA1161","Leino, R. P.; Luttikhedde, H. J. G.; Nasman, J. H.; Ahlgrén, M.; Pakkanen, T.","Dispiro(fluorene-9,4'-[1,3]dithiolane-5',9''-fluorene)","Acta Crystallographica Section C","1995","51","8","1593","1594","10.1107/S010827019500165X","","","0.71073","MoKα","","","0.047","","","0.047","","","","","1.153","1.153","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003843","10.233","0.002","18.605","0.003","19.9","0.003","90","","101.19","0.01","90","","3716.6","1.1","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2,3,4,5,8-hexakis-trimethylsilyl-1,2,3,4,5,8-hexahydro-naphthalene.","","- C28 H62 Si6 -","- C28 H62 Si6 -","- C112 H248 Si24 -","4","1","PA1172","Leger, J. M.; Grignon-Dubois, M.; Laguerre, M.","1,2,3,4,5,8-Hexakis(trimethylsilyl)-1,2,3,4,5,8-hexahydronaphthalene: the First Example of Double-<i>peri</i> Trimethylsilyl Substitution","Acta Crystallographica Section C","1995","51","8","1665","1667","10.1107/S0108270195002484","","","1.5418","CuKα","","","0.051","","","0.072","","","","","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003844","5.916","0.001","13.808","0.002","35.841","0.005","90","","90","","90","","2927.8","0.8","290","","","","","","","","","","grown from EtOAc","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H33 Br O4 -","- C34 H33 Br O4 -","- C136 H132 Br4 O16 -","4","1","PT1000","Gao, Q.; Yu, K.-L.; Mansuri, M. M.; Kerns, E. H.; Starrett, Jnr, J. E.","Methyl 6-[(4-Bromobenzoyloxy)(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthyl)methyl]-2-naphthalenecarboxylate","Acta Crystallographica Section C","1995","51","8","1672","1675","10.1107/S0108270195001958","","","1.5418","CuKα","","","0.045","","","0.057","","","","","1.643","1.643","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003845","6.169","0.002","6.894","0.002","12.797","0.002","90","","101.98","0.03","90","","532.4","0.3","293","","","","","","","","","","see text","4","P 1 21 1","P 2yb","4","","","","- C10 H11 N3 O4 -","- C10 H11 N3 O4 -","- C20 H22 N6 O8 -","2","1","VJ1016","Das, A. K.; Mazumdar, S. K.","3'-Isocyano-2',3'-dideoxyuridine (NCddUrd): a Nucleoside Analogue","Acta Crystallographica Section C","1995","51","8","1652","1654","10.1107/S0108270195000114","","","1.54184","CuKα","","","0.037","","","0.04","","","","","1.161","1.161","","","","","has coordinates","198478","2020-10-21","18:00:00",""
"2003846","5.333","0.002","23.891","0.006","9.876","0.002","90","","101.68","0.02","90","","1232.3","0.6","298","","","","","","","","","","see text","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 O3 -","- C21 H17 O3 -","- C84 H68 O12 -","4","1","AB1213","Kendi, E.; Özbey, S.; Ertan, R.; Fun, H.-K.; Yip, B.-C.","7-Hydroxyflavanone (I) and 7-Ethoxycarbonylmethoxyflavanone (II)","Acta Crystallographica Section C","1995","51","9","1880","1883","10.1107/S0108270195002940","","","0.71073","MoKα","","","0.0601","","","0.0766","","","","","2.07","2.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003847","7.238","0.003","7.822","0.003","29.518","0.013","90","","90.48","0.04","90","","1671.1","1.2","298","","","","","","","","","","see text","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 O5 -","- C19 H18 O5 -","- C76 H72 O20 -","4","1","AB1213","Kendi, E.; Özbey, S.; Ertan, R.; Fun, H.-K.; Yip, B.-C.","7-Hydroxyflavanone (I) and 7-Ethoxycarbonylmethoxyflavanone (II)","Acta Crystallographica Section C","1995","51","9","1880","1883","10.1107/S0108270195002940","","","0.71073","MoKα","","","0.0528","","","0.0474","","","","","1.06","1.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003848","7.879","0.003","16.867","0.006","11.826","0.004","90","","100.35","0.03","90","","1546","1","298","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 I Ir O S -","- C14 H22 I Ir O S -","- C56 H88 I4 Ir4 O4 S4 -","4","1","AB1226","Terblans, Y. M.; Basson, S. S.; Purcell, W.; Lamprecht, G. J.","(η^4^-1,5-Cyclooctadiene)(iodo)(methyl)(thioacetylacetonato)iridium(III)","Acta Crystallographica Section C","1995","51","9","1748","1750","10.1107/S010827019500254X","","","0.71073","MoKα","","","0.044","","","0.054","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003849","6.593","0.004","10.237","0.005","20.219","0.01","90","","90","","90","","1364.6","1.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2R,3S,4S) 1-[(1S)-1-phenylethyl]-3-hydroxy-2-hydroxymethyl-4-methyl pyrrolidine","","- C14 H21 N O2 -","- C14 H21 N O2 -","- C56 H84 N4 O8 -","4","1","AB1230","Chiaroni, A.; Riche, C.; Nicole, L.","(2<i>R</i>,3<i>S</i>,4<i>S</i>)-3-Hydroxy-4-methyl-1-[(1<i>S</i>)-1-phenylethyl]pyrrolidine-2-methanol","Acta Crystallographica Section C","1995","51","9","1859","1861","10.1107/S0108270194015027","","","1.5418","CuKα","","","0.036","","","0.049","","","","","0.64","0.64","","","","","has coordinates","190596","2020-10-21","18:00:00",""
"2003850","6.799","0.002","10.4","0.002","22.909","0.005","90","","96.86","0.02","90","","1608.3","0.7","293","","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","1-Methylimidazolinylidene(1,3-dimethylimidazolinylidene) gold(I) trifluoromethanesufonate","","- C10 H14 Au F3 N4 O3 S -","- C10 H14 Au F3 N4 O3 S -","- C40 H56 Au4 F12 N16 O12 S4 -","4","1","AB1233","Kruger, G. J.; Olivier, P. J.; Lindeque, L.; Raubenheimer, H. G.","(1,3-Dimethylimidazolinylidene)(1-methylimidazolinylidene)gold(I) Trifluoromethanesulfonate","Acta Crystallographica Section C","1995","51","9","1814","1816","10.1107/S0108270195003167","","","0.7093","MoKα","","0.145","0.057","","0.049","0.04","","","","2.082","2.045","2.045","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003851","6.015","0.002","8.052","0.003","14.387","0.005","98.83","0.03","94.21","0.03","108.65","0.03","646.8","0.4","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H9 N O4 S -","- C15 H9 N O4 S -","- C30 H18 N2 O8 S2 -","2","1","AB1240","Lamiot, J.; Baert, F.; Taverne, T.; Houssin, R.; Lesieur, I.","4-(2-Carboxybenzoyl)-2(3<i>H</i>)-benzothiazolone","Acta Crystallographica Section C","1995","51","9","1912","1915","10.1107/S0108270195003179","","","0.71073","MoKα","","","0.0496","","","0.0557","","","","","1.62","1.62","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2003852","16.037","0.003","8.769","0.004","12.804","0.003","90","","90","","90","","1800.6","1","153","","","","","","","","","","see text","4","C m c 21","C 2c -2","36","","","","- C14 H21 B10 P -","- C14 H21 B10 P -","- C56 H84 B40 P4 -","4","0.5","AB1245","Kivekäs, R.; Teixidor, F.; Viñas, C.; Nuñez, R.","1-Diphenylphosphino-1,2-dicarba-<i>closo</i>-dodecaborane(12) at 153 K","Acta Crystallographica Section C","1995","51","9","1868","1870","10.1107/S0108270195002605","","","0.71073","MoKα","","","0.062","","","0.045","","","","","1.253","1.253","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003853","18.278","0.012","13.866","0.007","13.52","0.005","90","","90","","90","","3427","3","193","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C9 H27 B10 P -","- C9 H27 B10 P -","- C72 H216 B80 P8 -","8","1","AB1246","Kivekäs, R.; Sillanpää, R.; Teixidor, F.; Viñas, C.; Nuñez, R.; Abad, M.","1-Diisopropylphosphino-2-methyl-1,2-dicarba-<i>closo</i>-dodecaborane(12), (1), and 1,2-Bis(diisopropylphosphino)-1,2-dicarba-<i>closo</i>-dodecaborane(12), (2), at 193 K","Acta Crystallographica Section C","1995","51","9","1864","1868","10.1107/S0108270195002629","","","0.71073","MoKα","","","0.095","","","0.082","","","","","1.442","1.442","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003854","10.254","0.005","17.128","0.006","13.717","0.006","90","","104.39","0.04","90","","2333.5","1.8","193","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H38 B10 P2 -","- C14 H38 B10 P2 -","- C56 H152 B40 P8 -","4","1","AB1246","Kivekäs, R.; Sillanpää, R.; Teixidor, F.; Viñas, C.; Nuñez, R.; Abad, M.","1-Diisopropylphosphino-2-methyl-1,2-dicarba-<i>closo</i>-dodecaborane(12), (1), and 1,2-Bis(diisopropylphosphino)-1,2-dicarba-<i>closo</i>-dodecaborane(12), (2), at 193 K","Acta Crystallographica Section C","1995","51","9","1864","1868","10.1107/S0108270195002629","","","0.71073","MoKα","","","0.053","","","0.05","","","","","1.594","1.594","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003855","12.353","0.002","12.353","0.002","12.931","0.002","90","","90","","120","","1708.9","0.5","291","2","291","2","","","","","","","","3","R -3 :H","-R 3","148","octachlorosilasesquioxane","","","- Cl8 O12 Si8 -","- Cl8 O12 Si8 -","- Cl24 O36 Si24 -","3","0.166667","AB1255","Törnroos, K. W.; Calzaferri, G.; Imhof, R.","Octachlorosilasesquioxane, Cl~8~Si~8~O~12~","Acta Crystallographica Section C","1995","51","9","1732","1735","10.1107/S0108270195004410","","","0.71073","MoKα","","0.2354","0.0459","","0.1246","0.07","","","","1.041","1.184","1.184","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003856","8.3218","0.0005","15.1916","0.0012","14.9796","0.0009","90","","102.43","0.01","90","","1849.4","0.2","153","2","153","2","","","","","","","Adolfsson et al.","6","P 1 21/n 1","-P 2yn","14","","trichloro[tris(2-pyridyl)methanol]rhodium(III).MeOH","","- C17 H17 Cl3 N3 O2 Rh -","- C17 H17 Cl3 N3 O2 Rh -","- C68 H68 Cl12 N12 O8 Rh4 -","4","1","AB1264","Ertan, A.; Adolfsson, H.; Moberg, C.","Trichloro[tris(2-pyridyl)methanol]rhodium(III)‒Methanol (1/1)","Acta Crystallographica Section C","1995","51","9","1761","1765","10.1107/S0108270195002939","","","0.71069","MoKα","","0","0.0301","","0","0.0334","","","","","","","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2003857","20.019","0.004","6.878","0.001","8.923","0.002","90","","112.87","0.03","90","","1132","0.5","293","2","293","2","","","","","","","Methylation of uridine.","4","C 1 2 1","C 2y","5","3-methyluridine","","","- C10 H14 N2 O6 -","- C10 H14 N2 O6 -","- C40 H56 N8 O24 -","4","1","AB1267","Partridge, B. L.; Pritchard, C. E.","Two Methylated Ribonucleosides: 3-Methyluridine and 1-Methylinosine","Acta Crystallographica Section C","1995","51","9","1929","1932","10.1107/S0108270195003933","","","0.71073","MoKα","","0.0442","0.0345","","0.1254","0.1029","","","","1.141","0.946","0.946","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003858","10.622","0.002","13.662","0.003","16.525","0.003","90","","90","","90","","2398.1","0.8","293","2","293","2","","","","","","","Methylation of inosine.","4","P 21 21 21","P 2ac 2ab","19","1-methylinosine","","","- C11 H14 N4 O5 -","- C11 H14 N4 O5 -","- C88 H112 N32 O40 -","8","2","AB1267","Partridge, B. L.; Pritchard, C. E.","Two Methylated Ribonucleosides: 3-Methyluridine and 1-Methylinosine","Acta Crystallographica Section C","1995","51","9","1929","1932","10.1107/S0108270195003933","","","1.54178","CuKα","","0.076","0.05","","0.1668","0.1287","","","","1.084","0.98","0.98","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003859","17.729","0.011","13.521","0.013","23.842","0.006","90","","114.64","0.02","90","","5195","6","296","","296","","","","","","","","Chloroform solution","4","C 1 2/c 1","-C 2yc","15","","dipotassium bis(2-[[2-[2-[2-[2-(2-hydroxyethoxy)]- phenoxy]ethoxy]phenoxy]ethoxy]methyl]benzoate) trihydrate","","- C52 H62 K2 O20 -","- C52 H52 K2 O24 -","- C208 H208 K8 O96 -","4","0.5","AS1158","Kasuga, N. C.; Yamaguchi, K.; Ohashi, Y.","Potassium Salt of a Synthetic Carboxylic Ionophore","Acta Crystallographica Section C","1995","51","9","1816","1819","10.1107/S0108270195003283","","","1.5418","CuKα","","","0.051","","","0.065","","","","","1.703","1.703","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003860","9.557","0.001","13.58","0.001","8.29","0.001","90.819","0.007","112.97","0.01","97.737","0.007","978.95","0.19","295","","","","","","","","","","recrystallized from ethanol solution","4","P -1","-P 1","2","","","","- C20 H28 N4 O2 -","- C20 H28 N4 O2 -","- C40 H56 N8 O4 -","2","1","AS1162","Nagahara, Y.; Hirayama, N.; Matsumiya, S.; Kono, M.; Shimada, J.; Suzuki, F.","8-(Noradamantan-3-yl)-1,3-dipropylxanthine","Acta Crystallographica Section C","1995","51","9","1955","1957","10.1107/S0108270195004021","","","1.54184","CuKα","","","0.076","","","0.0815","","","","","0.801","0.801","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2003861","7.64","0.001","8.804","0.001","32.126","0.002","90","","98.28","0.01","90","","2138.4","0.4","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2:1 theophylline-5FU complex H2O","","","- C18 H21 F N10 O7 -","- C18 H21 F N10 O7 -","- C72 H84 F4 N40 O28 -","4","1","AS1172","Zaitu, S.; Miwa, Y.; Taga, T.","A 2:1 Molecular Complex of Theophylline and 5-Fluorouracil as the Monohydrate","Acta Crystallographica Section C","1995","51","9","1857","1859","10.1107/S0108270195003295","","","1.54178","CuKα","","","0.059","","","0.072","","","","","1.19","1.19","","","","","has coordinates","190596","2020-10-21","18:00:00",""
"2003862","10.872","0.001","14.559","0.001","12.674","0.001","90","","100.27","0.01","90","","1974","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Phenyl-4-(2'-thienyl)-5,5-dicarbethoxypyrrolidin-2-one.","","- C20 H21 N O5 S -","- C20 H20.867 N O5 S -","- C80 H83.468 N4 O20 S4 -","4","1","AS1174","Kandasamy, S.; Fun, H.-K.; Ray, J. K.; Roy, B. C.; Nigam, G. D.","Diethyl 5-Oxo-1-phenyl-3-(2-thienyl)pyrrolidine-2,2-dicarboxylate, C~20~H~21~NO~5~S","Acta Crystallographica Section C","1995","51","9","1942","1944","10.1107/S0108270195003362","","","0.71073","MoKα","","0.073","0.0425","","0.1183","0.1071","","","","0.936","1.096","1.096","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003863","7.6582","0.0005","23.765","0.003","5.2255","0.0003","95.68","0.007","99.073","0.005","96.759","0.007","925.88","0.14","23","","23","","","","","","","","","5","P -1","-P 1","2","","","","- C17 H32 Cl N O -","- C17 H32 Cl N O -","- C34 H64 Cl2 N2 O2 -","2","1","AS1176","Vongbupnimit, K.; Noguchi, K.; Okuyama, K.","1-Dodecylpyridinium Chloride Monohydrate","Acta Crystallographica Section C","1995","51","9","1940","1941","10.1107/S0108270195004537","","","1.5418","CuKα","","","0.063","","","0.073","","","","","9.33","9.33","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003864","9.0653","0.0005","11.1733","0.0006","11.8981","0.0007","90","","91.253","0.005","90","","1204.86","0.12","296","","","","","","","","","","crystallized by slow evaporation from CH~2~Cl~2~/CH~3~OH","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H17 I N O3 P -","- C7 H17 I N O3 P -","- C28 H68 I4 N4 O12 P4 -","4","1","BK1019","Kumaravel, G.; Gandour, R. D.; Fronczek, F. R.","2,6,6-Trimethyl-2-oxo-1,3-dioxa-6-azonia-2-phosphocyclooctane Iodide","Acta Crystallographica Section C","1995","51","9","1919","1921","10.1107/S0108270195003556","","","0.71073","MoKα","","","0.033","","","0.04","","","","","2.074","2.074","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003865","22.662","0.005","7.671","0.001","18.443","0.001","90","","99.6","0.01","90","","3161.2","0.8","296","","","","","","","","","","National Cancer Institute, NSC 353648","3","C 1 2/c 1","-C 2yc","15","","","","- C18 H20 O4 -","- C18 H20 O4 -","- C144 H160 O32 -","8","1","BK1028","Ala, P.; Yang, D. S. C.","6-[1-(4-Ethoxyphenyl)ethyl]-5-methoxy-1,3-benzodioxole","Acta Crystallographica Section C","1995","51","9","1917","1919","10.1107/S0108270195003647","","","1.54178","CuKα","","","0.05","","","0.061","","","","","1.41","1.41","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003866","9.556","0.003","18.694","0.004","18.465","0.002","90","","95.77","0.01","90","","3281.9","1.3","295","1","295","5","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H20 O8 Ru3 -","- C36 H20 O8 Ru3 -","- C144 H80 O32 Ru12 -","4","1","BK1098","Capparelli, M. V.; De Sanctis, Y.; Arce, A. J.","Alkyne Coupling Induced by a Trinuclear Ruthenium Cluster: Synthesis and Structure of Di-μ-carbonyl-hexacarbonyl-μ~3~-(1,2,3,4-tetraphenyl-1,3-butadiene-1,4-diyl)-triruthenium(2 <i>Ru</i>—<i>Ru</i>), [Ru~3~(CO)~8~(C~4~Ph~4~)]","Acta Crystallographica Section C","1995","51","9","1819","1822","10.1107/S0108270195002861","","","0.7107","MoKα","","","0.0336","","","0.049","","","","","2.012","2.012","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003867","11.984","0.002","8.769","0.001","16.215","0.002","90","","91.24","0.02","90","","1703.6","0.4","294","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H17 N O4 S -","- C18 H17 N O4 S -","- C72 H68 N4 O16 S4 -","4","1","BK1102","Kumaradhas, P.; Nirmala, K. A.; Ravikumar, K.","<i>trans</i>-(±)-2-(4-Methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl Acetate","Acta Crystallographica Section C","1995","51","9","1932","1934","10.1107/S0108270195002654","","","0.7106","MoKα","","","0.039","","","0.048","","","","","0.91","0.91","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2003868","10.848","0.001","10.974","0.001","14.109","0.002","100.93","0.01","104.05","0.01","90.05","0.01","1597.9","0.3","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H24 Br N -","- C18 H24 Br N -","- C72 H96 Br4 N4 -","4","2","BK1104","Patrick, G. L.; Willis, A. C.","(±)-(4aα,4bβ,10bβ,12aβ)-9-Bromo-2-methyl-1,2,3,4,4a,4b,5,6,10b,11,12,12a-dodecahydronaphtho[2,1-<i>f</i>]isoquinoline Formed from the Acid-Catalyzed Cyclization of 5-[2-(4-Bromophenyl)ethyl]-2-methyl-1,2,3,4,5,6,7,8-octahydroisoquinoline","Acta Crystallographica Section C","1995","51","9","1937","1940","10.1107/S0108270195004975","","","0.71073","MoKα","","","0.039","","","0.048","","","","","1.56","1.56","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003869","5.0037","0.0007","10.594","0.0014","35.728","0.005","90","","93.689","0.011","90","","1890","0.5","298","","","","","","","","","","electrocrystallization","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H16 Ag F12 S16 -","- C28 H24 Ag F12 S16 -","- C56 H48 Ag2 F24 S32 -","2","0.5","BK1111","Geiser, U.; Schlueter, J. A.; Dudek, J. D.; Williams, J. M.; Naumann, D.; Roy, T.","Non-Superconducting Phase of Bis(3,4;3',4'-ethylenedithio)-2,2',5,5'-tetrathiafulvalene‒Tetrakis(trifluoromethyl)argentate(III) (2/1), (BEDT-TTF)~2~[Ag(CF~3~)~4~]","Acta Crystallographica Section C","1995","51","9","1779","1782","10.1107/S0108270195003064","","","0.7107","MoKα","","","0.039","","","0.038","","","","","1.85","1.85","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003870","13.782","0.001","29.581","0.002","5.502","0.003","90","","90","","90","","2243.1","1.2","173","1","173","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2,3,4,6-tetra-O-acetyl-N-β-D-glucopyranosyl-S-phenylsulfenamide","","- C20 H25 N O9 S -","- C20 H25 N O9 S -","- C80 H100 N4 O36 S4 -","4","1","BM1001","Lee, C. K.; Linden, A.; Vasella, A.","<i>N</i>-<small>D</small>-Glucopyranosyl-<i>S</i>-phenylsulfenamide: Structure and Evaluation as a Novel β-Glucosidase Inhibitor","Acta Crystallographica Section C","1995","51","9","1906","1910","10.1107/S0108270195005944","","","0.71073","MoKα","","0.0794","0.0452","","0.045","0.0416","","","","","1.505","1.505","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003871","9.3352","0.0006","19.2342","0.001","9.3903","0.0007","90","","93.039","0.006","90","","1683.71","0.19","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-methyl-6-(4-methylpiperazin-1-yl)-11H-pyrido[2,3-b][1,4]benzodiazepine","","- C18 H21 N5 -","- C18 H21 N5 -","- C72 H84 N20 -","4","1","BM1002","Dupont, L.; Liégeois, J.-F.; Rogister, F.; Delarge, J.","3-Methyl-6-(4-methylpiperazin-1-yl)-11<i>H</i>-pyrido[2,3-<i>b</i>][1,4]benzodiazepine","Acta Crystallographica Section C","1995","51","9","1889","1891","10.1107/S0108270195003337","","","1.5418","CuKα","","0.0775","0.0385","","0.1043","0.094","","","","0.897","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003872","6.721","0.001","9.002","0.002","22.914","0.005","90","","91.46","0.03","90","","1385.9","0.5","150","2","150","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Cyclohepta-3,5-dien-1-yl 3',5'-dinitrobenzoate","","- C14 H12 N2 O6 -","- C14 H12 N2 O6 -","- C56 H48 N8 O24 -","4","1","BM1005","Allen, F. H.; Howard, J. A. K.; Pitchford, N. A.; Steel, P. G.","Cyclohepta-3,5-dien-1-yl 3,5-Dinitrobenzoate","Acta Crystallographica Section C","1995","51","9","1946","1949","10.1107/S0108270195003957","","","0.71073","MoKα","","0.1115","0.0518","","0.2078","0.1431","","","","1.063","1.168","1.168","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003873","15.307","0.003","7.018","0.001","17.014","0.006","90","","107.61","0.02","90","","1742.1","0.8","140","0.2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-Methoxy-3-(3'4'5'-trimethoxyphenyl)-5,6-methylenedioxy-1,3- dihydroisobenzofuran","","- C19 H20 O7 -","- C19 H20 O7 -","- C76 H80 O28 -","4","1","BM1006","Hibbs, D. E.; Hursthouse, M. B.; Malik, K. M. A.; Ward, R. S.; Pelter, A.; Qianrong, L.","1-Methoxy-5,6-methylenedioxy-3-(3,4,5-trimethoxyphenyl)-1,3-dihydroisobenzofuran","Acta Crystallographica Section C","1995","51","9","1891","1893","10.1107/S0108270195004689","","","0.71069","MoKα","","0.0571","0.0363","","0.1137","0.0852","","","","0.52","0.515","0.515","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003874","12.069","0.001","12.6","0.002","13.556","0.002","87.97","0.01","67.36","0.01","80.19","0.01","1873.7","0.5","150","0.2","150","2","","","","","","","","8","P -1","-P 1","2","","aquacarbonylbis(triphenylarsine)rhodium(I) tetrafluoroborate dichloromethane (1/1)","","- C38 H34 As2 B Cl2 F4 O2 Rh -","- C38 H34 As2 B Cl2 F4 O2 Rh -","- C76 H68 As4 B2 Cl4 F8 O4 Rh2 -","2","1","BM1007","Hursthouse, M. B.; Malik, K. M. A.; Evans, E. W.; Howlader, M. B. H.; Atlay, M. T.","<i>trans</i>-Aquacarbonylbis(triphenylarsine)rhodium(I) Tetrafluoroborate Dichloromethane Solvate (1/1)","Acta Crystallographica Section C","1995","51","9","1782","1784","10.1107/S0108270195004082","","","0.71069","MoKα","","0.0568","0.0287","","0.1209","0.0724","","","","0.341","0.302","0.302","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2003875","6.8923","0.0011","12.836","0.002","17.387","0.003","90","","90","","90","","1538.2","0.4","240","2","240","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","S-(4''-methylphenyl)(2'R,4R)-2'-bromo-2'-(2,2-dimethyl-1,3-dioxolan- 4-yl)ethanethiolate","","- C14 H17 Br O3 S -","- C14 H17 Br O3 S -","- C56 H68 Br4 O12 S4 -","4","1","BM1008","Clegg, W.; Dunbar, J. M.; Elsegood, M. R. J.; Jackson, R. F. W.; Palmer, N. J.","Two Products of Ring Opening Reactions of an Arylthionitrooxirane","Acta Crystallographica Section C","1995","51","9","1950","1953","10.1107/S0108270195004276","","","0.71073","MoKα","","0.0616","0.0372","","0.1059","0.0926","","","","1.071","1.067","1.067","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003876","5.584","0.002","9.042","0.003","10.902","0.003","77.06","0.03","78.75","0.02","87.98","0.03","526.1","0.3","160","2","160","2","","","","","","","","5","P 1","P 1","1","","S-(4''-methylphenyl)(2'R,4S)-2'-(benzyloxycarbonylamino)- 2'-(2,2-dimethyl-1,3-dioxolan-4-yl)ethanethiolate","","- C22 H25 N O5 S -","- C22 H25 N O5 S -","- C22 H25 N O5 S -","1","1","BM1008","Clegg, W.; Dunbar, J. M.; Elsegood, M. R. J.; Jackson, R. F. W.; Palmer, N. J.","Two Products of Ring Opening Reactions of an Arylthionitrooxirane","Acta Crystallographica Section C","1995","51","9","1950","1953","10.1107/S0108270195004276","","","0.71073","MoKα","","0.049","0.0431","","0.1246","0.1158","","","","1.121","1.088","1.088","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003877","10.671","0.001","11.218","0.001","15.953","0.002","106.35","0.01","105.14","0.01","98.66","0.01","1716.3","0.4","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- Cs6 H14 Mo7 O31 -","- Cs6 Mo7 O31 -","- Cs12 Mo14 O62 -","2","1","BR1105","Kortz, U.; Pope, M. T.","Cs~6~[Mo~7~O~24~].7H~2~O","Acta Crystallographica Section C","1995","51","9","1717","1719","10.1107/S010827019500494X","","","0.71073","MoKα","","","0.05","","","0.132","","","","","1.123","1.123","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003878","20.569","0.008","11.3","0.006","19.179","0.007","90","0.03","96.21","0.02","90","0.04","4432","3","100","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","7,16-dihydro-2,3,6,8,11,12,15,17-octamethyldibenzo[b,i][1,4,8,11]- tetraazacyclotetradecine","","- C26 H32 N4 -","- C26 H32 N4 -","- C208 H256 N32 -","8","1","CR1112","Buzatu, D. A.; Nolan, S. P.; Stevens, E. D.","An Octamethyldibenzotetraaza[14]annulene","Acta Crystallographica Section C","1995","51","9","1855","1857","10.1107/S0108270194014708","","","0.71073","MoKα","","","0.037","","","0.044","","","","","1.911","1.911","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2003879","8.871","0.002","7.397","0.002","20.393","0.004","90","","93.83","0.02","90","","1335.2","0.5","293","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C9 H20 N4 O4 -","- C9 H20 N4 O4 -","- C36 H80 N16 O16 -","4","1","CR1118","Zhou, K.-J.; Di Maio, G.; Portalone, G.; Li, S.","4-Acetamidocyclohexanone Semicarbazone Dihydrate","Acta Crystallographica Section C","1995","51","9","1844","1846","10.1107/S0108270195002137","","","0.71069","MoKα","","","0.064","","","0.066","","","","","1.79","1.79","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003880","6.2543","0.0001","6.2543","0.0001","12.332","0.0003","90","","90","","120","","417.755","0.014","295","","295","","","","","","","","","3","P 63 2 2","P 6c 2c","182","","SrTa4O11","","- O11 Sr Ta4 -","- O11 Sr Ta4 -","- O22 Sr2 Ta8 -","2","0.166667","CR1170","Heunen, G. W. J. C.; IJdo, D. J. W.; Helmholdt, R. B.","SrTa~4~O~11~: a Rietveld Refinement Using Neutron Powder Diffraction Data","Acta Crystallographica Section C","1995","51","9","1723","1725","10.1107/S0108270195004264","","neutron","2.57167","Neutron","","0.0243","","","0.031","","","","","1.79","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003881","18.499","0.004","6.2149","0.0009","26.45","0.01","90","","103.16","0.03","90","","2961.1","1.4","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 N2 O2 -","- C17 H20 N2 O2 -","- C136 H160 N16 O16 -","8","2","CR1197","Marsh, R. E.","On the Structure of (13-Methyl-1,4,7,8,13,13b-hexahydro[1',2']oxazepino[2',3':1,2]pyrido[3,4-<i>b</i>]indol-1-yl)methanol","Acta Crystallographica Section C","1995","51","9","1957","1958","10.1107/S0108270195006032","","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003882","14.285","0.007","14.285","0.007","7.227","0.003","90","","90","","90","","1474.8","1.2","370","","370","","","","","","","","melting and slow cooling","3","I 4/m","-I 4","","","","","- Al3 F19 Pb5 -","- Al3 F19 Pb5 -","- Al12 F76 Pb20 -","4","0.25","DU1109","Sarraute, S.; Ravez, J.; Bravic, G.; Chasseau, D.; Abrahams, S. C.","Paraelastic Pb~5~Al~3~F~19~ at 370 K","Acta Crystallographica Section C","1995","51","9","1731","1732","10.1107/S0108270195001879","","","0.71073","MoKα","","","0.053","","","0.058","","","","","1.12","1.12","","","","","has coordinates","281832","2023-03-13","07:39:36",""
"2003883","9.526","0.002","10.194","0.002","16.391","0.004","90","","90","","90","","1591.7","0.6","293","2","293","2","","","","","","","from benzene","5","P 21 21 21","P 2ac 2ab","19","","2-(diphenylphosphine sulfide)cyclohexanone","","- C18 H19 O P S -","- C18 H19 O P S -","- C72 H76 O4 P4 S4 -","4","1","DU1112","Boukraa, M.; Jouini, T.; Barkallah, S.; Ben Akacha, A.; Zantour, H.; Baccar, B.","Diphenyl(2-oxocyclohexyl)phosphine Sulfide","Acta Crystallographica Section C","1995","51","9","1851","1853","10.1107/S0108270195001557","","","0.71069","MoKα","","0.0577","0.0503","","0.1313","0.1257","","","","1.058","1.09","1.09","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003884","6.2983","0.0003","9.5537","0.0009","10.4499","0.0006","90","","90","","90","","628.79","0.08","293","","","","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- K4 O12 Si4 Zn2 -","- K4 O12 Si4 Zn2 -","- K8 O24 Si8 Zn4 -","2","0.25","DU1113","Hogrefe, A. R.; Czank, M.","Synthetic Dipotassium Zinc Disilicate","Acta Crystallographica Section C","1995","51","9","1728","1730","10.1107/S0108270195003052","","","0.71069","MoKα","","","0.0541","","","0.0365","","","","","6.016","6.016","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003885","8.641","0.001","8.76","0.001","24.335","0.003","90","","90","","90","","1842","0.4","293","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- Cr0.4 Li1.14 Nb0.93 O12 P3 Sc0.67 -","- Cr0.394 Li1.5 Nb0.932 O12 P3 Sc0.674 -","- Cr3.152 Li12 Nb7.456 O96 P24 Sc5.392 -","8","1","DU1115","Rivier, S.; Angenault, J.; Couturier, J.-C.; Robert, F.; Quarton, M.","Li~1.14~Nb~0.93~Sc~0.67~Cr~0.40~(PO~4~)~3~","Acta Crystallographica Section C","1995","51","9","1735","1737","10.1107/S0108270195003088","","","0.71069","MoKα","","","0.03","","","0.033","","","","","2.54","2.54","","","","","has coordinates","176342","2020-10-21","18:00:00",""
"2003886","6.7156","0.0005","9.8164","0.0007","10.098","0.0005","66.884","0.004","73.282","0.005","73.301","0.006","574.76","0.07","293","2","293","2","","","","","","","synth\`ese","5","P -1","-P 1","2","","Orthophénylènediammonium Bis(dihydrogénophosphate)","","- C6 H14 N2 O8 P2 -","- C6 H14 N2 O8 P2 -","- C12 H28 N4 O16 P4 -","2","1","DU1120","Soumhi, E. H.; Jouini, T.","Orthophénylènediammonium Bis(dihydrogénophosphate)","Acta Crystallographica Section C","1995","51","9","1883","1885","10.1107/S0108270195004173","","","0.71069","MoKα","","0.0341","0.0304","","0.0815","0.0793","","","","1.08","1.112","1.112","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003887","10.92","0.001","16.409","0.003","7.753","0.006","90","","93.89","0.03","90","","1386","1.1","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[(H)N2-ethyl]CoCl~3~","Trichloro [N-(2-benzimidazolylmethyl)ethylammonium-N']cobalt(II)","","- C10 H14 Cl3 Co N3 -","- C10 H14 Cl3 Co N3 -","- C40 H56 Cl12 Co4 N12 -","4","1","FG1022","Cooley, J. A.; Kamaras, P.; Rapta, M.; Jameson, G. B.","Trichloro[(1<i>H</i>-benzimidazol-2-ylmethyl)(ethyl)ammonium-<i>N</i>^3^]cobalt(II)","Acta Crystallographica Section C","1995","51","9","1811","1813","10.1107/S0108270195003349","","","0.71073","MoKα","","0.0329","0.03","","0.0861","0.0817","","","","1.046","1.058","1.058","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003888","12.06","0.003","10.027","0.008","8.046","0.002","76.36","0.05","89.08","0.02","66.09","0.04","860.9","0.8","293","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C37 H20 Cl3 N2 Na O9 Zn2 -","- C37 H16 Cl3 N2 Na O9 Zn2 -","- C37 H16 Cl3 N2 Na O9 Zn2 -","1","0.5","FG1024","Davies, P. J.; Taylor, M. R.; Wainwright, K. P.; Kobus, H. J.","Zinc(II) Chloride‒Methanol Complex of 2-[(1,3-Dihydro-1,3-dioxo-2<i>H</i>-inden-2-ylidene)amino]-1<i>H</i>-indene-1,3(2<i>H</i>)-dionate(1‒) Sodium Salt: a Complex of Ruhemann's Purple","Acta Crystallographica Section C","1995","51","9","1802","1805","10.1107/S0108270195003325","","","0.7107","MoKα","","0.058","0.048","","0.048","0.041","","","","3.9","3.624","3.624","","","","","has coordinates","192027","2020-10-21","18:00:00",""
"2003889","6.591","0.004","12.222","0.002","17.254","0.004","90","","96.78","0.03","90","","1380.2","0.9","293","","293","","","","","","","","Crystals were obtained by slow evaporation of an aqueous solution that was 0.64 M in each of zinc(II) chloride, hydrochloric acid and purine.","5","C 1 c 1","C -2yc","9","","Dichlorobis(purine)zinc(II)","","- C10 H8 Cl2 N8 Zn -","- C10 H8 Cl2 N8 Zn -","- C40 H32 Cl8 N32 Zn4 -","4","1","FG1031","Laity, H. L.; Taylor, M. R.","Dichlorobis(purine)zinc(II)","Acta Crystallographica Section C","1995","51","9","1791","1793","10.1107/S0108270195004227","","","0.71073","MoKα","","0.047","0.04","","0.034","0.033","","","","1.391","1.443","1.443","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003890","7.194","0.001","11.741","0.002","10.63","0.002","90","","97.08","0.01","90","","891","0.3","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H24 N8 P2 Pt -","- C14 H24 N8 P2 Pt -","- C28 H48 N16 P4 Pt2 -","2","0.5","FG1042","Assefa, Z.; McBurnett, B. G.; Staples, R. J.; Fackler, Jnr, J. P.","<i>trans</i>-Dicyanobis(1,3,5-triaza-7-phosphaadamantane)platinum(II), [(TPA)~2~Pt(CN)~2~]","Acta Crystallographica Section C","1995","51","9","1742","1743","10.1107/S0108270195002915","","","0.71073","MoKα","","","0.0331","","","0.0442","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003891","11.154","0.002","15.059","0.003","14.641","0.003","90","","90.37","0.02","90","","2459.2","0.8","173","2","173","2","","","","","","","tetrahydrofuran","6","P 1 21/c 1","-P 2ybc","14","","1,1'-Bis(trimethylsilyl)ferrocenium Aluminum Tetrachloride","","- C16 H26 Al Cl4 Fe Si2 -","- C16 H26 Al Cl4 Fe Si2 -","- C64 H104 Al4 Cl16 Fe4 Si8 -","4","1","FG1056","Foucher, D. A.; Honeyman, C. H.; Lough, A. J.; Manners, I.; Nelson, J. M.","1,1'-Bis(trimethylsilyl)ferrocenium Tetrachloroaluminate(1‒), 1,1'-Bis(trimethylsilyl)ferrocene and 1,1'-Dimethylferrocene","Acta Crystallographica Section C","1995","51","9","1795","1799","10.1107/S0108270195003155","","","0.71073","MoKα","","0.099","0.0522","","0.0808","0.0692","","","","","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003892","6.173","0.002","8.103","0.001","16.915","0.003","90","","95.69","0.02","90","","841.9","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,1'-Bis(trimethylsilyl)ferrocene","","- C16 H26 Fe Si2 -","- C16 H26 Fe Si2 -","- C32 H52 Fe2 Si4 -","2","0.5","FG1056","Foucher, D. A.; Honeyman, C. H.; Lough, A. J.; Manners, I.; Nelson, J. M.","1,1'-Bis(trimethylsilyl)ferrocenium Tetrachloroaluminate(1‒), 1,1'-Bis(trimethylsilyl)ferrocene and 1,1'-Dimethylferrocene","Acta Crystallographica Section C","1995","51","9","1795","1799","10.1107/S0108270195003155","","","0.71073","MoKα","","0.0313","0.0279","","0.0819","0.08","","","","1.054","1.086","1.086","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003893","12.19","0.002","7.466","0.002","10.839","0.002","90","","103.25","0.03","90","","960.2","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1'-Dimethylferrocene","","- C12 H14 Fe -","- C12 H14 Fe -","- C48 H56 Fe4 -","4","1","FG1056","Foucher, D. A.; Honeyman, C. H.; Lough, A. J.; Manners, I.; Nelson, J. M.","1,1'-Bis(trimethylsilyl)ferrocenium Tetrachloroaluminate(1‒), 1,1'-Bis(trimethylsilyl)ferrocene and 1,1'-Dimethylferrocene","Acta Crystallographica Section C","1995","51","9","1795","1799","10.1107/S0108270195003155","","","0.71073","MoKα","","0.0724","0.0434","","0.0577","0.0523","","","","","1.22","1.22","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003894","9.126","0.001","12.631","0.001","24.532","0.004","97.32","0.01","99.59","0.01","105.46","0.01","2643.1","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","cis-Diethyldithiocarbamatodiiodophenyltellurium(IV)","","- C11 H15 I2 N S2 Te -","- C11 H15 I2 N S2 Te -","- C66 H90 I12 N6 S12 Te6 -","6","3","FG1060","Husebye, S.; Kudis, S.; Lindeman, S. V.; Strauch, P.","<i>cis</i>-(Diethyldithiocarbamato)diiodo(phenyl)tellurium(IV), PhTe(S~2~CNEt~2~)I~2~, and its Methoxy-Substituted Mixed Br/I Analogue <i>cis</i>-Bis(0.4-bromo/0.6-iodo)(diethyldithiocarbamato)(4-methoxyphenyl)tellurium(IV), <i>p</i>-MeOC~6~H~4~Te(S~2~CNEt~2~)(Br~0.4~I~0.6~)~2~","Acta Crystallographica Section C","1995","51","9","1870","1875","10.1107/S0108270195004239","","","0.71069","MoKα","","0.0946","0.0465","","0.1411","0.1138","","","","1.076","1.221","1.221","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003895","9.9482","0.0012","10.428","0.003","11.004","0.002","66.95","0.02","65.934","0.011","75.94","0.02","954.4","0.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","cis-Bis(0.4bromo/0.6iodo)diethyldithiocarbamato-4-methoxyphenyltellurium(IV)","","- C12 H17 Br0.8 I1.2 N O S2 Te -","- C12 H17 Br0.8 I1.2 N O S2 Te -","- C24 H34 Br1.6 I2.4 N2 O2 S4 Te2 -","2","1","FG1060","Husebye, S.; Kudis, S.; Lindeman, S. V.; Strauch, P.","<i>cis</i>-(Diethyldithiocarbamato)diiodo(phenyl)tellurium(IV), PhTe(S~2~CNEt~2~)I~2~, and its Methoxy-Substituted Mixed Br/I Analogue <i>cis</i>-Bis(0.4-bromo/0.6-iodo)(diethyldithiocarbamato)(4-methoxyphenyl)tellurium(IV), <i>p</i>-MeOC~6~H~4~Te(S~2~CNEt~2~)(Br~0.4~I~0.6~)~2~","Acta Crystallographica Section C","1995","51","9","1870","1875","10.1107/S0108270195004239","","","0.71069","MoKα","","0.0555","0.0427","","0.1492","0.1245","","","","1.059","1.108","1.108","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003896","7.374","0.004","7.469","0.004","9.598","0.004","117.57","0.03","72.19","0.04","96.81","0.04","446","0.4","293","","","","","","","","","","synthesis","6","P -1","-P 1","2","","","","- C12 H30 Cl2 N2 Ni O6 -","- C12 H30 Cl2 N2 Ni O6 -","- C12 H30 Cl2 N2 Ni O6 -","1","0.5","HR1050","İçbudak, H.; Yilmaz, V. T.; Howie, R. A.; Andaç, Ö.; Ölmez, H.","Bis[tris(2-hydroxyethyl)amine]nickel(II) Chloride","Acta Crystallographica Section C","1995","51","9","1759","1761","10.1107/S0108270195001600","","","0.71073","MoKα","","","0.038","","","0.044","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003897","7.046","0.002","9.919","0.003","10.392","0.003","90","","109.8","0.02","90","","683.4","0.4","295","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H12 Cu2 N6 O2 S2 -","- C8 H12 Cu2 N6 O2 S2 -","- C16 H24 Cu4 N12 O4 S4 -","2","0.5","HU1106","Chen, Z. N.; Qiu, J.; Tang, W. X.; Yu, K. B.","A Dinuclear Copper(II) Complex Bridged by a <i>trans</i>-Oxamidate Ligand","Acta Crystallographica Section C","1995","51","9","1809","1811","10.1107/S0108270195002782","","","0.71073","MoKα","","","0.0288","","","0.0316","","","","","1.157","1.157","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003898","5.114","0.005","10.896","0.003","20.883","0.006","90","","90","","90","","1163.6","1.2","293","","","","","","","","","","","4","P c 21 n","P -2n -2ac","33","","","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","1","HU1117","Lyubchova, A.; Cossé-Barbi, A.; Doucet, J. P.; Robert, F.; Souron, J.-P.; Quarton, M.","Salicylaldehyde Benzoyl Hydrazone","Acta Crystallographica Section C","1995","51","9","1893","1895","10.1107/S0108270195003076","","","0.71069","MoKα","","","0.035","","","0.033","","","","","1.47","1.47","","","","","has coordinates","198480","2020-10-21","18:00:00",""
"2003899","16.381","0.005","6.111","0.001","5.896","0.001","90","","90","","90","","590.2","0.2","295","","295","","","","","","","","","4","P b c n","-P 2n 2ab","60","Lead(II) hydrogenselenite","Lead(II) bis(hydrogenselenate(IV))","","- H2 O6 Pb Se2 -","- O6 Pb Se2 -","- O24 Pb4 Se8 -","4","0.5","HU1127","Koskenlinna, M.; Valkonen, J.","Lead(II) Hydrogenselenite","Acta Crystallographica Section C","1995","51","9","1737","1739","10.1107/S0108270195003441","","","0.71073","MoKα","","","0.032","","","0.04","","","","","0.46","0.46","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003900","17.862","0.004","6.849","0.002","23.065","0.002","90","","102.14","0.01","90","","2758.6","1","299","1","","","","","","","","","evaporation of aqueous solution","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H13 As N6 O5 -","- C9 H9 As N6 O5 -","- C72 H72 As8 N48 O40 -","8","1","HU1147","Leonard, G. A.; Hunter, W. N.; Berger, B. J.; Fairlamb, A. H.","<i>p</i>-(4,6-Diamino-<i>s</i>-triazin-2-yl)aminophenylarsonic Acid Dihydrate","Acta Crystallographica Section C","1995","51","9","1953","1955","10.1107/S0108270195003453","","","1.5418","CuKα","","","0.075","","","0.098","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003901","8.311","0.001","17.111","0.001","20.5","0.002","90","","101.44","0.01","90","","2857.4","0.5","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31.5 H33 O5 V Zr -","- C31.5 H33 O5 V Zr -","- C126 H132 O20 V4 Zr4 -","4","1","JZ1002","Grehl, M.; Berlekamp, M.; Erker, G.","A Nine-Membered Metallacyclic Metalloxycarbene Vanadium Complex","Acta Crystallographica Section C","1995","51","9","1772","1774","10.1107/S0108270195002435","","","0.71073","MoKα","","","0.061","","","0.091","","","","","1.268","1.268","","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2003902","11.783","0.001","16.365","0.004","8.981","0.001","90","","90","","90","","1731.8","0.5","293","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C10 H25 Cl Cr N5 O8 -","- C10 H25 Cl Cr N5 O8 -","- C40 H100 Cl4 Cr4 N20 O32 -","4","1","JZ1012","Choi, J.-H.; Suh, I.-H.; Kwak, S.-H.","[Bis(3-aminopropyl)amine-<i>N</i>,<i>N</i>',<i>N</i>''][glycylglycinato(2‒)-<i>N</i>,<i>N</i>',<i>O</i>]chromium(III) Perchlorate Monohydrate, [Cr(C~4~H~6~N~2~O~3~)(C~6~H~17~N~3~)]ClO~4~.H~2~O","Acta Crystallographica Section C","1995","51","9","1745","1748","10.1107/S0108270195002800","","","0.71073","MoKα","","","0.0416","","","0.0416","","","","","1.4815","1.4815","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2003903","12.811","0.003","10.122","0.001","13.176","0.005","90","","95.37","0.03","90","","1701.1","0.8","298","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 Ir N O2 S -","- C17 H18 Ir N O2 S -","- C68 H72 Ir4 N4 O8 S4 -","4","1","JZ1014","Theron, M.; Basson, S. S.; Purcell, W.","(η^4^-1,5-Cyclooctadiene)(<i>N</i>-hydroxy-4-methoxy-<i>N</i>-methylthiobenzamido-<i>O</i>,<i>S</i>)iridium(I)","Acta Crystallographica Section C","1995","51","9","1750","1752","10.1107/S0108270195002666","","","0.71073","MoKα","","","0.032","","","0.032","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003904","24.699","0.002","7.343","0.001","12.748","0.002","90","","90","","90","","2312","0.5","100","2","100","2","","","","","","","ethanol","4","P c a 21","P 2c -2ac","29","","Trimethylphenyphosphoniumiodide","","- C9 H14 I P -","- C9 H14 I P -","- C72 H112 I8 P8 -","8","2","JZ1022","Schödel, H.; Näther, C.; Bock, H.","Two Trimethylphenylphosphonium Iodides","Acta Crystallographica Section C","1995","51","9","1841","1844","10.1107/S0108270194015052","","","0.71073","MoKα","","0.0343","0.0201","","0.0507","0.0481","","","","1.039","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003905","6.033","0.001","8.048","0.001","27.348","0.005","90","","91.3","0.02","90","","1327.5","0.4","100","2","100","2","","","","","","","ethanol","5","P 1 21/c 1","-P 2ybc","14","","Trimethyl(p-N,N-dimethylamino)phenylphosphoniumiodide","","- C11 H19 I N P -","- C11 H19 I N P -","- C44 H76 I4 N4 P4 -","4","1","JZ1022","Schödel, H.; Näther, C.; Bock, H.","Two Trimethylphenylphosphonium Iodides","Acta Crystallographica Section C","1995","51","9","1841","1844","10.1107/S0108270194015052","","","0.71073","MoKα","","0.0338","0.0213","","0.0555","0.0508","","","","1.024","1.081","1.081","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003906","6.846","0.001","8.076","0.001","12.741","0.002","89.99","0.01","83.09","0.01","82.77","0.01","693.67","0.17","200","2","200","2","","","","","","","dimethylsufoxide/water","5","P -1","-P 1","2","N,N'-ditosyl-p-phenylenediamine","","","- C24 H32 N2 O6 S4 -","- C24 H32 N2 O6 S4 -","- C24 H32 N2 O6 S4 -","1","0.5","JZ1032","Nagel, N.; Näther, C.; Bock, H.","<i>N</i>,<i>N</i>'-Ditosyl-<i>p</i>-phenylenediamine Bis(dimethyl sulfoxide), C~20~H~20~N~2~O~4~S~2~.2C~2~H~6~OS","Acta Crystallographica Section C","1995","51","9","1935","1937","10.1107/S0108270195004884","","","0.71073","MoKα","","0.0378","0.0316","","0.0918","0.0872","","","","1.067","1.09","1.09","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003907","8.656","0.001","11.81","0.01","13.521","0.001","78.93","0.02","82.28","0.01","86.13","0.02","1343","1.2","293","2","293","2","","","","","","","crystallized from acetonitrile","5","P -1","-P 1","2","","","","- C34 H24 N2 O2 S2 -","- C34 H24 N2 O2 S2 -","- C68 H48 N4 O4 S4 -","2","1","JZ1033","Elmali, A.; Özbey, S.; Kendi, E.; Kabak, M.; Elerman, Y.","<i>N</i>,<i>N</i>'-[Dithiobis(<i>o</i>-phenylene)]bis(2-hydroxy-1-naphthaldimine)","Acta Crystallographica Section C","1995","51","9","1878","1880","10.1107/S010827019500285X","","","0.71069","MoKα","","0.0509","0.0459","","0.1159","0.1141","","","","2.828","3.051","3.051","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003908","7.27","0.001","7.076","0.004","11.227","0.001","90","","100.57","0.01","90","","567.7","0.3","293","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H11 Cl N2 O -","- C12 H11 Cl N2 O -","- C24 H22 Cl2 N4 O2 -","2","1","JZ1037","Moreau, S.; Metin, J.; Coudert, P.; Couquelet, J.","5-(2-Chlorobenzyl)-6-methyl-3(2<i>H</i>)-pyridazinone","Acta Crystallographica Section C","1995","51","9","1834","1836","10.1107/S0108270195002757","","","0.71069","MoKα","","","0.051","","","0.054","","","","","1.67","1.67","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003909","14.46","0.001","13.158","0.002","31.733","0.005","90","","94.13","0.01","90","","6022","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","not as in title!","","- C25 H11 Mn O13 P2 Re2 -","- C25 H10 Mn O13 P2 Re2 -","- C200 H80 Mn8 O104 P16 Re16 -","8","2","JZ1040","Flörke, U.; Haupt, H.-J.","μ-Phenylphosphido-μ-[(pentacarbonylmanganese)phenylphosphido]-bis(tetracarbonylrhenium)","Acta Crystallographica Section C","1995","51","9","1776","1778","10.1107/S0108270195003969","","","0.71073","MoKα","","0.1036","0.0548","","0.1215","0.1044","","","","1.045","1.172","1.172","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003910","13.622","0.001","13.622","0.001","36.47","0.002","90","","90","","120","","5860.7","0.7","211","","","","","","","","","","","7","R -3 :H","-R 3","148","","","","- C27 H63 Au3 B F4 O P3 -","- C27 H63 Au3 B0.5 F4 O P3 -","- C162 H378 Au18 B3 F24 O6 P18 -","6","0.333333","JZ1042","Angermaier, K.; Schmidbaur, H.","μ~3~-Oxo-tris[(triisopropylphosphine)gold(I)] Tetrafluoroborate","Acta Crystallographica Section C","1995","51","9","1793","1795","10.1107/S0108270195003787","","","0.71073","MoKα","","","0.0309","","","0.0344","","","","","0.89","0.89","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003911","23.875","0.011","22.954","0.01","11.877","0.005","90","","90","","90","","6509","5","293","","","","","","","","","","crystallization from ethanol/water","5","F d d 2","F 2 -2d","43","","","","- C16 H20 N6 O4 S -","- C17 H14 N6 O4 S -","- C272 H224 N96 O64 S16 -","16","1","KA1042","Kettmann, V.; Bozóová, A.; Rybár, A.","9,9'-Thiobis(1,2,3,4,7,8-hexahydro-7-methyl-6<i>H</i>-pyrimido[1,6-<i>a</i>]pyrimidine-6,8-dione)","Acta Crystallographica Section C","1995","51","9","1861","1864","10.1107/S0108270194000090","","","0.71073","MoKα","","","0.052","","","0.055","","","","","1.45","1.45","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003912","15.397","0.004","9.696","0.003","12.14","0.003","90","","104.43","0.02","90","","1755.2","0.8","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H15 F3 N4 O -","- C19 H15 F3 N4 O -","- C76 H60 F12 N16 O4 -","4","1","KA1108","Karolak-Wojciechowska, J.; Trzezwinska, H. B.; Lange, J.; Wieczorek, M.","Bicyclic [<i>b</i>]-Heteroannulated Pyridazine Derivatives. 3. Partially Hydrogenated Triazolo[4,3-<i>b</i>]pyridazines","Acta Crystallographica Section C","1995","51","9","1829","1832","10.1107/S0108270195002848","","","1.54178","CuKα","","","0.073","","","0.071","","","","","5.4","5.4","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003913","13.291","0.002","16.973","0.003","8.741","0.001","90","","114.16","0.01","90","","1799.1","0.5","293","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C19 H15 F3 N4 O -","- C19 H15 F3 N4 O -","- C76 H60 F12 N16 O4 -","4","1","KA1108","Karolak-Wojciechowska, J.; Trzezwinska, H. B.; Lange, J.; Wieczorek, M.","Bicyclic [<i>b</i>]-Heteroannulated Pyridazine Derivatives. 3. Partially Hydrogenated Triazolo[4,3-<i>b</i>]pyridazines","Acta Crystallographica Section C","1995","51","9","1829","1832","10.1107/S0108270195002848","","","1.54178","CuKα","","","0.053","","","0.059","","","","","6.3","6.3","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003914","11.918","0.004","12.296","0.003","11.193","0.005","90","","90.65","0.03","90","","1640.2","1","293","","","","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H14 Cl N3 O2 -","- C19 H14 Cl N3 O2 -","- C76 H56 Cl4 N12 O8 -","4","1","KA1109","Karolak-Wojciechowska, J.; Kiec-Kononowicz, K.","(<i>Z</i>)-1-Ethyl-3-(4-chlorobenzylidene)-1,2,3,5-tetrahydroimidazo[2,1-<i>b</i>]quinazoline-2,5-dione","Acta Crystallographica Section C","1995","51","9","1833","1834","10.1107/S0108270195002836","","","1.54184","CuKα","","","0.072","","","0.067","","","","","4.84","4.84","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003915","6.453","0.002","9.997","0.002","20.114","0.004","90","","90.38","0.01","90","","1297.5","0.5","293","","293","","","","","","","","","4","P 1 21/c 1","","","","","","- C15 H15 N O2 -","- C18.75 H18.75 N1.25 O2.5 -","- C75 H75 N5 O10 -","4","1","KA1112","Kaitner, B.; Pavlovic, G.","<i>N</i>-<i>p</i>-Tolylvanillaldimine, C~15~H~15~NO~2~","Acta Crystallographica Section C","1995","51","9","1875","1878","10.1107/S0108270195002824","","","0.7093","MolybdenumKα","","","0.048","","","0.085","","","","","1.27","1.27","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003916","7.4728","0.0014","7.0341","0.0012","12.356","0.002","90","","92.9","0.02","90","","648.7","0.2","240","2","240","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(1S,2S,4R,4'S)-4'-chloromethyl-4,7,7-trimethylbicyclo[2.2.1]heptane- 2-spiro-2'-(1',3'-dioxolan)-3-one","","- C13 H19 Cl O3 -","- C13 H19 Cl O3 -","- C26 H38 Cl2 O6 -","2","1","KA1114","Clegg, W.; Golding, B. T.; King, B. J.; Maude, A. B.","Four Isomeric Dioxolane Derivatives of <small>D</small>-Camphorquinone","Acta Crystallographica Section C","1995","51","9","1825","1829","10.1107/S0108270195001788","","","0.71073","MoKα","","0.0316","0.0282","","0.0788","0.0762","","","","1.054","1.054","1.054","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003917","7.22","0.0013","7.6439","0.0015","12.148","0.003","90","","93.9","0.02","90","","668.9","0.2","240","2","240","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(1S,2S,4R,4'R)-4'-chloromethyl-4,7,7-trimethylbicyclo[2.2.1]heptane- 2-spiro-2'-(1',3'-dioxolan)-3-one","","- C13 H19 Cl O3 -","- C13 H19 Cl O3 -","- C26 H38 Cl2 O6 -","2","1","KA1114","Clegg, W.; Golding, B. T.; King, B. J.; Maude, A. B.","Four Isomeric Dioxolane Derivatives of <small>D</small>-Camphorquinone","Acta Crystallographica Section C","1995","51","9","1825","1829","10.1107/S0108270195001788","","","0.71073","MoKα","","0.0303","0.0284","","0.0776","0.0756","","","","1.091","1.088","1.088","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003918","7.0866","0.0014","7.813","0.002","23.956","0.004","90","","90","","90","","1326.4","0.5","240","2","240","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1S,2R,4R,4'R)-4'-chloromethyl-4,7,7-trimethylbicyclo[2.2.1]heptane- 2-spiro-2'-(1',3'-dioxolan)-3-one","","- C13 H19 Cl O3 -","- C13 H19 Cl O3 -","- C52 H76 Cl4 O12 -","4","1","KA1114","Clegg, W.; Golding, B. T.; King, B. J.; Maude, A. B.","Four Isomeric Dioxolane Derivatives of <small>D</small>-Camphorquinone","Acta Crystallographica Section C","1995","51","9","1825","1829","10.1107/S0108270195001788","","","0.71073","MoKα","","0.0372","0.0285","","0.0806","0.0714","","","","1.066","1.046","1.046","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003919","7.364","0.002","7.484","0.002","24.168","0.005","90","","90","","90","","1332","0.6","240","2","240","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1S,2R,4R,4'S)-4'-chloromethyl-4,7,7-trimethylbicyclo[2.2.1]heptane- 2-spiro-2'-(1',3'-dioxolan)-3-one","","- C13 H19 Cl O3 -","- C13 H19 Cl O3 -","- C52 H76 Cl4 O12 -","4","1","KA1114","Clegg, W.; Golding, B. T.; King, B. J.; Maude, A. B.","Four Isomeric Dioxolane Derivatives of <small>D</small>-Camphorquinone","Acta Crystallographica Section C","1995","51","9","1825","1829","10.1107/S0108270195001788","","","0.71073","MoKα","","0.0286","0.0269","","0.0745","0.072","","","","1.035","1.03","1.03","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003920","7.9169","0.0009","9.2702","0.0006","15.9849","0.0012","90","","90","","90","","1173.15","0.18","293","1","293","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Mer(NO~2~),trans(NH~2~,NH~3~)-silver(I)- (S-alaninato)amminetrinitrocobaltate(III) Monohydrate","","- C3 H11 Ag Co N5 O9 -","- C3 H11 Ag Co N5 O9 -","- C12 H44 Ag4 Co4 N20 O36 -","4","1","KA1120","Prelesnik, B.; Andjelković, K.; Malinar, M.; Juranic, N.","Mono(aminocarboxylato)cobalt(III) Complexes Possessing Only Vicinal and Conformational Asymmetry. IV. Silver(I) <i>mer</i>-(NO~2~),<i>trans</i>-(NH~2~,NH~3~)-[(<i>S</i>)-alaninato]amminetrinitrocobaltate(III) Monohydrate","Acta Crystallographica Section C","1995","51","9","1767","1769","10.1107/S0108270195002812","","","0.71069","MoKα","","","0.035","","","0.037","","","","","2.6","2.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003921","7.799","0.001","11.275","0.0008","11.622","0.001","90","","90","","90","","1021.97","0.17","213","","213","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H14 N2 O3 -","- C9 H14 N2 O3 -","- C36 H56 N8 O12 -","4","1","KH1020","Chai, C. L. L.; King, A. R.; Hockless, D. C. R.","<i>cyclo</i>-<i>N</i>-Acetyl-<small>L</small>-alanyl-<i>N</i>-methyl-<small>L</small>-alanyl (<i>cyclo</i>-<i>N</i>-Ac-<small>L</small>-Ala-<i>N</i>-Me-<small>L</small>-Ala)","Acta Crystallographica Section C","1995","51","9","1836","1838","10.1107/S0108270195002745","","","1.5418","CuKα","","0.0329","0.029","","0.0229","0.023","","","","","3.56","3.56","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003922","9.0574","0.0009","11.658","0.004","25.697","0.004","90","0.013","90","0.02","90","0.02","2713.4","1.1","130","1","130","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(1) endo 2-Norborneol 2,4-Dinitrobenzoate","","- C14 H14 N2 O6 -","- C14 H14 N2 O6 -","- C112 H112 N16 O48 -","8","1","KH1023","White, J. M.; Green, A. J.","<i>endo</i>-2-Norborneol 2,4-Dinitrobenzoate","Acta Crystallographica Section C","1995","51","9","1905","1906","10.1107/S0108270195002393","","","0.71069","MoKα","","0.0635","0.0437","","0.1366","0.1163","","","","1.152","1.132","1.132","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003923","15.12","0.01","10.72","0.01","21.58","0.02","90","","119.23","0.1","90","","3052","5","288","","288","","","","","","","","","7","P 1 c 1","P -2yc","7","","bis(4-benzyl-1,7-diphenyl-2,4,6-triazahepta-2,5-diene-κ^2^N^2^N^6^)mercury(II) tetrakis(trifluoroacetato)mercury(II) dichloromethane solvate","","- C54.7 H47.4 Cl1.4 F12 Hg2 N6 O8 -","- C55 Cl2 F12 Hg2 N6 O8 -","- C110 Cl4 F24 Hg4 N12 O16 -","2","1","LI1135","Breuer, S. W.; Small, R. W. H.","Bis(4-benzyl-1,7-diphenyl-2,4,6-triazahepta-2,5-diene-κ^2^<i>N</i>^2^,<i>N</i>^6^)mercury(II) Tetrakis(trifluoroacetato)mercury(II) Dichloromethane Solvate","Acta Crystallographica Section C","1995","51","9","1784","1788","10.1107/S010827019500477X","","","0.7107","MoKα","","","0.049","","","0.045","","","","","1.676","1.676","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003924","6.582","0.006","7.362","0.005","12.265","0.005","90","","94.03","0.06","90","","592.9","0.7","293","2","293","2","","","","","","","Preparation by Kitajima et al. (1982)","3","P 1 21/c 1","-P 2ybc","14","","copper(II) tetrachloroaluminium","","- Al2 Cl8 Cu -","- Al2 Cl8 Cu -","- Al4 Cl16 Cu2 -","2","0.5","MD1003","Herbstein, F. H.; Kapon, M.","Re-Examination Shows that Copper(II) Tetrachloroaluminium, Cu(AlCl~4~)~2~, is Monoclinic and not Triclinic as Originally Stated","Acta Crystallographica Section C","1995","51","9","1739","1741","10.1107/S0108270195005865","","","0.71069","MoKα","","0.0883","0.0848","","0.2396","","","","","0.476","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003925","9.402","0.004","10.045","0.006","13.658","0.006","90","","106.49","0.02","90","","1236.8","1.1","293","2","293","2","","","","","","","chemical synthesis","3","P 1 21/c 1","-P 2ybc","14","","cis-3-Hydroxytricyclo[7.5.0.0^3,8^]tetradec-1(9)-en-2-one","","- C14 H20 O2 -","- C14 H20 O2 -","- C56 H80 O8 -","4","1","MU1162","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Brosse, N.; Caubère, P.","<i>cis</i>-3-Hydroxytricyclo[7.5.0.0^3,8^]tetradec-1(9)-en-2-one","Acta Crystallographica Section C","1995","51","9","1838","1841","10.1107/S0108270195002228","","","1.54056","CuKα~1~","","0.1456","0.0544","","0.2345","0.1721","","","","1.004","1.291","1.291","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003926","17.631","0.007","11.843","0.004","6.984","0.001","90","","92.36","0.03","90","","1457","0.8","293","2","293","2","","","","","","","chemical synthesis","3","P 1 21/n 1","-P 2yn","14","","(1RS,2RS,9RS,10SR,14RS)-9-acetoxy-11-oxatricyclo[8.4.0.0^2,9^]tetradec-6,7-diol","","- C15 H24 O5 -","- C15 H24 O5 -","- C60 H96 O20 -","4","1","MU1167","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mercier-Girardot, S.; Caubère, P.","Stereochemistry of Hydroxylation Reactions on Polycyclic Pyrans","Acta Crystallographica Section C","1995","51","9","1885","1889","10.1107/S0108270195001442","","","1.54056","Cu-Kα~1~","","0.0729","0.0561","","0.1826","0.1553","","","","1.075","1.112","1.112","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003927","20.355","0.007","16.648","0.005","9.181","0.002","90","","97.14","0.04","90","","3087","1.6","293","2","293","2","","","","","","","chemical synthesis","3","C 1 2/c 1","-C 2yc","15","","(1SR,2RS,9RS,10RS,14SR)-9-acetoxy-11-oxatricyclo[8.4.0.0^2,9^]tetradec-6,7-diol monohydrate","","- C15 H26 O6 -","- C15 H26 O6 -","- C120 H208 O48 -","8","1","MU1167","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mercier-Girardot, S.; Caubère, P.","Stereochemistry of Hydroxylation Reactions on Polycyclic Pyrans","Acta Crystallographica Section C","1995","51","9","1885","1889","10.1107/S0108270195001442","","","1.54056","CuKα~1~","","0.0487","0.0374","","0.1071","0.1024","","","","1.014","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003928","11.995","0.001","11.995","0.001","16.692","0.002","90","","90","","90","","2401.6","0.4","296","","296","","","","","","","","","6","P 42/m n m","-P 4n 2n","136","","Tetraethylammonium hepta-μ3-chloro-μ3-teluro-hexachlorohexamolybdate","","- C24 H60 Cl13 Mo6 N3 Te -","- C24 Cl13 Mo6 N3 Te -","- C48 Cl26 Mo12 N6 Te2 -","2","0.125","NA1128","Ebihara, M.; Imai, T.; Kawamura, T.","Hexamolybdenum Cluster with One Telluride and Seven Chloride Capping Ligands","Acta Crystallographica Section C","1995","51","9","1743","1745","10.1107/S0108270194013466","","","0.7107","MolybdenumKα","","","0.038","","","0.043","","","","","1.52","1.52","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003929","20.27","0.009","20.27","0.009","12.3","0.05","90","","90","","120","","4377","18","293","2","293","2","","","","","","","","6","P 31 2 1","P 31 2""","152","cis-diammine-bisacyclovir platinum(II) chloride dihydrate","cis-diamminebis{2-amino-1,9-dihydro-9-[(2-hydroxyethoxy)methyl]-6H-purin-6-one} platinum(II) chloride dihydrate","","- C16 H32 Cl2 N12 O8 Pt -","- C16 H20 Cl2 N12 O8 Pt -","- C96 H120 Cl12 N72 O48 Pt6 -","6","1","NA1142","Sinur, A.; Grabner, S.","A Platinum(II) Diammine Complex: <i>cis</i>-[Pt(C~8~H~11~N~5~O~3~)~2~(NH~3~)~2~]Cl~2~.2H~2~O","Acta Crystallographica Section C","1995","51","9","1769","1772","10.1107/S0108270195002563","","","0.71069","MoKα","","0.065","0.054","","0.066","0.056","","","","3.013","2.843","2.843","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003930","14.301","0.006","13.037","0.005","20.981","0.014","90","","90","","90","","3912","3","293","2","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H29 N4 O12 V3 -","- C8 H29 N4 O12 V3 -","- C64 H232 N32 O96 V24 -","8","1","NA1147","Tyrselová, J.; Kuchta, L.; Pavelcík, F.","Piperazine Metavanadate Trihydrate","Acta Crystallographica Section C","1995","51","9","1752","1754","10.1107/S0108270195002022","","","0.71069","MoKα","","","0.0568","","","0.1261","","","","","1.125","1.125","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003931","24.096","0.005","10.692","0.002","20.188","0.004","90","","98.36","0.02","90","","5145.9","1.8","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","The tetraethylammonium salt of the Eu(dipic)3","tris(tetraethylammonium)tris(dipicolinato)europium(III) tetrahydrate","","- C45 H77 Eu N6 O16 -","- C45 H77 Eu N6 O16 -","- C180 H308 Eu4 N24 O64 -","4","1","NA1151","Brayshaw, P. A.; Harrowfield, J. M.; Sobolev, A. N.","A Strongly Luminescent Organic-Solvent-Soluble Salt of the Tris(dipicolinato)europium(III) Trianion","Acta Crystallographica Section C","1995","51","9","1799","1802","10.1107/S0108270195002897","","","0.71073","MoKα","","0.0673","0.0417","","0.0975","0.086","","","","1.064","1.108","1.108","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2003933","8.892","0.001","8.614","0.001","18.094","0.001","90","","102.62","0.01","90","","1352.4","0.2","293","","","","","","","","","","see text","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 O2 P -","- C15 H15 O2 P -","- C60 H60 O8 P4 -","4","1","NA1158","Wieczorek, W.","(2-Methoxyphenyl)(phenyl)vinylphosphine Oxide","Acta Crystallographica Section C","1995","51","9","1849","1851","10.1107/S0108270195002642","","","1.54184","CuKα","","","0.04","","","0.046","","","","","2.41","2.41","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003934","4.233","0.001","4.233","0.001","31.039","0.009","90","","90","","90","","556.2","0.2","293","2","293","2","","","","","","","Palenzona & Manfrinetti (1995)","2","I 41/a m d","-I 4bd 2","","","","","- Sc Sn2 -","- Sc Sn2 -","- Sc8 Sn16 -","8","","NA1161","Pani, M.; Manfrinetti, P.; Fornasini, M. L.","Two New Scandium Phases: ScSn~2~ and Sc~6~Pb~5~","Acta Crystallographica Section C","1995","51","9","1725","1728","10.1107/S0108270195003301","","","0.7107","MoKα","","0.078","0.065","","0.125","0.124","","","","4.57","5.6","5.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003935","8.889","0.001","19.274","0.002","6.177","0.002","90","","90","","90","","1058.3","0.4","293","2","293","2","","","","","","","Palenzona & Manfrinetti (1995)","2","I b a m","-I 2 2c","","","","","- Pb5 Sc6 -","- Pb5 Sc6 -","- Pb20 Sc24 -","4","0.25","NA1161","Pani, M.; Manfrinetti, P.; Fornasini, M. L.","Two New Scandium Phases: ScSn~2~ and Sc~6~Pb~5~","Acta Crystallographica Section C","1995","51","9","1725","1728","10.1107/S0108270195003301","","","0.7107","MoKα","","0.08","0.054","","0.146","0.139","","","","0.92","1.05","1.05","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003936","10.002","0.002","14.274","0.003","21.976","0.004","90","","90","","90","","3137.5","1.1","293","2","293","2","","","","","","","chemical synthesis","5","P 21 21 21","P 2ac 2ab","19","","(Z)-N-[(2R,3R)-2-(tert-Butoxycarbonylamino)-3-(tert- butyldiphenylsilyloxy)butylidene]benzylamine N-oxide","","- C32 H42 N2 O4 Si -","- C32 H42 N2 O4 Si -","- C128 H168 N8 O16 Si4 -","4","1","NA1167","Merino, P.; Merchan, F. L.; Tejero, T.; Lanaspa, A.","(<i>Z</i>)-<i>N</i>-[(2<i>R</i>,3<i>R</i>)-2-(<i>tert</i>-Butoxycarbonylamino)-3-(<i>tert</i>-butyldiphenylsiloxy)butylidene]benzylamine <i>N</i>-Oxide","Acta Crystallographica Section C","1995","51","9","1949","1950","10.1107/S0108270195004343","","","0.71073","MoKα","","0.1279","0.0568","","0.1593","0.1148","","","","1.078","1.132","1.132","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003937","24.032","0.004","8.109","0.002","24.014","0.003","90","","98.47","0.01","90","","4628.7","1.5","294","1","","","","","","","","","synthesized by the authors, see text","5","C 1 2/c 1","-C 2yc","15","3a,9b-Dihydro-2,9b-dimethylthiazolo[5,4-c]quinolin-4(5H)-one cis-isomer","(3aS^*^,9bS^*^)-(±)-3a,9b-Dihydro-2,9b-dimethylthiazolo[5,4-c] quinolin-4(5H)-one","","- C12 H12 N2 O S -","- C12 H12 N2 O S -","- C192 H192 N32 O16 S16 -","16","2","NA1185","Dao, D. C.; Ferguson, G.","(3a<i>S</i>^*^,9b<i>S</i>^*^)-(±)-3a,9b-Dihydro-2,9b-dimethylthiazolo[5,4-<i>c</i>]quinolin-4(5<i>H</i>)-one","Acta Crystallographica Section C","1995","51","9","1823","1825","10.1107/S0108270195007311","","","0.71069","MolybdenumKα","","0.0617","0.0367","","0.1134","0.1062","","","","1.065","1.202","1.202","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003938","12.193","0.009","12.821","0.002","6.685","0.001","90","","90","","90","","1045","0.8","298","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C8 H18 Cd N2 -","- C8 H18 Cd N2 -","- C32 H72 Cd4 N8 -","4","0.5","OH1068","Wang, X.; Sun, H.; Sun, X.; You, X.; Huang, X.","Me~2~Cd(dabco)","Acta Crystallographica Section C","1995","51","9","1754","1756","10.1107/S0108270194012291","","","0.71069","MoKα","","","0.03","","","0.039","","","","","1.23","1.23","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003939","27.571","0.004","5.062","0.001","17.284","0.003","90","","127.63","0.01","90","","1910.4","0.6","291","","","","","","","","","","aqueous solution","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H6 Ag N O4 -","- C10 H6 Ag N O4 -","- C80 H48 Ag8 N8 O32 -","8","1","PA1128","Jaber, F.; Charbonnier, F.; Faure, R.","Silver(I) <i>N</i>-Phthaloylglycinate","Acta Crystallographica Section C","1995","51","9","1765","1767","10.1107/S0108270195002447","","","0.7107","MoKα","","","0.017","","","0.019","","","","","1.48","1.48","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003940","8.521","0.003","15.367","0.006","16.892","0.006","90","","90","","90","","2211.9","1.4","293","","293","","","","","","","","synth\`ese chimique","4","P 21 21 21","P 2ac 2ab","19","","1-mésityl-3a-méthyl-5-phényl-3,3a,4,11-tétrahydro-3H-[1,2,4] oxadiazolo [4,5-a] [1,5] benzodiazépine","","- C26 H25 N3 O -","- C26 H25 N3 O -","- C104 H100 N12 O4 -","4","1","PA1141","Chiaroni, A.; Riche, C.; Baouid, A.; Benharref, A.; Hasnaoui, A.; Lavergne, J.-P.","1-Mésityl-3a-méthyl-5-phényl-3a,4-dihydro[1,2,4]oxadiazolo[4,5-<i>a</i>][1,5]benzodiazépine","Acta Crystallographica Section C","1995","51","9","1898","1900","10.1107/S0108270194010358","","","0.7107","MoKα","","","0.056","","","0.063","","","","","1.02","1.02","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003941","8.112","0.002","10.142","0.002","10.033","0.002","90","","74.49","0.03","90","","795.4","0.3","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","N-(1-Phenylethyl)-3-aza-10-oxatricyclo[5.2.1.0exp1,5]dec-8-ene-4-oxo6-carboxylic methyl ester","","- C18 H19 N O4 -","- C23 H19 -","- C46 H38 -","2","1","PA1167","Pèpe, G.; Zylber, J.; Tubul, A.; Brun, P.","Methyl 4-Oxo-<i>N</i>-(1-phenylethyl)-10-oxa-3-azatricyclo[5.2.1.0^1,5^]dec-8-ene-6-carboxylate","Acta Crystallographica Section C","1995","51","9","1915","1917","10.1107/S0108270195002460","","","1.5418","CuKα","","0.0362","0.0362","","0.0362","0.0362","","","","0.52","0.52","0.52","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003942","19.95","0.009","7.048","0.003","7.65","","81.26","0.03","86.34","0.03","88.78","0.04","1060.9","0.7","300","","","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H13 N7 S -","- C26 H13 N7 S -","- C52 H26 N14 S2 -","2","1","PA1168","Viossat, B.; Tomas, A.; Nguyen-Huy Dung; Mettey, Y.; Vierfond, J.-M.","12-Imino-12<i>H</i>-benzimidazo[2,1-<i>b</i>][1,3]benzothiazine‒7,7,8,8-Tétracyano-<i>p</i>-quinodiméthane, IBB‒TCNQ","Acta Crystallographica Section C","1995","51","9","1896","1898","10.1107/S0108270195002472","","","0.71069","MoKα","","","0.042","","","0.044","","","","","0.82","0.82","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003943","11.576","0.002","10.6933","0.0007","11.582","0.002","90","","101.448","0.009","90","","1405.2","0.4","293","2","293","2","","","","","","","Laboratory of Medicinal Chemistry, Li\`ege","4","P 1 21/a 1","-P 2yab","14","","2-Cyanoimino-5,5-diphenyl-4-imidazolinone Monohydrate","","- C16 H14 N4 O2 -","- C16 H14 N4 O2 -","- C64 H56 N16 O8 -","4","1","PA1170","Dupont, L.; Masereel, B.; Lambert, D.; Scriba, G.","2-Cyanoimino-5,5-diphenyl-4-imidazolinone Monohydrate","Acta Crystallographica Section C","1995","51","9","1901","1903","10.1107/S0108270195001661","","","1.5418","CuKα","","0.0467","0.0347","","0.1063","0.1025","","","","1.073","1.192","1.192","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2003944","9.636","0.002","19.634","0.003","8.215","0.002","90","","107.45","0.02","90","","1482.7","0.6","295","","","","","","","","","","slow evaporation of water solution","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 N2 O5 S -","- C14 H16 N2 O5 S -","- C56 H64 N8 O20 S4 -","4","1","PA1174","Ehlinger, N.; Perrin, M.","4-(4-Hydroxy-3,5-dimethylphenylazo)benzenesulfonic Acid","Acta Crystallographica Section C","1995","51","9","1846","1849","10.1107/S0108270195002496","","","1.54056","CuKα","","","0.0486","","","0.1098","","","","","0.886","0.886","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003945","14.586","0.002","8.583","0.001","12.186","0.002","90","","101.83","0.02","90","","1493.2","0.4","295","","","","","","","","","","slow evaporation of water solution","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 N2 O5 S -","- C14 H16 N2 O5 S -","- C56 H64 N8 O20 S4 -","4","1","PA1174","Ehlinger, N.; Perrin, M.","4-(4-Hydroxy-3,5-dimethylphenylazo)benzenesulfonic Acid","Acta Crystallographica Section C","1995","51","9","1846","1849","10.1107/S0108270195002496","","","1.54056","CuKα","","","0.0393","","","0.1077","","","","","0.994","0.994","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003946","9.5563","0.0003","13.8791","0.0008","10.929","0.0008","90","","111.648","0.002","90","","1347.3","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Benzamido-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-Dioxide","","- C13 H10 N4 O3 S -","- C13 H10 N4 O3 S -","- C52 H40 N16 O12 S4 -","4","1","PA1176","Dupont, L.; De Tullio, P.; Pirotte, B.; Masereel, B.; Delarge, J.","3-Benzamido-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-Dioxide","Acta Crystallographica Section C","1995","51","9","1903","1905","10.1107/S0108270195002459","","","1.5418","CuKα","","0.0391","0.0318","","0.0874","0.085","","","","1.039","1.109","1.109","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003947","7.484","0.001","10.735","0.001","7.1191","0.0009","98.37","0.01","109.59","0.01","105.98","0.01","499.84","0.12","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C9 H8 N2 O6 -","- C9 H8 N2 O6 -","- C18 H16 N4 O12 -","2","1","PT1001","Jedrzejas, M. J.; Luo, M.; Singh, S.; Brouillette, W. J.; Air, G. M.","4-(Acetylamino)-3-hydroxy-5-nitrobenzoic Acid","Acta Crystallographica Section C","1995","51","9","1910","1912","10.1107/S0108270195003258","","","1.5418","CuKα","","","0.0517","","","0.0647","","","","","2.43","2.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003948","7.532","0.001","3.992","0.001","9.728","0.001","90","","90","","90","","292.5","0.09","293","2","","","","","","","","","see text","4","P m n 21","P 2ac -2","31","","","","- B2 Cs Nb O6 -","- B2 Cs Nb O6 -","- B4 Cs2 Nb2 O12 -","2","0.5","SH1104","Becker, P.; Bohatý, L.; Fröhlich, R.","CsNbOB~2~O~5~: the Basic Structure Type of the Borates <i>AM</i>OB~2~O~5~ (<i>A</i> = K, Rb, Cs, Tl; <i>M</i> = Nb, Ta)","Acta Crystallographica Section C","1995","51","9","1721","1723","10.1107/S0108270195002617","","","0.71073","MoKα","","","0.0241","","","0.0661","","","","","1.023","1.023","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003949","9.161","0.001","9.161","0.001","10.678","0.002","90","","90","","90","","896.1","0.2","293","2","","","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- K2 Ni O10 P2 W -","- K2 Ni O10 P2 W -","- K8 Ni4 O40 P8 W4 -","4","0.5","SH1105","Peuchert, U.; Bohatý, L.; Fröhlich, R.","K~2~NiWO~2~(PO~4~)~2~: a New Structure Type Related to KTiOPO~4~ (KTP)","Acta Crystallographica Section C","1995","51","9","1719","1721","10.1107/S0108270195004185","","","0.71073","MoKα","","0.0143","0.0173","","0.0325","0.033","","","","","1.117","1.117","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003950","13.199","0.003","6.108","0.001","20.971","0.004","90","","92.53","0.02","90","","1689","0.6","158","","158","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Pentacylo[6.4.0^1,5^.0^1,8^.0^7,11^.0^10,12^]dodecan-6-yl 3,5-dintrobenzoate","","- C19 H18 N2 O6 -","- C19 H18 N2 O6 -","- C76 H72 N8 O24 -","4","1","SZ1009","Lautens, M.; Lough, A. J.; Tam, W.","An Unusual <i>trans</i>-Fused Cyclopentane Ring System at 158 K","Acta Crystallographica Section C","1995","51","9","1944","1946","10.1107/S0108270195003490","","","0.71073","MoKα","","0.0758","0.0503","","0.1391","0.1303","","","","1.043","1.191","1.191","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003951","15.885","0.002","5.6895","0.0004","14.889","0.002","90","","93.359","0.009","90","","1343.3","0.3","299","","","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C24 H28 O11 S2 -","- C24 H28 O11 S2 -","- C48 H56 O22 S4 -","2","0.5","SZ1011","Shalaby, M. A.; Fronczek, F. R.; Voll, R. J.; Younathan, E. S.","3,4-Di-<i>O</i>-acetyl-2,5-anhydro-1,6-di-<i>O</i>-(<i>p</i>-tolylsulfonyl)-<small>D</small>-mannitol","Acta Crystallographica Section C","1995","51","9","1921","1923","10.1107/S0108270195003519","","","1.54184","CuKα","","","0.03","","","0.041","","","","","2.295","2.295","","","","","has coordinates","198471","2020-10-21","18:00:00",""
"2003952","14.14","0.006","9.586","0.003","16.118","0.007","90","","94.48","0.02","90","","2178.1","1.5","298","","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","dicyclohexylammonium hydrogen 2-sulfobenzoate dihydrate","","- C19 H33 N O7 S -","- C19 H33 N O7 S -","- C76 H132 N4 O28 S4 -","4","1","TA1017","Ng, S. W.","Dicyclohexylammonium 2-Carboxybenzenesulfonate Dihydrate","Acta Crystallographica Section C","1995","51","9","1853","1855","10.1107/S0108270195003118","","","0.71073","MoKα","","0.1205","0.0575","","0.1509","0.1188","","","","1.009","1.075","1.075","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003953","11.8709","0.0008","13.625","0.002","13.8088","0.0014","88.684","0.009","75.199","0.007","72.618","0.007","2057.3","0.4","298","","298","","","","","","","","","6","P -1","-P 1","2","","tetrabutylbis[(N,N-diethylthiocarbamylthio)acetato]distannoxane dimer","","- C60 H120 N4 O10 S8 Sn4 -","- C60 H120 N4 O10 S8 Sn4 -","- C60 H120 N4 O10 S8 Sn4 -","1","0.5","TA1020","Ng, S. W.; Kumar Das, V. G.","Tetrabutylbis[(<i>N</i>,<i>N</i>-diethylthiocarbamoylthio)acetato]distannoxane Dimer","Acta Crystallographica Section C","1995","51","9","1774","1776","10.1107/S0108270195003143","","","0.71073","MoKα","","0.0944","0.0501","","0.1133","0.0948","","","","1.025","1.077","1.077","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003954","19.582","0.002","7.668","0.002","14.138","0.002","90","","111.229","0.009","90","","1978.8","0.6","296","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H26 Cl4 N3 Ru -","- C12 H26 Cl4 N3 Ru -","- C48 H104 Cl16 N12 Ru4 -","4","0.5","TA1023","Gheller, S. F.; Heath, G. A.; Hockless, D. C. R.","Tetraethylammonium Salt of <i>trans</i>-Bis(acetonitrile)tetrachlororuthenate(III), a Notable Optical Chromophore","Acta Crystallographica Section C","1995","51","9","1805","1807","10.1107/S0108270195003623","","","1.5418","CuKα","","0.0397","0.025","","0.0231","0.022","","","","","1.73","1.73","","","","","has coordinates","198475","2020-10-21","18:00:00",""
"2003955","9.132","0.002","12.248","0.002","13.622","0.003","95.72","0.02","105.6","0.02","89.91","0.02","1459.7","0.5","295","","295","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H36 Cl2 N Os P3 -","- C26 H36 Cl2 N Os P3 -","- C52 H72 Cl4 N2 Os2 P6 -","2","1","TA1024","Yeomans, B. D.; Heath, G. A.; Hockless, D. C. R.","(Acetonitrile)-<i>trans</i>-dichloro-<i>mer</i>-tris[(dimethyl)phenylphosphine]osmium(III); the Kinetically Controlled Electrogenerated Isomer","Acta Crystallographica Section C","1995","51","9","1807","1809","10.1107/S0108270195003544","","","0.7107","MoKalpha","","0.0609","0.044","","0.0622","0.061","","","","","2.59","2.59","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003956","15.209","0.003","25.479","0.004","6.26","0.002","90","","90.01","0.02","90","","2425.8","1","23","","23","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H30 N2 O5 -","- C27 H30 N2 O5 -","- C108 H120 N8 O20 -","4","1","VJ1012","Tsutsumi, S.; Okonogi, T.; Takeuchi, Y.; Kodama, Y.","Prolyl Endopeptidase Inhibitors. I. A Peptidyl α-Keto Ester Derivative","Acta Crystallographica Section C","1995","51","9","1923","1925","10.1107/S0108270195003891","","","1.5418","CuKα","","","0.229","","","0.079","","","","","1.24","1.24","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2003957","8.819","0.001","6.656","0.004","20.006","0.004","90","","93.34","0.01","90","","1172.3","0.8","23","","23","","","","","","","","","5","P 1 21 1","","","","","","- C25 H23 N3 O4 S -","- C25 H23 N3 O4 S -","- C50 H46 N6 O8 S2 -","2","1","VJ1013","Tsutsumi, S.; Okonogi, T.; Takeuchi, Y.; Kodama, Y.","Prolyl Endopeptidase Inhibitors. II. A Peptidyl α-Keto Thiazole Derivative","Acta Crystallographica Section C","1995","51","9","1925","1927","10.1107/S0108270195003908","","","1.5418","CuKα","","","0.194","","","0.075","","","","","1.17","1.17","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003958","10.226","0.001","9.365","0.001","12.073","0.002","90","","95.58","0.01","90","","1150.7","0.3","23","","23","","","","","","","","","5","P 1 21 1","","","","","","- C25 H25 N3 O4 S -","- C25 H25 N3 O4 S -","- C50 H50 N6 O8 S2 -","2","1","VJ1014","Tsutsumi, S.; Okonogi, T.; Takeuchi, Y.; Kodama, Y.","Prolyl Endopeptidase Inhibitors. III. A Peptidyl α-Keto Benzothiazole Derivative","Acta Crystallographica Section C","1995","51","9","1927","1929","10.1107/S010827019500391X","","","1.5418","CuKα","","","0.2202","","","0.0735","","","","","1.121","1.121","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003959","14.98","0.002","6.05","0.002","13.31","0.002","90","","101.21","0.07","90","","1183.3","0.5","295","","","","","","","","","","Synthesized locally","5","P 1 21/a 1","-P 2yab","14","","","","- C10 H12 N2 O5 S -","- C10 H12 N2 O5 S -","- C40 H48 N8 O20 S4 -","4","1","AB1088","Mukherjee, K.; Banerjee, T.; Roychowdhury, P.; Yamane, T.","<i>N</i>-Benzenesulfonylglycylglycine, (I), and Tetrakis(μ-<i>N</i>-benzenesulfonylglycylglycinato)bis[aquacopper(II)](<i>Cu</i>—<i>Cu</i>)‒Water (1/4), (II)","Acta Crystallographica Section C","1995","51","10","2025","2028","10.1107/S0108270194005214","","","1.5418","CuKα","","","0.0615","","","0.0567","","","","","1.17","1.17","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003960","13.716","0.003","12.374","0.003","7.992","0.004","97.66","0.03","83.12","0.03","95.82","0.02","1329.6","0.8","297","","","","","","","","","","Synthesized","6","P -1","-P 1","2","","","","- C20 H28 Cu N4 O13 S2 -","- C20 H28 Cu N4 O13 S2 -","- C40 H56 Cu2 N8 O26 S4 -","2","1","AB1088","Mukherjee, K.; Banerjee, T.; Roychowdhury, P.; Yamane, T.","<i>N</i>-Benzenesulfonylglycylglycine, (I), and Tetrakis(μ-<i>N</i>-benzenesulfonylglycylglycinato)bis[aquacopper(II)](<i>Cu</i>—<i>Cu</i>)‒Water (1/4), (II)","Acta Crystallographica Section C","1995","51","10","2025","2028","10.1107/S0108270194005214","","","1.5418","CuKα","","","0.0574","","","0.0599","","","","","1.13","1.13","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2003961","15.665","0.001","16.352","0.003","17.252","0.001","90","","95.725","0.007","90","","4397.1","0.9","298","3","","","","","","","","","synthesis","6","P 1 21/a 1","-P 2yab","14","","","","- C14 H32 Cl2 N4 Ni O8 -","- C14 H32 Cl2 N4 Ni O8 -","- C112 H256 Cl16 N32 Ni8 O64 -","8","2","AB1193","Tahirov, T. H.; Lu, T.-H.; Liu, G.-S.; Chi, T.-Y.; Chung, C.-S.","[(5<i>SR</i>,7<i>RS</i>,12<i>RS</i>,14<i>RS</i>)-5,7,12,14-Tetramethyl-1,4,8,11-tetraazacyclotetradecane]nickel(II) Diperchlorate","Acta Crystallographica Section C","1995","51","10","2018","2020","10.1107/S0108270195004458","","","0.71073","MoKα","","","0.048","","","0.058","","","","","1.38","1.38","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003962","11.203","0.002","12.368","0.002","14.849","0.003","90","","99.8","0.2","90","","2027.4","1.4","293","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C23 H30 O4 -","- C23 H30 O4 -","- C92 H120 O16 -","4","2","AB1212","Bidyasagar, M.; Ravikumar, K.; Rama Rao, A. V.; Reddy, M. M.; Singh, A. K.","Structural Studies of Intermediates in the Synthesis of Mifepristone (RU 486). IV. An α-Epoxy Steroid","Acta Crystallographica Section C","1995","51","10","2102","2105","10.1107/S0108270195004409","","","0.71073","MoKα","","","0.05","","","0.053","","","","","0.992","0.992","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003963","10.881","0.002","19.772","0.003","21.563","0.003","90","","90","","90","","4639","1.3","298","","","","","","","","","","","5","P c a b","-P 2bc 2ac","61","","","","- C48 H48 Cu2 N4 O10 -","- C24 H24 Cu N2 O5 -","- C192 H192 Cu8 N16 O40 -","8","1","AB1221","Hökelek, T.; Necefouglu, H.; Balcı, M.","Tetrakis(μ-benzoato-<i>O</i>:<i>O</i>')bis(<i>N</i>,<i>N</i>-diethylnicotinamide-<i>N</i>')dicopper(II)","Acta Crystallographica Section C","1995","51","10","2020","2023","10.1107/S0108270195000618","","","0.71069","MoKα","","","0.0453","","","0.0486","","","","","0.36","0.36","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003964","7.414","0.002","11.981","0.002","22.826","0.006","90","","90","","90","","2027.6","0.8","290","","","","","","","","","","see text","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H9 N O2 -","- C12 H9 N O2 -","- C96 H72 N8 O16 -","8","2","AB1254","Rajnikant; Watkin, D.; Tranter, G.","3-Nitrobiphenyl","Acta Crystallographica Section C","1995","51","10","2071","2073","10.1107/S0108270195003593","","","0.71073","MoKα","","","0.045","","","0.0571","","","","","0.83","0.83","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003965","9.845","0.003","12.445","0.002","14.0154","0.0013","90","","92.154","0.012","90","","1716","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5a-p-Tolyl-5a,5b,6,7,8,9,9a,11-octahydroisoindolo [2,1-a]- benzimidazol-10-one","","- C21 H22 N2 O -","- C21 H22 N2 O -","- C84 H88 N8 O4 -","4","1","AB1256","Sillanpää, R.; Csende, F.; Stájer, G.","5a-<i>p</i>-Methylphenyl-5a,5b,6,7,8,9,9a,10-octahydro-5<i>H</i>-isoindolo[2,1-<i>a</i>]benzimidazol-10-one","Acta Crystallographica Section C","1995","51","10","2169","2171","10.1107/S0108270195005920","","","0.71069","MoKα","","0.1107","0.0441","","0.1164","0.0913","","","","1.025","1.101","1.101","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003966","8.313","0.005","9.717","0.005","12.151","0.004","70.86","0.04","88.56","0.04","82.11","0.05","918.3","0.8","293","2","293","2","","","","","","","synthesis","4","P -1","-P 1","2","pyruvic acid oxime","2-hydroxyiminopropanoic acid","","- C3 H5 N O3 -","- C3 H5 N O3 -","- C24 H40 N8 O24 -","8","4","AB1262","Maurin, J. K.","Resonance-Assisted Hydrogen Bonds Between Oxime and Carboxyl Groups. II. The Tetrameric Structure of Pyruvic Acid Oxime","Acta Crystallographica Section C","1995","51","10","2111","2113","10.1107/S0108270195005932","","","1.54178","CuKα","","0.0639","0.0393","","0.1139","0.1038","","","","1.016","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003967","19.746","0.005","12.403","0.003","7.254","0.002","90","","100.57","0.02","90","","1746.4","0.8","122","2","122","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","O-Methyl-THPO hydrochloride","O-Methyl-4,5,6,7-tetrahydroisoxazolo[4,5c]pyridin-3-ol hydrochloride","","- C7 H11 Cl N2 O2 -","- C7 H11 Cl N2 O2 -","- C56 H88 Cl8 N16 O16 -","8","1","AB1263","Frydenvang, K.; Hansen, L. M.; Jensen, B.","<i>O</i>-Methyl-4,5,6,7-tetrahydroisoxazolo[4,5-<i>c</i>]pyridin-3-ol Hydrochloride, <i>O</i>-Me-THPO.HCl","Acta Crystallographica Section C","1995","51","10","2053","2057","10.1107/S010827019500446X","","","0.71073","MoKα","","0.1088","0.05","","0.1559","0.1239","","","","1.068","1.083","1.083","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003968","11.101","0.002","8.6795","0.0007","14.648","0.002","90","","100.457","0.011","90","","1387.9","0.3","294","1","294","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2-Ferrocenylquinoxaline","","- C18 H14 Fe N2 -","- C18 H14 Fe N2 -","- C72 H56 Fe4 N8 -","4","1","AB1268","Ferguson, G.; Glidewell, C.; Scott, J. P.","2-Ferrocenylquinoxaline","Acta Crystallographica Section C","1995","51","10","1989","1991","10.1107/S0108270195004094","","","0.7107","MoKα","","0.0598","0.0347","","0.0962","0.0901","","","","1.042","1.167","1.167","","","","","has coordinates","192281","2020-10-21","18:00:00",""
"2003969","9.065","0.002","10.858","0.002","14.118","0.003","89.59","0.03","71.94","0.03","83.63","0.03","1312.4","0.5","173","2","173","2","","","","","","","chemical synthesis","4","P -1","-P 1","2","","Quinazolino[2,3-a]benzisoquinoline-2,14-dione","","- C19 H10 N2 O2 -","- C19 H10 N2 O2 -","- C76 H40 N8 O8 -","4","2","AB1270","Lindeman, S. V.; Ponomarev, I. I.; Rusanov, A. L.","Benz[4,5]isoquino[1,2-<i>b</i>]quinazoline-7,9-dione and a Rearrangement Product of its Hydrolysis, 2-(1,8-Naphthalenedicarboximido)benzamide","Acta Crystallographica Section C","1995","51","10","2157","2161","10.1107/S0108270195005749","","","0.71069","MoKα","","0.1197","0.0696","","0.1982","0.1679","","","","1.043","1.134","1.134","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003970","9.354","0.002","14.13","0.003","11.923","0.002","90","","111.28","0.03","90","","1468.4","0.6","173","2","173","2","","","","","","","chemical synthesis","4","P 1 21/c 1","-P 2ybc","14","","N-(o-amidophenyl)-1,8-naphthoyleneimide","","- C19 H12 N2 O3 -","- C19 H12 N2 O3 -","- C76 H48 N8 O12 -","4","1","AB1270","Lindeman, S. V.; Ponomarev, I. I.; Rusanov, A. L.","Benz[4,5]isoquino[1,2-<i>b</i>]quinazoline-7,9-dione and a Rearrangement Product of its Hydrolysis, 2-(1,8-Naphthalenedicarboximido)benzamide","Acta Crystallographica Section C","1995","51","10","2157","2161","10.1107/S0108270195005749","","","0.71069","MoKα","","0.0746","0.0475","","0.1357","0.1194","","","","1.03","1.049","1.049","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003971","26.114","0.005","9.859","0.002","13.273","0.003","90","","108.48","0.03","90","","3241","1.3","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H22 N6 O4 -","- C15 H22 N6 O5 -","- C120 H176 N48 O40 -","8","1","AS1159","Karczmarzyk, Z.; Karolak-Wojciechowska, J.; Pawlowski, M.","8-Amino-7-(2-hydroxy-3-morpholinopropyl)theophylline","Acta Crystallographica Section C","1995","51","10","2121","2123","10.1107/S0108270195003374","","","1.54184","CuKα","","","0.0667","","","0.0667","","","","","3.43","3.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003972","3.86","0.01","12.771","0.006","10.994","0.004","90","","93.93","0.08","90","","540.7","1.4","295","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H10 O2 -","- C16 H6 O2 -","- C32 H12 O4 -","2","0.5","AS1161","Kingsford-Adaboh, R.; Kashino, S.","Disordered Structure of 2-Methylanthraquinone","Acta Crystallographica Section C","1995","51","10","2094","2096","10.1107/S0108270195003842","","","0.71073","MoKα","","","0.061","","","0.058","","","","","2.21","2.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003973","10.008","0.001","12.409","0.001","6.821","0.001","90","","99.5","0.01","90","","835.48","0.16","293","2","293","2","","","","","","","see prep","4","P 1 21/c 1","-P 2ybc","14","","4,5-Diazafluoren-9-one","","- C11 H6 N2 O -","- C11 H6 N2 O -","- C44 H24 N8 O4 -","4","1","AS1169","Fun, H.-K.; Sivakumar, K.; Zhu, D.-R.; You, X.-Z.","4,5-Diazafluoren-9-one","Acta Crystallographica Section C","1995","51","10","2076","2078","10.1107/S0108270195003854","","","0.71073","MoKα","","0.051","0.0439","","0.1324","0.1277","","","","1.057","1.14","1.14","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003974","7.815","0.001","8.116","0.001","24.972","0.002","90","","90","","90","","1583.9","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","14-methyl-7,14-dihydrodibenzo[a,j]acridine","","- C22 H17 N -","- C22 H17 N -","- C88 H68 N4 -","4","1","AS1170","Ray, J. K.; Roy, B. C.; Nigam, G. D.; Sivakumar, K.; Fun, H.-K.","14-Methyl-7,14-dihydrodibenzo[<i>a</i>,<i>j</i>]acridine","Acta Crystallographica Section C","1995","51","10","2083","2085","10.1107/S0108270195004860","","","0.71073","MoKα","","0.0465","0.0332","","0.1447","0.0924","","","","1.044","1.142","1.142","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003975","21.811","0.007","10.177","0.001","16.006","0.002","90","","99.91","0.02","90","","3499.8","1.3","298","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 N4 O -","- C18 H24 N4 O -","- C144 H192 N32 O8 -","8","2","AS1171","Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A.","Bis[4-(dimethylamino)phenyl](<i>N</i>-methylcarbamoyl)amine, C~18~H~24~N~4~O","Acta Crystallographica Section C","1995","51","10","2198","2200","10.1107/S0108270195006196","","","1.54184","CuKα","","","0.055","","","0.068","","","","","2.85","2.85","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003976","10","0.003","25.705","0.006","7.323","0.002","90","","107.84","0.03","90","","1791.9","0.9","299","2","","","","","","","","","crystallization from CS~2~-ethanol","4","P 1 21 1","P 2yb","4","","","","- C33 H56 P2 S4 -","- C33 H56 P2 S4 -","- C66 H112 P4 S8 -","2","1","AS1173","Tani, K.; Onouchi, J.; Yamagata, T.; Kataoka, Y.","(1<i>S</i>,2<i>S</i>)-(+)-1,2-Bis[(dicyclohexyl)phosphinomethyl]cyclopentane.2CS~2~ and (±)-1,2-Bis(dicyclohexylphosphinomethyl)cyclopentane","Acta Crystallographica Section C","1995","51","10","2073","2076","10.1107/S0108270195004033","","","1.54178","CuKα","","","0.047","","","0.048","","","","","0.771","0.771","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003977","29.558","0.002","9.5439","0.0005","11.039","0.001","90","","101.157","0.009","90","","3055.2","0.4","294","1","","","","","","","","","crystallization from hexanes","3","C 1 2/c 1","-C 2yc","15","","","","- C31 H56 P2 -","- C31 H56 P2 -","- C124 H224 P8 -","4","0.5","AS1173","Tani, K.; Onouchi, J.; Yamagata, T.; Kataoka, Y.","(1<i>S</i>,2<i>S</i>)-(+)-1,2-Bis[(dicyclohexyl)phosphinomethyl]cyclopentane.2CS~2~ and (±)-1,2-Bis(dicyclohexylphosphinomethyl)cyclopentane","Acta Crystallographica Section C","1995","51","10","2073","2076","10.1107/S0108270195004033","","","1.54178","CuKα","","","0.054","","","0.05","","","","","2.578","2.578","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003978","18.25","0.004","16.424","0.004","12.639","0.002","90","","113.56","0.02","90","","3472.6","1.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","p-N,N-dimethylaminobenzaldehyde-4,5-diazafluorene-9-hydrazone monohydrate.","","- C20 H19 N5 O -","- C20 H19 N5 O -","- C160 H152 N40 O8 -","8","1","AS1177","Lu, Z.-L.; Duan, C.-Y.; Tian, Y.-P.; You, X.-Z.; Fun, H.-K.; Sivakumar, K.","<i>p</i>-Dimethylaminobenzaldehyde 4,5-Diaza-9-fluorenylidenehydrazone Monohydrate","Acta Crystallographica Section C","1995","51","10","2078","2080","10.1107/S0108270195004446","","","0.71073","MoKα","","0.0681","0.0399","","0.0994","0.0914","","","","0.879","1.066","1.066","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003979","10.431","0.002","13.477","0.002","15.016","0.004","109.56","0.02","101.56","0.02","109.14","0.01","1761.4","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","S-benzyl-β-N-(dimethylaminophenyl)methylendithiocarbazate.","","- C17 H19 N3 S2 -","- C17 H19 N3 S2 -","- C68 H76 N12 S8 -","4","2","AS1178","Fun, H.-K.; Sivakumar, K.; Yip, B.-C.; Tian, Y.-P.; Duan, C.-Y.; Lu, Z.-L.; You, X.-Z.","Benzyl 3-(4-Dimethylaminobenzylidene)dithiocarbazate","Acta Crystallographica Section C","1995","51","10","2080","2083","10.1107/S0108270195004549","","","0.71069","MoKα","","0.0657","0.0464","","0.1382","0.1278","","","","1.049","1.169","1.169","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003981","9.374","0.002","11.217","0.001","12.015","0.002","90","","104.03","0.02","90","","1225.7","0.4","213","","213","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 Br N O -","- C14 H12 Br N O -","- C56 H48 Br4 N4 O4 -","4","1","AS1181","Banwell, M. G.; Bridges, V. S.; Hockless, D. C. R.","1-[2(<i>Z</i>)-Bromo-3-phenyl-2-propenyl]pyridin-2(1<i>H</i>)-one","Acta Crystallographica Section C","1995","51","10","2128","2129","10.1107/S0108270195005579","","","1.5418","CuKα","","0.0397","0.035","","0.0397","0.038","","","","","2.41","2.41","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003982","11.263","0.001","18.507","0.002","7.449","0.001","90","","110.379","0.009","90","","1455.5","0.3","90","","90","","","","","","","","synthesis","2","C 1 2/c 1","-C 2yc","15","","(Z)-6,6'-dimethylbiindanylidene","","- C20 H20 -","- C20 H20 -","- C80 H80 -","4","0.5","AS1182","Harada, J.; Ogawa, K.; Tomoda, S.","`Stiff' <i>cis</i>-Stilbenes. (<i>Z</i>)-6,6'-Dimethyl-1,1'-biindanylidene and (<i>Z</i>)-4,4',7,7'-Tetramethyl-1,1'-biindanylidene","Acta Crystallographica Section C","1995","51","10","2125","2127","10.1107/S0108270195005440","","","1.54184","CuKα","","0.057","0.052","","0.066","0.066","","","","3.11","3.275","3.275","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003983","11.604","0.003","7.754","0.002","18.146","0.002","90","","102.71","0.01","90","","1592.7","0.6","90","","90","","","","","","","","synthesis","2","C 1 2/c 1","-C 2yc","15","","(Z)-4,4',7,7'-tetramethyl-1,1'-biindanylidene","","- C22 H24 -","- C22 H24 -","- C88 H96 -","4","0.5","AS1182","Harada, J.; Ogawa, K.; Tomoda, S.","`Stiff' <i>cis</i>-Stilbenes. (<i>Z</i>)-6,6'-Dimethyl-1,1'-biindanylidene and (<i>Z</i>)-4,4',7,7'-Tetramethyl-1,1'-biindanylidene","Acta Crystallographica Section C","1995","51","10","2125","2127","10.1107/S0108270195005440","","","1.54184","CuKα","","0.056","0.054","","0.073","0.073","","","","2.474","2.52","2.52","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003984","12.119","0.001","7.821","0.001","12.107","0.001","90","","105.73","0.01","90","","1104.6","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","trans-9-Methyl-1,5-dioxofuro[2,3-b]decalin","","- C13 H14 O3 -","- C13 H14 O3 -","- C52 H56 O12 -","4","1","AS1184","Ray, J. K.; Kar, G. K.; Nigam, G. D.; Sivakumar, K.; Fun, H.-K.","<i>trans</i>-4,4a,6,7,8,8a-Hexahydro-8a-methylnaphtho[2,3-<i>b</i>]furan-5,9(5<i>H</i>,9<i>H</i>)-dione","Acta Crystallographica Section C","1995","51","10","2090","2092","10.1107/S010827019500535X","","","0.71073","MoKα","","0.06","0.0424","","0.1209","0.1135","","","","0.999","1.143","1.143","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003985","9.8472","0.0005","12.2385","0.0006","23.5157","0.001","90","","101.292","0.004","90","","2779.1","0.2","302","","","","","","","","","","Evaporation from H~2~O","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H16 Co N7 S3 -","- C7 H16 Co N7 S3 -","- C56 H128 Co8 N56 S24 -","8","1","BK1060","Liu, Y.-H.; Fronczek, F. R.; Watkins, S. F.; Shaffer, G. W.; Musselman, R. L.","<i>trans</i>-Bis(isothiocyanato)bis(ethylenediamine)cobalt(III) Thiocyanate","Acta Crystallographica Section C","1995","51","10","1992","1994","10.1107/S010827019500518X","","","0.71073","MoKα","","","0.024","","","0.032","","","","","1.677","1.677","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003986","9.566","0.001","9.566","0.001","12.042","0.002","90","","90","","120","","954.3","0.2","291","","","","","","","","","","crystallized from hexane","6","P 63/m","-P 6c","176","","","","- C11 H15 Cl Fe2 O6 Si3 -","- C9 Cl3 Fe2 O6 Si3 -","- C18 Cl6 Fe4 O12 Si6 -","2","0.166667","BK1089","Simons, R. S.; Tessier, C. A.","Diiron Complex with Three Bridging Silyl Substituents","Acta Crystallographica Section C","1995","51","10","1997","1998","10.1107/S0108270195002873","","","0.71073","MoKα","","","0.0351","","","0.0429","","","","","1.44","1.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003987","5.8981","0.0006","9.235","0.001","11.101","0.002","97.85","0.01","90.38","0.01","98.87","0.01","591.59","0.14","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C3 H10 Cl2 N6 O9 -","- C3 H11 Cl2 N6 O9 -","- C6 H22 Cl4 N12 O18 -","2","1","BK1103","Martin, A.; Pinkerton, A. A.","Melaminium Diperchlorate Hydrate","Acta Crystallographica Section C","1995","51","10","2174","2177","10.1107/S0108270195003921","","","0.71073","MoKα","","0.029","0.026","","","0.035","","","","","3.35","3.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003988","8.052","0.002","5.488","0.002","19.308","0.002","90","","95.39","0.01","90","","849.4","0.4","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 N4 Ni O6 -","- C14 H18 N4 Ni O6 -","- C28 H36 N8 Ni2 O12 -","2","0.5","BK1125","Okabe, N.; Tamaki, K.","Dimethanolbis(<i>N</i>-nitroso-<i>N</i>-phenylhydroxylaminato-<i>O</i>,<i>O</i>')nickel(II)","Acta Crystallographica Section C","1995","51","10","2004","2005","10.1107/S0108270195005816","","","0.71069","MoKα","","","0.033","","","0.049","","","","","2.31","2.31","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003989","15.243","0.006","15.384","0.006","29.716","0.009","90","","90","","90","","6968","4","120","0.2","120","0.2","","","","","","","see prep","3","P 21 21 21","P 2ac 2ab","19","","Methyl 2α,3β,23-triacetoxyurs-12,18-dien-28-oate","","- C37 H54 O8 -","- C37 H54 O8 -","- C296 H432 O64 -","8","2","BM1010","Cox, P. J.; Durham, D. G.; Liu, X.; Richards, R. M. E.","Methyl 2α,3β,23-Triacetoxyurs-12,18-dien-28-oate","Acta Crystallographica Section C","1995","51","10","2135","2137","10.1107/S0108270195005774","","","0.71069","MoKα","","0.1029","0.0452","","0.0891","0.0747","","","","0.644","0.898","0.898","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2003990","9.9075","0.0007","12.4566","0.0013","16.047","0.002","90","","90","","90","","1980.4","0.4","294","1","294","1","","","","","","","see prep","4","P 21 21 21","P 2ac 2ab","19","","(3R,4R,4aS,10aR)-5-acetyl-3,4,4a,5,6,7,10,10a-octahydro-8-methoxy-7-methyl-6- oxo-2H-pyrano[3,2-g]pteridin-3,4-diyl diacetate","","- C17 H22 N4 O8 -","- C17 H22 N4 O8 -","- C68 H88 N16 O32 -","4","1","BM1014","Low, J. N.; Cadoret, E.; Ferguson, G.; López, M. D.; Quijano, M. L.; Sánchez, A.; Nogueras, M.","A Triacetyl Derivation of a Pyrano[3,2-<i>g</i>]pteridine","Acta Crystallographica Section C","1995","51","10","2141","2143","10.1107/S0108270195005956","","","0.71073","MolybdenumKα","","0.082","0.042","","0.058","0.052","","","","","1.37","1.37","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003991","9.561","0.002","5.557","0.002","6.179","0.002","90","","98.85","0.02","90","","324.38","0.17","296","","","","","","","","","","grown from melt composition of BaNaBO~3~","4","C 1 2/m 1","-C 2y","12","","","","- B Ba Na O3 -","- B Ba Na O3 -","- B4 Ba4 Na4 O12 -","4","0.5","BR1082","Tu, J.-M.; Keszler, D. A.","BaNaBO~3~","Acta Crystallographica Section C","1995","51","10","1962","1964","10.1107/S010827019400750X","","","0.71069","MoKα","","","0.033","","","0.04","","","","","1.39","1.39","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003992","10.9547","0.0009","8.4281","0.0007","18.962","0.002","90","","90.314","0.007","90","","1750.7","0.3","150","","150","","","","","","","","from silicate melt","4","P 1 21/m 1","-P 2yb","11","cesium-lithium phyllosilicate","cesium-lithium phyllosilicate'","","- Cs1.33 Li0.67 O5 Si2 -","- Cs1.33333 Li0.666667 O5 Si2 -","- Cs16 Li8 O60 Si24 -","12","3","BR1107","Veldman, N.; Spek, A. L.; Supèr, H. T. J.; de Jong, B. H. W. S.","Caesium‒Lithium Phyllosilicate, Cs~1.33~Li~0.67~Si~2~O~5~","Acta Crystallographica Section C","1995","51","10","1972","1975","10.1107/S0108270195005257","","","0.71073","MoKα","","0.0452","0.0394","","0.115","0.144","","","","1.13","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003993","10.099","0.003","15.04","0.004","9.917","0.002","90","","98.05","0.02","90","","1491.4","0.7","293","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H24 Cu N6 O6 -","- C8 H24 Cu N6 O6 -","- C32 H96 Cu4 N24 O24 -","4","0.5","DE1004","Narayanan, B.; Bhadbhade, M. M.","Non-Thermochromic Bis(<i>N</i>,<i>N</i>-dimethylethylenediamine)copper(II) Dinitrate","Acta Crystallographica Section C","1995","51","10","2016","2018","10.1107/S0108270195004859","","","0.71073","MoKα","","","0.03","","","0.055","","","","","1.75","1.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003994","24.122","0.003","13.321","0.002","7.509","0.001","90","","101.6","0.01","90","","2363.6","0.6","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C11 H11 N3 S2 -","- C11 H11 N3 S2 -","- C88 H88 N24 S16 -","8","1","DU1107","Toledano, P.; Ait Itto, M. Y.; Hasnaoui, A.","2-Méthyl-7-phényl-3,5-dithioxo-3,4,5,6-tétrahydro-2<i>H</i>-1,2,4-triazépine","Acta Crystallographica Section C","1995","51","10","2066","2068","10.1107/S0108270195001314","","","0.71069","MoKα","","","0.0327","","","0.0317","","","","","3.73","3.73","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003995","7.8067","0.0006","12.3221","0.001","10.4078","0.001","90","","111.174","0.007","90","","933.59","0.14","293","2","293","2","","","","","","","synthesis","4","C 1 2/c 1","-C 2yc","15","","Potassium Yttrium Tetrametaphosphate","","- K O12 P4 Y -","- K O12 P4 Y -","- K4 O48 P16 Y4 -","4","0.5","DU1117","Hamady, A.; Jouini, T.; Driss, A.","KYP~4~O~12~","Acta Crystallographica Section C","1995","51","10","1970","1972","10.1107/S0108270195002381","","","0.7106","MoKα","","0.0298","0.0264","","0.0661","0.0648","","","","1.117","1.138","1.138","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003996","12.326","0.003","7.088","0.002","12.365","0.003","90","","110.08","0.02","90","","1014.6","0.5","293","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- Cd4 Ge S6 -","- Cd4 Ge S6 -","- Cd16 Ge4 S24 -","4","1","DU1119","Julien-Pouzol, M.; Jaulmes, S.","Redétermination de la Structure du Sulfure de Cadmium et de Germanium, Cd~4~GeS~6~","Acta Crystallographica Section C","1995","51","10","1966","1968","10.1107/S0108270195003763","","","0.71069","MoKα","","","0.0407","","","0.0508","","","","","0.28","0.28","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003997","8.849","0.002","15.53","0.003","10.422","0.003","90","","108.04","0.02","90","","1361.8","0.6","293","2","293","2","","","","","","","Stenborn & Ludwig (1993b)","6","P 1 21 1","P 2yb","4","","Bis(dimethylglyoximato-N,N')(methyl)(triphenylphosphine)rhodium(III)","","- C27 H32 N4 O4 P Rh -","- C27 H32 N4 O4 P Rh -","- C54 H64 N8 O8 P2 Rh2 -","2","1","FG1053","Potočňák, I.; Dunaj-Jurčo, M.; Ludwig, M.; Steinborn, D.","Bis(dimethylglyoximato-<i>N</i>,<i>N</i>')(methyl)(triphenylphosphine)rhodium(III)","Acta Crystallographica Section C","1995","51","10","1999","2001","10.1107/S0108270195004240","","","0.71069","MoKα","","0.0313","0.0202","","0.1229","0.0496","","","","0.981","1.012","1.012","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003998","6.155","0.001","32.871","0.005","9.27","0.001","90","","100.87","0.01","90","","1841.9","0.5","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H7 N2 O Se2 -","- C8 H7 N2 O Se2 -","- C64 H56 N16 O8 Se16 -","8","2","FG1061","Parvez, M.; Boeré, R. T.; Moock, K. H.","A Dimer of 4-(4-Methoxyphenyl)-1,2,3,5-diselenadiazole","Acta Crystallographica Section C","1995","51","10","2118","2121","10.1107/S0108270195004252","","","0.71069","MoKα","","","0.053","","","0.053","","","","","2.07","2.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003999","19.244","0.007","19.244","0.007","9.651","0.002","90","","90","","120","","3095.2","1.7","293","1","293","1","","","","","","","Synthesised by Gleiter et al, 1984","4","R -3 :H","-R 3","148","3,7-bis(tert-Butyl)-1,5,2,4,6,8-dithiatetrazocine","","","- C10 H18 N4 S2 -","- C10 H18 N4 S2 -","- C90 H162 N36 S18 -","9","0.5","FG1068","Parvez, M.; Boeré, R. T.; Derrick, S.; Moock, K. H.","3,7-Di-<i>tert</i>-butyl-1,5,2,4,6,8-dithiatetrazocine","Acta Crystallographica Section C","1995","51","10","2116","2118","10.1107/S010827019500521X","","","0.71069","MoKα","","0.0711","0.0384","","0.1339","0.1141","","","","0.952","0.984","0.984","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004000","9.992","0.001","13.743","0.002","14.885","0.002","90","","91.35","0.01","90","","2043.4","0.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[tricarbonyl(tri-isopropyl phosphite)cobalt] dichloromethane solvate","","- C25 H44 Cl2 Co2 O12 P2 -","- C25 H42 Cl1.98 Co2 O12 P2 -","- C50 H84 Cl3.96 Co4 O24 P4 -","2","0.5","FG1073","Farrar, D. H.; Lough, A. J.; Poë, A. J.; Stromnova, T. A.","Bis[tricarbonyl(triisopropyl phosphite)cobalt](<i>Co</i>—<i>Co</i>) Dichloromethane Solvate","Acta Crystallographica Section C","1995","51","10","2008","2010","10.1107/S0108270195005014","","","0.71073","MoKα","","0.1494","0.0472","","0.1428","0.107","","","","1.005","1.093","1.093","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004002","9.036","0.001","19.834","0.001","12.16","0.001","90","","100.81","0.01","90","","2140.6","0.3","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 Cl2 N8 O2 S2 -","- C14 H22 Cl2 N8 O2 S2 -","- C56 H88 Cl8 N32 O8 S8 -","4","1","HR1053","Urtiaga, M. K.; Arriortua, M. I.; García-Tojal, J.; Rojo, T.","Pyridine-2-carbaldehyde Thiosemicarbazone Hydrochloride Monohydrate, 2C~7~H~9~N~4~S^+^.2Cl^{-^}.2H~2~O","Acta Crystallographica Section C","1995","51","10","2172","2174","10.1107/S0108270195005324","","","0.71073","MoKα","","","0.064","","","0.1631","","","","","1.113","1.113","","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2004003","10.497","0.006","8.405","0.004","17.17","0.01","90","","95.59","0.03","90","","1507.7","1.4","293","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H15 N -","- C21 H15 N -","- C84 H60 N4 -","4","1","HU1097","Ahmet, M. T.; Miller, J. R.; Osborne, A. G.; Warmsley, J. F.","2,4-Diphenylquinoline and its Sterically Hindered Derivative 3-Methyl-2,4-diphenylquinoline","Acta Crystallographica Section C","1995","51","10","2105","2108","10.1107/S0108270195002794","","","0.71073","MoKα","","","0.0349","","","0.0359","","","","","0.253","0.253","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004004","8.273","0.002","10.248","0.003","11.113","0.002","111.87","0.02","103.61","0.01","101.35","0.02","806.5","0.4","293","","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H17 N -","- C22 H17 N -","- C44 H34 N2 -","2","1","HU1097","Ahmet, M. T.; Miller, J. R.; Osborne, A. G.; Warmsley, J. F.","2,4-Diphenylquinoline and its Sterically Hindered Derivative 3-Methyl-2,4-diphenylquinoline","Acta Crystallographica Section C","1995","51","10","2105","2108","10.1107/S0108270195002794","","","0.71073","MoKα","","","0.06","","","0.0631","","","","","0.478","0.478","","","","","has coordinates","198482","2020-10-21","18:00:00",""
"2004005","5.274","0.001","12.087","0.001","20.053","0.002","90","","90","","90","","1278.3","0.3","296","2","296","2","","","","","","","SIGMA Chemical Co.","4","P b c a","-P 2ac 2ab","61","DL- PROLINE MONOHYDRATE","DL- PROLINE MONOHYDRATE","","- C5 H11 N O3 -","- C5 H11 N O3 -","- C40 H88 N8 O24 -","8","1","HU1113","Padmanabhan, S.; Suresh, S.; Vijayan, M.","<small>DL</small>-Proline Monohydrate","Acta Crystallographica Section C","1995","51","10","2098","2100","10.1107/S0108270195003465","","","0.71068","MoKα","","0.0475","0.0391","","0.1107","0.1066","","","","1.049","1.098","1.098","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004006","12.563","0.003","14.083","0.004","15.308","0.003","90","","102.17","0.02","90","","2647.5","1.1","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Cyano-2-(2,3,6,7-tetramethoxy-10-diethylaminomethylphenanthr-9-yl)pyrrolidine","","- C29 H37 N3 O4 -","- C29 H37 N3 O4 -","- C116 H148 N12 O16 -","4","1","HU1121","Kabaleeswaran, V.; Rajan, S. S.; Thiruvalluvar, A.; Parthasarathi, V.","2-(10-Diethylaminomethyl-2,3,6,7-tetramethoxy-9-phenanthrylmethyl)-1-pyrrolidinecarbonitrile","Acta Crystallographica Section C","1995","51","10","2189","2192","10.1107/S0108270195003428","","","1.5418","CuKα","","","0.067","","","0.072","","","","","1.8","1.8","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2004007","3.8437","0.0003","3.8437","0.0003","12.688","0.0015","90","","90","","90","","187.45","0.03","296","2","296","2","","","","","","","","4","I 4/m m m","-I 4 2","139","strontium lanthanum gallate","strontium lanthanum gallate","","- Ga La O4 Sr -","- Ga La O4 Sr -","- Ga2 La2 O8 Sr2 -","2","0.0625","JZ1003","Britten, J. F.; Dabkowska, H. A.; Dabkowski, A. B.; Greedan, J. E.; Campbell, J. L.; Teesdale, W. J.","Czochralski-Grown SrLaGaO~4~","Acta Crystallographica Section C","1995","51","10","1975","1977","10.1107/S0108270194011820","","","0.56086","AgKα","","0.0324","0.0272","","0.0679","0.0662","","","","1.156","1.187","1.187","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004008","8.544","0.003","13.193","0.001","13.616","0.001","90","","90.23","0.02","90","","1534.8","0.6","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","stilbene-carbamate 1","4-[2-(4'-nitrophenyl)ethenyl]phenylcarbamic acid ethyl ester","","- C17 H16 N2 O4 -","- C17 H16 N2 O4 -","- C68 H64 N8 O16 -","4","1","JZ1028","Soto Bustamante, E. A.; Hanemann, T.; Haase, W.; Svoboda, I.; Fuess, H.","Two New Stilbene Carbamates","Acta Crystallographica Section C","1995","51","10","2192","2196","10.1107/S0108270195004847","","","0.71069","MoKα","","0.0555","","","0.1369","","","","","1.116","1.152","1.152","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004009","8.607","0.002","33.918","0.008","11.43","0.002","90","","90.54","0.02","90","","3336.6","1.2","301","2","301","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","stilbene-carbamate 2","4-[2-(2',4'-dinitrophenyl)ethenyl]phenylcarbamic acid ethyl ester","","- C17 H15 N3 O6 -","- C17 H15 N3 O6 -","- C136 H120 N24 O48 -","8","2","JZ1028","Soto Bustamante, E. A.; Hanemann, T.; Haase, W.; Svoboda, I.; Fuess, H.","Two New Stilbene Carbamates","Acta Crystallographica Section C","1995","51","10","2192","2196","10.1107/S0108270195004847","","","0.71069","MoKα","","0.0802","","","0.2022","","","","","1.044","1.011","1.011","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004010","12.38","0.01","10.11","0.01","11.44","0.01","123.2","0.1","77.9","0.1","100","0.1","1168","2","286","","288","","","","","","","","","5","P -1","-P 1","2","","bis(tetraphenylphosphonium) tetraazidodimethylstannate(II)","","- C50 H46 N12 P2 Sn -","- C50 H46 N12 P2 Sn -","- C50 H46 N12 P2 Sn -","1","0.5","JZ1036","Halfpenny, J.","Bis(tetraphenylphosphonium) Tetraazidodimethylstannate(IV)","Acta Crystallographica Section C","1995","51","10","2044","2046","10.1107/S0108270195005269","","","0.7107","MoKα","","","0.038","","","0.038","","","","","0.427","0.427","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004011","15.305","0.004","3.8628","0.0004","7.467","0.002","90","","105.34","0.04","90","","425.72","0.18","293","1","293","1","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Tantal(IV)oxiddiiodid","","- I2 O Ta -","- I2 O Ta -","- I8 O4 Ta4 -","4","0.5","JZ1041","Ruck, M.","TaOI~2~: Eine zentrosymmetrische Variante der NbOI~2~-Struktur","Acta Crystallographica Section C","1995","51","10","1960","1962","10.1107/S0108270195003799","","","0.71073","MoKα","","0.0894","0.0467","","0.0614","0.0539","","","","1.006","1.079","1.079","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004012","6.19","0.001","12.278","0.001","14.11","0.001","110.79","0.01","99.18","0.01","103.87","0.01","937.3","0.2","296","","","","","","","","","","see text","6","P -1","-P 1","2","","","","- C16 H22 Au O P Si -","- C16 H22 Au O P Si -","- C32 H44 Au2 O2 P2 Si2 -","2","1","JZ1043","Bauer, A.; Schier, A.; Schmidbaur, H.","(Methyldiphenylphosphine)(trimethylsiloxy)gold(I)","Acta Crystallographica Section C","1995","51","10","2030","2032","10.1107/S0108270195003775","","","0.71073","MoKα","","","0.0277","","","0.0303","","","","","1.24","1.24","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004013","14.397","0.001","17.432","0.001","8.535","0.001","90","","112.6","0.01","90","","1977.5","0.3","293","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H22 Cu N4 O5 -","- C20 H22 Cu0.5 N4 O4.5 -","- C80 H88 Cu2 N16 O18 -","4","0.5","JZ1045","Tosik, A.; Sieron, L.; Bukowska-Strzyzewska, M.","Heptacoordinate Cu^II^ in <i>catena</i>-Poly[aquabis(benzimidazole-<i>N</i>^3^)copper(II)-μ-adipato-<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section C","1995","51","10","1985","1987","10.1107/S0108270195005968","","","1.54184","CuKα","","","0.044","","","0.118","","","","","1.037","1.037","","","","","has coordinates,has disorder","192020","2020-10-21","18:00:00",""
"2004014","6.724","0.001","8.721","0.001","18.692","0.003","90","","90","","90","","1096.1","0.3","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H10 Cu N2 O5 -","- C10 H10 Cu N2 O5 -","- C40 H40 Cu4 N8 O20 -","4","1","JZ1046","Tosik, A.; Sieron, L.; Bukowska-Strzyzewska, M.","<i>catena</i>-Poly[aqua(benzimidazole-<i>N</i>^3^)copper(II)-μ-malonato-<i>O</i>,<i>O</i>'':<i>O</i>']","Acta Crystallographica Section C","1995","51","10","1987","1989","10.1107/S0108270195004707","","","1.54184","CuKα","","","0.0462","","","0.047","","","","","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004015","6.225","0.002","9.369","0.002","10.794","0.002","87.54","0.02","73.81","0.02","83.7","0.02","600.9","0.3","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H34 N2 O2 Si2 -","- C24 H34 N2 O2 Si2 -","- C24 H34 N2 O2 Si2 -","1","0.5","JZ1048","Pohl, E.; Herbst-Irmer, R.; Huhn, T.; Groth, U.","A Diaza-<i>cyclo</i>-tetradecadiene‒Bis(pyrido-silafuran) Ring System","Acta Crystallographica Section C","1995","51","10","2145","2147","10.1107/S0108270195005117","","","0.71073","MoKα","","0.062","0.0563","","0.1609","0.1506","","","","1.098","1.092","1.092","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004016","10.817","0.005","12.62","0.004","11.502","0.004","90","","91.44","0.02","90","","1569.6","1","293","","293","","","","","","","","","3","I 1 a 1","I -2ya","9","","","","- C19 H20 O2 -","- C19 H20 O2 -","- C76 H80 O8 -","4","1","KA1116","Judas, N.; Kaitner, B.; Mestrovic, E.","3,3-Dibenzylpentane-2,4-dione, C~19~H~20~O~2~","Acta Crystallographica Section C","1995","51","10","2123","2125","10.1107/S0108270195004690","","","0.7093","MolybdenumKα","","","0.032","","","0.043","","","","","1.06","1.06","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004017","11.683","0.002","12.388","0.003","15.978","0.003","75.62","0.03","86","0.03","65.12","0.03","2030.5","0.9","295","","","","","","","","","","see text","4","P -1","-P 1","2","","","","- C48 H24 Gd N13 -","- C48 H24 Gd N13 -","- C96 H48 Gd2 N26 -","2","1","KA1117","Janczak, J.; Kubiak, R.","Gadolinium(III) Bicyclic Phthalocyanine","Acta Crystallographica Section C","1995","51","10","2039","2042","10.1107/S0108270195005300","","","0.71073","MoKα","","","0.047","","","0.068","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004018","10.293","0.012","14.21","0.03","15.6","0.03","90","0.02","90","0.05","90","0.06","2282","7","295","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H30 N2 O4 -","- C24 H30 N2 O4 -","- C96 H120 N8 O16 -","4","1","KA1122","Weber, H. P.; Ettmayer, P.; Hübner, M.; Gstach, H.","(3<i>R</i>,4<i>S</i>,5<i>S</i>)-5-Benzyl-4-hydroxy-3-[1(<i>S</i>)-(1,1-dimethylethoxycarbonylamino)-2-phenylethyl]pyrrolidin-2-one","Acta Crystallographica Section C","1995","51","10","2139","2141","10.1107/S010827019500504X","","","1.54184","CuKα","","","0.068","","","0.069","","","","","3.113","3.113","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004019","9.065","0.001","21.295","0.003","21.976","0.003","90","","98.669","0.001","90","","4193.8","0.9","296","2","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H50 Cl Co2 La O20 P6 -","- C22 H50 Cl Co2 La O20 P6 -","- C88 H200 Cl4 Co8 La4 O80 P24 -","4","1","KH1012","Cho, I. Y.; Yeo, H. J.; Jeong, J. H.; Song, C. E.","Di(aqua)bis[(η^5^-cyclopentadienyl)tris(dimethylphosphito-<i>P</i>)cobalt-<i>O</i>,<i>O</i>',<i>O</i>'']lanthanum(III) Chloride","Acta Crystallographica Section C","1995","51","10","2035","2037","10.1107/S0108270195000473","","","0.71073","MoKα","","","0.039","","","0.048","","","","","1.068","1.068","","","","","has coordinates","191094","2020-10-21","18:00:00",""
"2004020","7.037","0.001","7.645","0.001","13.445","0.001","90","","90","","90","","723.31","0.15","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Hydrazinium L-tartrate","","- C4 H10 N2 O6 -","- C4 H10 N2 O6 -","- C16 H40 N8 O24 -","4","1","KH1026","Fun, H.-K.; Sivakumar, K.; Jiang, Y.-Z.; Sun, J.; Zhou, Z.-Y.","Hydrazinium <small>L</small>-Tartrate","Acta Crystallographica Section C","1995","51","10","2085","2087","10.1107/S0108270195005488","","","0.71073","MoKα","","0.0363","0.0314","","0.0811","0.0791","","","","0.989","1.053","1.053","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004021","9.082","0.002","10.778","0.002","11.088","0.003","76.93","0.01","83.41","0.01","80.78","0.01","1040.1","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","7-dimethylamino-4-methylcoumarin","","- C12 H13 N O2 -","- C12 H13 N O2 -","- C48 H52 N4 O8 -","4","2","KH1033","Yip, B.-C.; Yaw, O.-L.; Ong, L.-H.; Fun, H.-K.; Sivakumar, K.","Coumarin 311","Acta Crystallographica Section C","1995","51","10","2087","2089","10.1107/S0108270195005476","","","0.71073","MoKα","","0.0658","0.0523","","0.1688","0.1688","","","","1.116","1.241","1.241","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004022","5.425","0.001","17.618","0.002","12.173","0.002","90","","97.07","0.02","90","","1154.6","0.3","293","","","","","","","","","","synthesis and recrystallization","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 O S -","- C14 H12 O S -","- C56 H48 O4 S4 -","4","1","KH1036","Wong, W.-T.; Lee, S.-M.","2-(Phenylmethylthio)benzaldehyde","Acta Crystallographica Section C","1995","51","10","2137","2139","10.1107/S0108270195005981","","","0.71073","MoKα","","","0.038","","","0.062","","","","","1.912","1.912","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004023","27.511","0.005","6.666","0.003","17.351","0.003","90","","115.3","0.03","90","","2876.8","1.6","296","","296","","","","","","","","synthesized at UMIST","4","C 1 2/c 1","-C 2yc","15","","Ethyl-6,7-bis(trifluoromethyl)isocumarin-3-carboxylate","","- C14 H8 F6 O4 -","- C14 H8 F6 O4 -","- C112 H64 F48 O32 -","8","1","LI1134","Abubakar, A. B.; Pritchard, R. G.; Suliman, N. N. E.; Tipping, A. E.","Ethyl 6,7-Bis(trifluoromethyl)isocoumarin-3-carboxylate: Formed by a Novel Diels‒Alder Cycloaddition Involving Two Different α,β-Unsaturated Esters","Acta Crystallographica Section C","1995","51","10","2100","2102","10.1107/S0108270195004781","","","0.71069","MoKα","","","0.068","","","0.042","","","","","1.93","1.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004024","9.426","0.002","17.744","0.004","12.137","0.002","90","","102.04","0.03","90","","1985.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bromodichloromethylphenylmercury","","","- C7 H5 Br Cl2 Hg -","- C7 H5 Br1.002 Cl1.998 Hg -","- C56 H40 Br8.016 Cl15.984 Hg8 -","8","2","MD1001","Bachman, R. E.; Maughon, B. R.; McCord, D. J.; Whitmire, K. H.; Billups, W. E.","(Bromodichloromethyl)phenylmercury","Acta Crystallographica Section C","1995","51","10","2033","2035","10.1107/S0108270195004501","","","0.71073","MoKα","","0.1367","0.0467","","0.0957","0.0738","","","","1.037","1.099","1.099","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004025","8.127","0.005","9.952","0.002","9.992","0.003","72.17","0.02","76.76","0.03","68.31","0.03","708.7","0.5","293","","","","","","","","","","recrystallized from chloroform","5","P -1","-P 1","2","","","","- C14 H12 I N Te -","- C14 H12 I N Te -","- C28 H24 I2 N2 Te2 -","2","1","MU1134","Hamor, T. A.; Maslakov, A. G.; McWhinnie, W. R.","1-Iodo-2-<i>p</i>-tolyl-1-tellura-2-azaindene","Acta Crystallographica Section C","1995","51","10","2062","2064","10.1107/S0108270194010802","","","0.71069","MoKα","","","0.0278","","","0.0382","","","","","0.67","0.67","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004026","15.967","0.001","15.967","0.001","15.348","0.004","90","","90","","90","","3912.9","1.1","296","","296","","","","","","","","","7","I 41/a :2","-I 4ad","88","","poly[bis-{μ~2~-(bromo)-copper(I)}-bis-μ~3~-(N,N-diethyldithiocarbamato- S,S,S',S')platinum(II)]","","- C10 H20 Br2 Cu2 N2 Pt S4 -","- C10 Br2 Cu2 N2 Pt0.5 S4 -","- C80 Br16 Cu16 N16 Pt4 S32 -","8","0.5","MU1152","Tokoro, K.; Ebihara, M.; Kawamura, T.","(Cu<i>X</i>)~<i>n~</i> Helical Chains in [Pt(S~2~CNEt~2~)~2~Cu~2~<i>X</i>~2~] (<i>X</i> = Br, Cl)","Acta Crystallographica Section C","1995","51","10","2010","2013","10.1107/S0108270195001855","","","0.7107","MolybdenumKα","","","0.045","","","0.041","","","","","1.56","1.56","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004027","15.835","0.002","15.835","0.002","15.037","0.003","90","","90","","90","","3770.5","1","296","","296","","","","","","","","","7","I 41/a :2","-I 4ad","88","","poly[bis-{μ~2~-(chloro)-copper(I)}-bis-μ~3~-(N,N-diethyldithiocarbamato- S,S,S',S')-platinum(II)]","","- C10 H20 Cl2 Cu2 N2 Pt S4 -","- C10 Cl2 Cu2 N2 Pt0.5 S4 -","- C80 Cl16 Cu16 N16 Pt4 S32 -","8","0.5","MU1152","Tokoro, K.; Ebihara, M.; Kawamura, T.","(Cu<i>X</i>)~<i>n~</i> Helical Chains in [Pt(S~2~CNEt~2~)~2~Cu~2~<i>X</i>~2~] (<i>X</i> = Br, Cl)","Acta Crystallographica Section C","1995","51","10","2010","2013","10.1107/S0108270195001855","","","0.7107","MolybdenumKα","","","0.038","","","0.037","","","","","1.73","1.73","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004028","17.55","0.012","11.75","0.008","18.531","0.009","90","","91.52","0.04","90","","3820","4","150","0.2","150","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4,7,10,13-pentaoxa-16,19-dithiacyclohenicosane sesquihydrate","","- C14 H31 O6.5 S2 -","- C14 H31 O6.5 S2 -","- C112 H248 O52 S16 -","8","2","MU1168","Blake, A. J.; Gould, R. O.; Harris, S. G.; Parsons, S.; Radek, C.; Schröder, M.","1,4,7,10,13-Pentaoxa-16,19-dithiacyclohenicosane Sesquihydrate at 150 K","Acta Crystallographica Section C","1995","51","10","2186","2189","10.1107/S0108270195005142","","","0.71073","Mo-Kα","","0.1352","0.0714","","0.2805","0.1766","","","","1.097","1.172","1.172","","","","","has coordinates,has disorder","194562","2020-10-21","18:00:00",""
"2004029","10.859","0.002","18.443","0.003","15.299","0.005","90","","92.66","0.02","90","","3060.7","1.3","293","2","293","2","","","","","","","see below","6","P 1 21/n 1","-P 2yn","14","","Tris(diethyldithiocarbamato)-4-methoxyphenyltellurium(IV)","","- C22 H37 N3 O S6 Te -","- C22 H37 N3 O S6 Te -","- C88 H148 N12 O4 S24 Te4 -","4","1","MU1172","Husebye, S.; Lindeman, S. V.","Tris(diethyldithiocarbamato)(4-methoxyphenyl)tellurium(IV), <i>p</i>-MeOC~6~H~4~Te(S~2~CNEt~2~)~3~, and the Triclinic Modification of Tris(diethyldithiocarbamato)phenyltellurium(IV), PhTe(S~2~CNEt~2~)~3~","Acta Crystallographica Section C","1995","51","10","2152","2157","10.1107/S0108270195005154","","","0.71069","MoKα","","0.1063","0.0328","","0.1631","0.0849","","","","1.093","1.07","1.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004030","11.1827","0.0007","16.0827","0.0015","17.383","0.0013","108.3","0.007","100.623","0.006","96.12","0.006","2871.6","0.4","293","2","293","2","","","","","","","see below","5","P -1","-P 1","2","","Tris(diethyldithiocarbamato)phenyltellurium(IV)","","- C21 H35 N3 S6 Te -","- C21 H35 N3 S6 Te -","- C84 H140 N12 S24 Te4 -","4","2","MU1172","Husebye, S.; Lindeman, S. V.","Tris(diethyldithiocarbamato)(4-methoxyphenyl)tellurium(IV), <i>p</i>-MeOC~6~H~4~Te(S~2~CNEt~2~)~3~, and the Triclinic Modification of Tris(diethyldithiocarbamato)phenyltellurium(IV), PhTe(S~2~CNEt~2~)~3~","Acta Crystallographica Section C","1995","51","10","2152","2157","10.1107/S0108270195005154","","","0.71069","MoKα","","0.0814","0.0327","","0.1085","0.0797","","","","1.066","1.118","1.118","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004031","17.067","0.007","8.425","0.003","9.597","0.004","90","","90","","90","","1379.9","0.9","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","(3S,4R,7S,8R,9R)-4-methyl-7-(2-propyl)-4,5,6,7,8,9-hexahydro-2-oxo- 3-benzofuranoic acid","","- C13 H20 O4 -","- C13 H20 O4 -","- C52 H80 O16 -","4","1","MU1174","Adovasio, V.; Nardelli, M.; Chelucci, G.; Saba, A.","Configuration and Conformation of (3<i>S</i>,3a<i>R</i>,4<i>R</i>,7<i>S</i>,7a<i>S</i>)-4-Methyl-7-(2-propyl)-2-oxo-2,3,3a,4,5,6,7,7a-octahydro-3-benzofurancarboxylic Acid","Acta Crystallographica Section C","1995","51","10","2166","2169","10.1107/S0108270195005361","","","1.54178","Cu-Kα","","0.0977","0.038","","0.1298","0.0891","","","","0.817","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004032","6.922","0.001","12.297","0.001","6.922","0.001","90","","113.85","0.01","90","","538.89","0.13","293","","293","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C6 H8 Cu N6 O8 -","- C6 H8 Cu N6 O8 -","- C12 H16 Cu2 N12 O16 -","2","0.5","MU1175","Simonsen, O.; la Cour, A.","A Copper‒Nitromalonamide Complex","Acta Crystallographica Section C","1995","51","10","2006","2008","10.1107/S0108270195005270","","","0.71073","MoKα","","0.031","0.027","","0.027","0.027","","","","7.287","7.678","7.678","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004033","11.103","0.004","13.223","0.007","17.079","0.006","90","","95.29","0.04","90","","2496.8","1.8","296","","","","","","","","","","see text","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H24 Mn N3 O4 -","- C29 H24 Mn N3 O4 -","- C116 H96 Mn4 N12 O16 -","4","1","MU1177","Xiong, R.-G.; You, X.-Z.; Wu, Q.-J.; Huang, X.-Y.","Tris(8-quinolinolato-<i>N</i>,<i>O</i>)manganese(III) Ethanol Solvate","Acta Crystallographica Section C","1995","51","10","1978","1980","10.1107/S0108270195005373","","","0.71069","MoKα","","","0.064","","","0.069","","","","","1.42","1.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004034","10.668","0.001","14.687","0.002","18.82","0.002","90","","90","","90","","2948.7","0.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-phenyl-6,7,8,9-tetrahydro-[1,2,4]triazolo-[4,3-a]thieno[3,2-e]pyrimidin- 5(4H)-one.","","- C17 H14 N4 O S -","- C17 H13.4 N4 O S -","- C136 H107.2 N32 O8 S8 -","8","1","MU1178","Velavan, R.; Sivakumar, K.; Pathak, U. S.; Jain, K. S.; Singh, S.; Fun, H.-K.","4-Phenyl-6,7,8,9-tetrahydro-[1]benzothieno[3,2-<i>e</i>][1,2,4]triazolo[4,3-<i>a</i>]pyrimidin-5(4<i>H</i>)-one","Acta Crystallographica Section C","1995","51","10","2092","2094","10.1107/S0108270195005129","","","0.71073","MoKα","","0.0459","0.0341","","0.0996","0.0938","","","","1.037","1.112","1.112","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004035","6.85","0.004","12.852","0.005","15.537","0.005","90","","96.33","0.04","90","","1359.5","1.1","291","","","","","","","","","","see text","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H8 Au B Cl2 F4 N2 -","- C10 H8 Au B Cl2 F4 N2 -","- C40 H32 Au4 B4 Cl8 F16 N8 -","4","1","MU1181","McInnes, E. J. L.; Welch, A. J.; Yellowlees, L. J.","2,2'-Bipyridinedichlorogold(III) Tetrafluoroborate","Acta Crystallographica Section C","1995","51","10","2023","2025","10.1107/S0108270195005099","","","0.71073","MoKα","","","0.0437","","","0.0592","","","","","1.284","1.284","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004036","30.195","0.004","30.195","0.004","14.871","0.002","90","","90","","120","","11742","3","293","2","293","2","","","","","","","","5","R 3 :H","R 3","146","","Tetrameric copper(II) complex of 6-hydroxy-1-phenyl-3-methyl-4-azahexa-3- en-1-one","","- C48 H52 Cu4 N4 O8 -","- C48 H52 Cu4 N4 O8 -","- C432 H468 Cu36 N36 O72 -","9","1","MU1182","Fun, H.-K.; Yip, B.-C.; Song, B.-L.; Xiong, R.-G.; You, X.-Z.","Tetrameric Copper(II) Complex of 6-Hydroxy-3-methyl-1-phenyl-4-azahexa-3-en-1-one","Acta Crystallographica Section C","1995","51","10","1980","1982","10.1107/S0108270195005634","","","0.71073","MoKα","","0.0566","0.0473","","0.1342","0.1294","","","","1.036","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004037","10.2314","0.0009","12.1988","0.0013","12.4854","0.0006","89.937","0.006","102.916","0.006","111.827","0.007","1404.2","0.2","298","","298","2","","","","","","","","5","P -1","-P 1","2","","Bromotriphenyl(diphenylcyclopropenone)lead","","- C33 H25 Br O Pb -","- C33 H25 Br O Pb -","- C66 H50 Br2 O2 Pb2 -","2","1","MU1189","Ng, S. W.","Bromo(diphenylcyclopropenone)triphenyllead","Acta Crystallographica Section C","1995","51","10","2042","2044","10.1107/S0108270195005397","","","0.71073","MoKα","","0.1276","0.0545","","0.1069","0.0846","","","","1.025","1.091","1.091","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004038","7.45","0.002","13.184","0.002","10.388","0.001","90","","100.87","0.01","90","","1002","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Cd(Sacch)~2~(NH~3~)~4~","Tetra-amminebis(1,2-benzisothiazol-3(2H)-one 1,1-dioxide)-N-cadmium","","- C14 H20 Cd N6 O6 S2 -","- C14 H20 Cd N6 O6 S2 -","- C28 H40 Cd2 N12 O12 S4 -","2","0.5","NA1152","Pascual, I.","Tetraamminebis(saccharinato-<i>N</i>)cadmium","Acta Crystallographica Section C","1995","51","10","2028","2030","10.1107/S0108270195002903","","","0.71073","MoKα","","0.2006","0.0651","","0.1208","0.0908","","","","1.036","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004039","49.34","0.01","10.675","0.002","9.372","0.002","90","","98.22","0.02","90","","4885.6","1.7","293","","293","","","","","","","","Janssen Research Foundation, Beerse, Belgium","5","C 1 c 1","C -2yc","9","","1-[(4-Fluorophenyl)methyl]-N-[1-[2-(4-methoxyphenyl)ethyl]-4-piperidinyl]- 1H-benzimidazol-2-amine","","- C28 H31 F N4 O -","- C28 H31 F N4 O -","- C224 H248 F8 N32 O8 -","8","2","NA1156","Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","1-[(4-Fluorophenyl)methyl]-<i>N</i>-{1-[2-(4-methoxyphenyl)ethyl]-4-piperidyl}-1<i>H</i>-benzimidazol-2-amine (Astemizole)","Acta Crystallographica Section C","1995","51","10","2132","2135","10.1107/S0108270195004331","","","1.54184","CuKα","","0.0547","0.0396","","0.1225","0.1065","","","","1.054","1.067","1.067","","","","","has coordinates","198442","2020-10-21","18:00:00",""
"2004040","6.139","0.003","9.231","0.005","13.273","0.004","90","","97.26","0.05","90","","746.1","0.6","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H9 N S2 -","- C6 H9 N S2 -","- C24 H36 N4 S8 -","4","1","NA1157","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","Five-, Six- and Seven-Membered-Ring Substituted Thiazolidine-2-thione","Acta Crystallographica Section C","1995","51","10","2113","2116","10.1107/S010827019500432X","","","0.71073","MoKα","","","0.036","","","0.044","","","","","1.356","1.356","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004041","5.359","0.002","10.433","0.005","16.812","0.006","90","","91.49","0.04","90","","939.6","0.7","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H13 N S2 -","- C8 H13 N S2 -","- C32 H52 N4 S8 -","4","1","NA1157","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","Five-, Six- and Seven-Membered-Ring Substituted Thiazolidine-2-thione","Acta Crystallographica Section C","1995","51","10","2113","2116","10.1107/S010827019500432X","","","0.71073","MoKα","","","0.036","","","0.0431","","","","","0.793","0.793","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004042","8.629","0.003","12.282","0.006","8.844","0.003","90","","98.02","0.04","90","","928.1","0.6","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H13 N S2 -","- C8 H13 N S2 -","- C32 H52 N4 S8 -","4","1","NA1157","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","Five-, Six- and Seven-Membered-Ring Substituted Thiazolidine-2-thione","Acta Crystallographica Section C","1995","51","10","2113","2116","10.1107/S010827019500432X","","","0.71073","MoKα","","","0.047","","","0.052","","","","","1.406","1.406","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004043","13.544","0.003","6.8416","0.0008","14.2204","0.0006","90","","94.044","0.008","90","","1314.4","0.3","150","2","150","2","","","","","","","Chemical synthesis","5","P 1 21/a 1","-P 2yab","14","","trimethyl[(trimethylstannyl)methyl]ammoniumiodide","","- C7 H20 I N Sn -","- C7 H20 I N Sn -","- C28 H80 I4 N4 Sn4 -","4","1","NA1164","Cox, P. J.; Wardell, J. L.","Trimethyl[(trimethylstannyl)methyl]ammonium Iodide","Acta Crystallographica Section C","1995","51","10","2037","2039","10.1107/S0108270195004495","","","0.71069","MoKα","","0.0395","0.034","","0.096","0.086","","","","0.92","0.979","0.979","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004044","10.184","0.002","13.362","0.001","16.429","0.001","90","","90","","90","","2235.6","0.5","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H34 O4 -","- C25 H34 O4 -","- C100 H136 O16 -","4","1","NA1165","Puliti, R.; De Rosa, S.; Mattia, C. A.","Studies on Avarol Derivatives. 2',5'-Diacetylavarol from <i>Dysidea Avara</i>","Acta Crystallographica Section C","1995","51","10","2163","2166","10.1107/S0108270195004720","","","1.54056","CuKα","","","0.047","","","0.055","","","","","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004045","32.885","0.003","8.983","0.002","19.043","0.002","90","","101.49","0.01","90","","5512.7","1.5","208","2","208","2","","","","","","","[TcNCl~2~(Me~2~PhP)~3~] + NaEt~2~dtp","7","C 1 2/c 1","-C 2yc","15","","Dichloro(O,O'-diethyldithiophosphato-S,S')- bis(dimethylphenylphosphine)technetium(III)","","- C20 H32 Cl2 O2 P3 S2 Tc -","- C20 H32 Cl2 O2 P3 S2 Tc -","- C160 H256 Cl16 O16 P24 S16 Tc8 -","8","1","NA1169","Abram, U.; Abram, S.; Dilworth, J. R.","<i>trans</i>-Dichloro(<i>O</i>,<i>O</i>'-diethyldithiophosphato-<i>S</i>,<i>S</i>')bis(dimethylphenylphosphine)technetium(III)","Acta Crystallographica Section C","1995","51","10","1983","1985","10.1107/S0108270195005063","","","0.7093","MoKα","","0.0377","0.0271","","0.0753","0.0689","","","","1.068","1.074","1.074","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004046","8.5973","0.0005","16.592","0.0008","30.202","0.002","90","","90","","90","","4308.2","0.4","293","","293","","","","","","","","Janssen Research Foundation, Beerse, Belgium","6","P 21 21 21","P 2ac 2ab","19","","(+)-(S)-4-[(2-Benzothiazolyl)methylamino]-α-[(3,4-difluorophenoxy)methyl]- piperidineethanol","","- C22 H25 F2 N3 O2 S -","- C25 H26.5 F3 N3 O2 S -","- C200 H212 F24 N24 O16 S8 -","8","2","NA1175","Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","(+)-(<i>S</i>)-1-{4-[(2-Benzothiazolyl)(methyl)amino]piperidyl}-3-(3,4-difluorophenoxy)-2-propanol (Lubeluzole)","Acta Crystallographica Section C","1995","51","10","2129","2132","10.1107/S0108270195005439","","","1.54184","CuKα","","0.0591","0.0524","","0.1541","0.154","","","","1.039","1.038","1.038","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004047","7.653","0.004","15.98","0.01","17.57","0.01","90","","90","","90","","2149","2","293","","293","","","","","","","","Kali-Chemie, Pharma GmbH, Hannover, Germany","5","P b c 21","P 2c -2b","29","","1,8-Dimethyl-2-[(3-furancarbonyl)aminomethyl]-5-phenyl- 2,3-dihydro-1H-1,4-benzodiazepin-4-ium Chloride","","- C23 H24 Cl N3 O2 -","- C23 H24 Cl N3 O2 -","- C92 H96 Cl4 N12 O8 -","4","1","NA1182","Blaton, N. M.; Peeters, O. M.; De Ranter, C. J.","1,8-Dimethyl-2-(3-furanoylaminomethyl)-5-phenyl-2,3-dihydro-1<i>H</i>-1,4-benzodiazepin-4-ium Chloride","Acta Crystallographica Section C","1995","51","10","2177","2179","10.1107/S0108270195006949","","","1.54184","CuKα","","0.0344","0.0334","","0.0885","0.0885","","","","1.068","1.068","1.068","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004048","11.631","0.003","11.066","0.001","10.563","0.002","90","","99.04","0.02","90","","1342.7","0.5","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H16 Co N5 O7 -","- C8 H16 Co N5 O7 -","- C32 H64 Co4 N20 O28 -","4","1","NS1000","Egan, T. J.; Baldwin, D. A.; Denner, L.; Levendis, D. C.; Marques, H. M.","Guanidinium β-<i>cis</i>-(Carbonato-<i>O</i>,<i>O</i>')(<i>N</i>,<i>N</i>'-ethylenediaminediacetato-<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>'')cobaltate(III)","Acta Crystallographica Section C","1995","51","10","1994","1997","10.1107/S010827019500463X","","","0.71073","MoKα","","","0.0349","","","0.081","","","","","0.906","0.906","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004049","10.253","0.001","13.061","0.001","16.593","0.001","112.94","0.01","99.4","0.01","91.09","0.01","2010.5","0.3","200","2","200","2","","","","","","","ethanol","6","P -1","-P 1","2","","2,4,6-Tris(2-pyridyl)-1,3,5-triazyllithium tetraphenylborate bis(ethanol) solvate","","- C46 H44 B Li N6 O2 -","- C46 H44 B Li N6 O2 -","- C92 H88 B2 Li2 N12 O4 -","2","1","NS1001","Schödel, H.; Van, T. T. H.; Bock, H.","2,4,6-Tris(2-pyridyl)-1,3,5-triazine‒Lithium Tetraphenylborate Bis(ethanol) Solvate","Acta Crystallographica Section C","1995","51","10","2001","2004","10.1107/S0108270195004641","","","0.71073","MoKα","","0.0851","0.06","","0.181","0.1547","","","","1.021","1.073","1.073","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004050","16.636","0.003","16.733","0.003","17.19","0.003","90","","98.25","0.01","90","","4735.7","1.5","296","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C64 H144 Ag2 I4 N4 O19 W6 -","- C64 Ag2 I4 N4 O19 W6 -","- C128 Ag4 I8 N8 O38 W12 -","2","0.5","OH1075","Hou, H.-W.; Ye, X.; Xin, X.; Wang, Z.; Liu, S.; Huang, J.","Tetrabutylammonium Di-μ-iodo-bis(iodoargentate) Hexatungstate, [^<i>n^</i>Bu~4~N]~4~[Ag~2~I~4~][W~6~O~19~]","Acta Crystallographica Section C","1995","51","10","2013","2015","10.1107/S0108270195005038","","","0.71073","MoKα","","","0.038","","","0.047","","","","","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004052","9.845","0.002","11.513","0.004","3.775","0.001","90","","90","","90","","427.9","0.2","295","","","","","","","","","","see text","4","P b a m","-P 2 2ab","55","","","","- O8 S2 Sm2 Ta3 -","- O8 S2 Sm2 Ta4 -","- O16 S4 Sm4 Ta8 -","2","0.25","OH1081","Guo, G.; Wang, Y.; Chen, J.; Zhuang, H.; Huang, J.; Zhang, Q.","Samarium Tantalum Oxysulfide, Sm~2~Ta~3~S~2~O~8~","Acta Crystallographica Section C","1995","51","10","1964","1966","10.1107/S0108270195005026","","","0.71069","MoKα","","","0.058","","","0.076","","","","","1.33","1.33","","","","","has coordinates","208743","2020-10-21","18:00:00",""
"2004053","7.6178","0.0009","7.6178","0.0009","7.2537","0.0007","90","","90","","120","","364.54","0.07","297","","","","","","","","","","see text","4","R 3 2 :H","R 3 2""","155","","","","- Ba H3 I O6 -","- Ba H3 I O6 -","- Ba3 H9 I3 O18 -","3","0.166667","OH1082","Sasaki, M.; Yarita, T.; Sato, S.","Ba[H~3~IO~6~]","Acta Crystallographica Section C","1995","51","10","1968","1970","10.1107/S0108270195004744","","","0.71069","MoKα","","","0.011","","","0.014","","","","","1.29","1.29","","","","","has coordinates","211153","2020-10-21","18:00:00",""
"2004054","12.2439","0.0012","10.6348","0.0009","14.0329","0.0013","90","","117.964","0.006","90","","1613.9","0.3","293","2","293","2","","","","","","","Laboratory of Medicinal Chemistry, Li\`ege","5","C 1 2/c 1","-C 2yc","15","","3-methyl-4H-pyrido[2,3-e]-1,2,4-thiadiazine 1,1-dioxide","","- C7 H7 N3 O2 S -","- C7 H7 N3 O2 S -","- C56 H56 N24 O16 S8 -","8","1","PA1157","Dupont, L.; Pirotte, B.; de Tullio, P.; Masereel, B.; Delarge, J.","3-Methyl-4<i>H</i>-pyrido[2,3-<i>e</i>]-1,2,4-thiadiazine 1,1-Dioxide","Acta Crystallographica Section C","1995","51","10","2064","2066","10.1107/S0108270194014447","","","1.5418","CuKα","","0.0324","0.0284","","0.0784","0.0769","","","","1.034","1.084","1.084","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2004055","8.156","0.002","13.017","0.003","13.035","0.003","90","","89.81","0.02","90","","1383.9","0.6","293","","","","","","","","","","synthesis","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 N4 O3 -","- C14 H14 N4 O3 -","- C56 H56 N16 O12 -","4","1","PA1163","Souron, J.-P.; Quarton, M.; Robert, F.; Lyubchova, A.; Cosse-Barbi, A.; Doucet, J. P.","Pyridoxal Isonicotinoyl Hydrazone (PIH), a Synthetic Ion-Chelating Agent","Acta Crystallographica Section C","1995","51","10","2179","2182","10.1107/S0108270195004586","","","0.71069","MoKα","","","0.0389","","","0.0383","","","","","1.138","1.138","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004056","8.448","0.002","9.383","0.003","21.14","0.007","90","","90","","90","","1675.7","0.9","293","","293","","","","","","","","chemical synthesis","6","P 21 21 21","P 2ac 2ab","19","","(1S,2R,3R,4S)-N-methyl-1,2-oxydo-3-methyl-4-phenyl-1,2,3,4- tetrahydroisoquinolinium","","- C17 H18 B F4 N O -","- C17 H18 B F4 N O -","- C68 H72 B4 F16 N4 O4 -","4","1","PA1171","Chiaroni, A.; Hanquet, G.; Lusinchi, M.; Riche, C.","First X-ray Determination of an Oxaziridinium Salt: (1<i>S</i>,2<i>R</i>,3<i>R</i>,4<i>S</i>)-2,3-Dimethyl-4-phenyl-1,2,3,4-tetrahydro-1,2-epoxyisoquinolinium Tetrafluoroborate and (1<i>S</i>,2<i>R</i>,3<i>R</i>,4<i>S</i>)-3-Methyl-4-phenyl-1,2,3,4-tetrahydro-2,3-epoxyisoquinoline","Acta Crystallographica Section C","1995","51","10","2047","2050","10.1107/S0108270195004604","","","1.5418","CuKα","","","0.097","","","0.083","","","","","1.05","1.05","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004057","9.13","0.007","15.082","0.012","9.506","0.007","90","","100.36","0.03","90","","1287.6","1.7","293","","293","","","","","","","","chemical synthesis","4","P 1 21 1","P 2yb","4","","(1S,2R,3R,4S)-1,2-oxydo-3-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinoline","","- C16 H15 N O -","- C16 H15 N O -","- C64 H60 N4 O4 -","4","2","PA1171","Chiaroni, A.; Hanquet, G.; Lusinchi, M.; Riche, C.","First X-ray Determination of an Oxaziridinium Salt: (1<i>S</i>,2<i>R</i>,3<i>R</i>,4<i>S</i>)-2,3-Dimethyl-4-phenyl-1,2,3,4-tetrahydro-1,2-epoxyisoquinolinium Tetrafluoroborate and (1<i>S</i>,2<i>R</i>,3<i>R</i>,4<i>S</i>)-3-Methyl-4-phenyl-1,2,3,4-tetrahydro-2,3-epoxyisoquinoline","Acta Crystallographica Section C","1995","51","10","2047","2050","10.1107/S0108270195004604","","","1.5418","CuKα","","","0.045","","","0.06","","","","","0.81","0.81","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004058","8.517","0.006","15.512","0.009","25.925","0.014","90","","90","","90","","3425","4","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","11-12 dihydro, 7-triethylsilyl, 10-deacetylbaccatin III.","","- C35 H52 O10 Si -","- C35 H52 O10 Si -","- C140 H208 O40 Si4 -","4","1","PA1173","Chiaroni, A.; Riche, C.; Marder, R.; Dubois, J.; Guénard, D.; Guéritte-Voegelein, F.","A 10-Deacetylbaccatin III Derivative: 11,12-Dihydro-7-triethylsilyl-10-deacetylbaccatin III","Acta Crystallographica Section C","1995","51","10","2050","2053","10.1107/S0108270195004616","","","1.5418","CuKα","","","0.041","","","0.056","","","","","0.96","0.96","","","","","has coordinates,has disorder","190593","2020-10-21","18:00:00",""
"2004059","12.801","0.001","7.819","0.001","15.169","0.002","90","","101.08","0.01","90","","1490","0.3","293","","","","","","","","","","see prep","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H22 N2 O2 -","- C15 H22 N2 O2 -","- C60 H88 N8 O8 -","4","1","PA1179","Aubry, A.; Brembilla, A.; Faivre, V.; Lochon, P.","2-Hydroxymethyl-1-pentylbenzimidazole Hemi(1,4-dioxane) Solvate","Acta Crystallographica Section C","1995","51","10","2147","2148","10.1107/S0108270195006688","","","1.5418","CuKα","","","0.044","","","0.046","","","","","4.34","4.34","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004060","10.712","0.004","9.902","0.001","19.562","0.003","90","","101.25","0.02","90","","2035.1","0.9","290","","290","","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C13 H12 O -","- C13 H11 O -","- C104 H88 O8 -","8","4","PA1180","Rajnikant; Watkin, D.; Tranter, G.","Biphenyl-2-methanol","Acta Crystallographica Section C","1995","51","10","2161","2163","10.1107/S0108270195005002","","","1.54184","CuKα","","","0.0706","","","0.0764","","","","","1.18","1.18","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004061","8.77","0.02","20.42","0.03","13.17","0.02","90","","90","","90","","2359","7","200","2","200","2","","","","","","","isolated from needles of Taxus chinensis; after CC-separation and purification recrystallisation from n-hexane/ EtOH.","3","P 21 21 21","P 2ac 2ab","19","","2α,5α,9α-Trihydroxy-10β,13α-diacetoxy-4b,20-epoxy-taxa-11-ene","","- C24 H36 O8 -","- C24 H36 O8 -","- C96 H144 O32 -","4","1","SE1076","Wiedenfeld, H.; Knoch, F.; Zhang, Z. P.","2α,5α,9α-Trihydroxy-10β,13α-diacetoxy-4β,20-epoxy-taxa-11-en, ein neues Taxan aus <i>Taxus chinensis</i>","Acta Crystallographica Section C","1995","51","10","2184","2186","10.1107/S010827019500429X","","","0.71073","MoKα","","0.0847","0.0393","","0.0957","0.0837","","","","0.708","1.049","1.049","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004062","9.759","0.001","27.561","0.001","8.941","0.001","90","","114.87","0.01","90","","2181.8","0.4","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H30 N O P S -","- C21 H30 N O P S -","- C84 H120 N4 O4 P4 S4 -","4","1","SH1109","Wieczorek, W.","[3,3-Dimethyl-1-(2-pyridylthio)butyl]methyl(2,4,6-trimethylphenyl)phosphine Oxide","Acta Crystallographica Section C","1995","51","10","2108","2110","10.1107/S0108270195004100","","","1.54184","CuKα","","","0.049","","","0.053","","","","","2.03","2.03","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004063","11.35","0.003","13.838","0.003","10.509","0.003","90","","100.15","0.02","90","","1624.7","0.7","296","","","","","","","","","","Recrystallization from ether/petroleum ether at 253 K","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 Br O2 -","- C20 H17 Br O2 -","- C80 H68 Br4 O8 -","4","1","SZ1004","Lloyd, B. A.; Arif, A. M.; Coots, R. J.; Allred, E. L.","A Structure with Through-Space Cyclopropyl π-Interaction","Acta Crystallographica Section C","1995","51","10","2059","2062","10.1107/S0108270195003477","","","0.71073","MoKα","","","0.0622","","","0.0625","","","","","2.3818","2.3818","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004064","9.3901","0.0015","18.497","0.003","4.2114","0.0005","90.65","0.01","102.86","0.01","73.09","0.01","681.17","0.18","294","","","","","","","","","","","3","P -1","-P 1","2","","","","- C20 H14 O2 -","- C20 H14 O2 -","- C40 H28 O4 -","2","1","SZ1006","Zacharias, D. E.; Glusker, J. P.; Harvey, R. G.","4,5-Dihydrobenzo[<i>a</i>]pyrene-4,5-<i>trans</i>-(<i>e</i>,<i>e</i>)-diol","Acta Crystallographica Section C","1995","51","10","2096","2098","10.1107/S0108270195003489","","","1.5418","CuKα","","","0.045","","","0.058","","","","","0.85","0.85","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004065","5.564","0.002","17.816","0.011","17.028","0.009","90","","92.1","0.04","90","","1686.8","1.5","288","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 O10 -","- C15 H20 O10 -","- C60 H80 O40 -","4","1","SZ1017","Baughman, R. G.; Sands, R. D.","Methyl 1-Hydroxy-2,4,6-trimethoxycarbonyl-3-oxo-1-cyclohexaneacetate","Acta Crystallographica Section C","1995","51","10","2068","2071","10.1107/S0108270195003532","","","0.71073","MoKα","","","0.071","","","0.127","","","","","1.027","1.027","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004066","5.923","0.001","6.803","0.001","19.554","0.005","90","","90","0.03","90","","787.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-dicyclohexyl-dithiooxamide.","","- C14 H24 N2 S2 -","- C14 H24 N2 S2 -","- C28 H48 N4 S4 -","2","0.5","SZ1025","Perec, M.; Baggio, R.; Garland, M. T.","<i>N</i>,<i>N</i>'-Dicyclohexyldithiooxamide","Acta Crystallographica Section C","1995","51","10","2182","2184","10.1107/S0108270195006391","","","0.71073","MoKα","","0.0262","0.0254","","0.0747","0.0645","","","","0.267","0.234","0.234","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004067","5.394","0.002","11.725","0.002","20.062","0.005","90","","95.48","0.02","90","","1263","0.6","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","dicyclohexylammonium chloride","","- C12 H24 Cl N -","- C12 H24 Cl N -","- C48 H96 Cl4 N4 -","4","1","TA1015","Ng, S. W.","Dicyclohexylammonium Chloride","Acta Crystallographica Section C","1995","51","10","2149","2150","10.1107/S0108270195003131","","","0.71073","MoKα","","0.0629","0.0398","","0.1027","0.0929","","","","1.039","1.107","1.107","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004068","10.664","0.002","9.829","0.004","20.058","0.002","90","","105.315","0.005","90","","2027.7","0.9","298","","298","","","","","","","","","5","P 1 2/a 1","-P 2ya","13","","bis(dicyclohexylammonium trithiocarbodiglycolate trithiocarbodiglycolic acid","","- C17 H29 N O4 S3 -","- C17 H29 N O4 S3 -","- C68 H116 N4 O16 S12 -","4","1","TA1016","Ng, S. W.","Bis(dicyclohexylammonium) Trithiocarbodiglycolate Trithiocarbodiglycolic Acid","Acta Crystallographica Section C","1995","51","10","2150","2152","10.1107/S010827019500312X","","","0.71073","MoKα","","0.0849","0.0435","","0.1186","0.0999","","","","0.992","1.067","1.067","","","","","has coordinates","196234","2020-10-21","18:00:00",""
"2004069","6.732","0.002","24.375","0.004","12.027","0.003","90","","115.1","0.02","90","","1787.2","0.8","293","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 O4 -","- C21 H22 O4 -","- C84 H88 O16 -","4","1","VJ1022","Magotra, D. K.; Gupta, V. K.; Rajnikant; Goswami, K. N.; Thappa, R. K.","Archangelin","Acta Crystallographica Section C","1995","51","10","2196","2198","10.1107/S0108270195005506","","","0.71073","MoKα","","","0.051","","","0.154","","","","","0.679","0.679","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004070","13.538","0.003","10.798","0.003","24.646","0.002","90","","91.4","0.03","90","","3601.8","1.3","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H20 Ca N10 O14 -","- C36 H20 Ca N10 O13.9 -","- C144 H80 Ca4 N40 O55.6 -","4","1","AB1176","Vijayvergiya, V.; Padmanabhan, B.; Singh, T. P.","<i>trans</i>-Bis(1,10-phenanthroline)-<i>trans</i>-bis(2,4,6-trinitrophenolato-<i>O</i>,<i>O</i>')calcium(II)","Acta Crystallographica Section C","1995","51","11","2235","2238","10.1107/S0108270195005233","","","1.54184","CuKα","","","0.061","","","0.061","","","","","1.59","1.59","","","","","has coordinates","192027","2020-10-21","18:00:00",""
"2004071","16.4845","0.0007","8.0579","0.0004","21.8436","0.0013","90","","98.812","0.005","90","","2867.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","endo-5-methyl-exo-6-phenylseleno-endo-tricyclo[5.2.1.0^2,6^]deca-8-en-3-one","","- C17 H18 O Se -","- C17 H18 O Se -","- C136 H144 O8 Se8 -","8","2","AB1222","Moers, F. G.; Smits, J. M. M.; Beurskens, P. T.; Zhu, J.; Klunder, A. J. H.","<i>endo</i>-5-Methyl-<i>exo</i>-6-phenylseleno-<i>endo</i>-tricyclo[5.2.1.0^2,6^]dec-8-en-3-one","Acta Crystallographica Section C","1995","51","11","2335","2338","10.1107/S0108270195006251","","","0.71073","MoKα","","0.1784","0.0584","","0.0928","0.0685","","","","1.101","1.293","1.293","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004072","15.011","0.008","8.862","0.004","9.068","0.004","90","","107.5","0.02","90","","1150.5","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","diglycyl-glycine methyl ester hydrochloride","","","- C7 H14 Cl N3 O4 -","- C7 H14 Cl N3 O4 -","- C28 H56 Cl4 N12 O16 -","4","1","AB1258","Handelsman-Benory, E.; Botoshansky, M.; Kaftory, M.","Hydrogen Bonding in Glycyl-glycyl-glycine Methyl Ester Hydrochloride","Acta Crystallographica Section C","1995","51","11","2362","2364","10.1107/S0108270195005646","","","0.71069","MoKα","","0.0646","0.0484","","0.1541","0.1394","","","","1.045","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004073","10.857","0.003","11.445","0.002","13.916","0.003","87.51","0.02","80.91","0.02","73.42","0.03","1636.5","0.7","294","","","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H19 Cl N O3 P -","- C16 H19 Cl N O3 P -","- C64 H76 Cl4 N4 O12 P4 -","4","2","AB1259","Liu, X.-L.; Zhou, Y.; Li, W.-Z.; Fan, Z.; Miao, F.-M.; Mao, L.-J.; Chen, R.-Y.","Dimethyl [α-(Benzylamino)-<i>p</i>-chlorobenzyl]phosphonate","Acta Crystallographica Section C","1995","51","11","2350","2352","10.1107/S0108270195005245","","","0.71073","MoKα","","","0.055","","","0.056","","","","","1.51","1.51","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004074","8.142","0.009","17.617","0.008","10.479","0.004","90","","107.23","0.07","90","","1435.6","1.9","296","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H32 N4 Ni O4 P2 S4 -","- C18 H32 N4 Ni O4 P2 S4 -","- C36 H64 N8 Ni2 O8 P4 S8 -","2","0.5","AB1261","Huang, X.-Y.; Xiong, R.-G.; You, X.-Z.","The Adduct of Bis(<i>O</i>,<i>O</i>'-diethyl dithiophosphato)nickel(II) with 3-Aminopyridine","Acta Crystallographica Section C","1995","51","11","2261","2263","10.1107/S0108270195004999","","","0.71073","MoKα","","","0.04","","","0.051","","","","","1.42","1.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004079","9.025","0.003","6.695","0.001","7.721","0.001","90","","116.18","0.01","90","","418.66","0.17","293","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- F11 Na Zn Zr2 -","- F11 Na Zn Zr2 -","- F22 Na2 Zn2 Zr4 -","2","0.25","AB1265","Kettani, M. H.; Avignant, D.; Metin, J.","Na<i>M</i>^II^Zr~2~F~11~ (<i>M</i>^II^ = Mn, Fe, Co, Ni, Zn) Fluorides","Acta Crystallographica Section C","1995","51","11","2207","2210","10.1107/S0108270195006081","","","0.71073","MoKα","","","0.028","","","0.035","","","","","1.23","1.23","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004080","12.38","0.002","11.194","0.002","26.892","0.005","90","","90","","90","","3726.7","1.1","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","1,2;3,4-Bis(8',11'-dioxa[4.3.3]propella(3',4'))benzene","1H,3H,4H,7H,8H,10H,11H,12H-3a,12a:7a,10a-Bis(methanoxymethano)phenanthro [2,3-c:6,7-c']difuran","","- C22 H26 O4 -","- C22 H26 O4 -","- C176 H208 O32 -","8","2","AB1266","Stadnicka, K.; Zeslawski, W.","1,2;3,4-Bis{8',11'-dioxa[4.3.3]propella(3',4')}benzene: a Bis(propellene) from Prehnitene","Acta Crystallographica Section C","1995","51","11","2377","2381","10.1107/S0108270195007402","","","0.7093","MoKα~1~","","0.0593","0.0317","","0.0809","0.0709","","","","1.066","1.146","1.146","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004081","12.666","0.001","8.552","0.002","8.034","0.002","90","","95.49","0.01","90","","866.2","0.3","173","1","173","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,6-dimethylanilinium chloride","2,6-dimethylphenylammonium chloride","","- C8 H12 Cl N -","- C8 H12 Cl N -","- C32 H48 Cl4 N4 -","4","1","AB1275","Linden, A.; James, B. D.; Liesegang, J.","2,6-Dimethylphenylammonium Chloride at 173 and 293 K","Acta Crystallographica Section C","1995","51","11","2317","2320","10.1107/S0108270195007918","","","0.71069","MoKα","","0.0509","0.0342","","0.0438","0.0413","","","","","1.669","1.669","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004082","12.766","0.002","8.566","0.001","8.136","0.001","90","","94.84","0.01","90","","886.5","0.2","293","1","293","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,6-dimethylanilinium chloride","2,6-dimethylphenylammonium chloride","","- C8 H12 Cl N -","- C8 H12 Cl N -","- C32 H48 Cl4 N4 -","4","1","AB1275","Linden, A.; James, B. D.; Liesegang, J.","2,6-Dimethylphenylammonium Chloride at 173 and 293 K","Acta Crystallographica Section C","1995","51","11","2317","2320","10.1107/S0108270195007918","","","0.71069","MoKα","","0.1203","0.0465","","0.045","0.039","","","","","1.801","1.801","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004083","9.502","0.003","9.98","0.004","10.68","0.004","90","","90","","90","","1012.8","0.6","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 N O -","- C11 H15 N O -","- C44 H60 N4 O4 -","4","1","AB1286","Hibbs, D. E.; Hursthouse, M. B.; Malik, K. M. A.","({-})-(1<i>S</i>,3<i>R</i>,4<i>R</i>,6<i>S</i>)-4,7,7-Trimethyl-5-oxobicyclo[4.1.0]heptane-3-carbonitrile","Acta Crystallographica Section C","1995","51","11","2315","2317","10.1107/S0108270195008316","","","0.71069","MoKα","","0.039","0.0365","","0.0881","0.0876","","","","1.096","1.132","1.132","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004084","11.529","0.004","17.725","0.005","7.172","0.005","90","","90","","90","","1465.6","1.2","173","1","173","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","methyl 2,2^1^-anhydro-4,6-O-benzylidene-3-deoxy-3-C-[(R)-2-hydroxyethyl]- α-D-allopyranoside","","- C16 H20 O5 -","- C16 H20 O5 -","- C64 H80 O20 -","4","1","AB1289","Linden, A.; Lee, C. K.","Methyl 2,2^1^-Anhydro-4,6-<i>O</i>-benzylidene-3-deoxy-3-<i>C</i>-[(<i>R</i>)-2-hydroxyethyl]-α-<small>D</small>-<i>allo</i>-pyranoside at 173 K","Acta Crystallographica Section C","1995","51","11","2320","2322","10.1107/S0108270195008997","","","0.71069","MoKα","","0.0777","0.0453","","0.0432","0.0399","","","","","1.598","1.598","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2004085","9.005","0.001","9.416","0.001","9.269","0.001","90","","90.58","0.01","90","","785.89","0.15","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-diethyl thiourea","","- C5 H12 N2 S -","- C5 H12 N2 S -","- C20 H48 N8 S4 -","4","1","AS1179","Ramnathan, A.; Sivakumar, K.; Subramanian, K.; Janarthanan, N.; Ramadas, K.; Fun, H.-K.","Symmetrically Substituted Thiourea Derivatives","Acta Crystallographica Section C","1995","51","11","2446","2450","10.1107/S010827019500607X","","","0.71073","MoKα","","0.1003","0.0723","","0.2364","0.2153","","","","1.021","1.199","1.199","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004086","10.463","0.002","9.276","0.002","10.596","0.003","90","","107.83","0.02","90","","979","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-diisopropyl thiourea","","- C7 H16 N2 S -","- C7 H16 N2 S -","- C28 H64 N8 S4 -","4","1","AS1179","Ramnathan, A.; Sivakumar, K.; Subramanian, K.; Janarthanan, N.; Ramadas, K.; Fun, H.-K.","Symmetrically Substituted Thiourea Derivatives","Acta Crystallographica Section C","1995","51","11","2446","2450","10.1107/S010827019500607X","","","0.71073","MoKα","","0.0477","0.0395","","0.1153","0.1116","","","","1.058","1.131","1.131","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004087","7.951","0.002","25.576","0.009","5.689","0.002","90","","90","","90","","1156.9","0.6","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","1,3-diphenyl thiourea","","- C13 H12 N2 S -","- C13 H12 N2 S -","- C52 H48 N8 S4 -","4","0.5","AS1179","Ramnathan, A.; Sivakumar, K.; Subramanian, K.; Janarthanan, N.; Ramadas, K.; Fun, H.-K.","Symmetrically Substituted Thiourea Derivatives","Acta Crystallographica Section C","1995","51","11","2446","2450","10.1107/S010827019500607X","","","0.71073","MoKα","","0.1221","0.0676","","0.2088","0.1775","","","","0.933","1.108","1.108","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004088","7.949","0.001","9.071","0.002","14.032","0.004","77.58","0.02","77.73","0.02","64.18","0.01","881.3","0.4","298","3","","","","","","","","","","6","P -1","-P 1","2","","","","- C9 H24 Cl2 Cu N4 O8 -","- C9 H24 Cl2 Cu N4 O8 -","- C18 H48 Cl4 Cu2 N8 O16 -","2","1","AS1183","Lu, T.-H.; Liu, Y.-L.; Chung, C.-S.","Diperchlorato[(2<i>RS</i>,5<i>SR</i>,9<i>RS</i>,12<i>RS</i>)-2,5,9,12-tetraazatridecane]copper(II)","Acta Crystallographica Section C","1995","51","11","2275","2277","10.1107/S0108270195006226","","","0.71073","MoKα","","","0.034","","","0.036","","","","","0.98","0.98","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004089","7.693","0.002","9.178","0.001","22.982","0.004","90","","116.59","0.02","90","","1451","0.5","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","theophilline p-nitroaniline complex","","","- C13 H14 N6 O4 -","- C13 H14 N6 O4 -","- C52 H56 N24 O16 -","4","1","AS1190","Zaitu, S.; Miwa, Y.; Taga, T.","1:1 Molecular Complex of Theophylline and <i>p</i>-Nitroaniline","Acta Crystallographica Section C","1995","51","11","2390","2392","10.1107/S010827019500864X","","","1.54178","CuKα","","","0.07","","","0.075","","","","","0.8","0.8","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2004090","11.518","0.001","11.518","0.001","19.966","0.004","90","","90","","120","","2293.9","0.5","294","","21","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C12 H36 Fe N3 O15 S6 -","- C12 H36 Fe N3 O18 S6 -","- C36 H108 Fe3 N9 O54 S18 -","3","0.166667","BK1054","Tzou, J.-R.; Mullaney, M.; Norman, R. E.; Chang, S.-C.","Hexakis(dimethyl sulfoxide-<i>O</i>)iron(III) Trinitrate","Acta Crystallographica Section C","1995","51","11","2249","2252","10.1107/S0108270195005695","","","0.7107","MoKα","","","0.0435","","","0.054","","","","","5.165","5.165","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004091","7.467","0.002","8.161","0.003","10.717","0.002","80.81","0.02","73.64","0.02","71.71","0.02","593.1","0.3","297","","","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H14 N4 O6 Zn -","- C6 H14 N4 O6 Zn -","- C12 H28 N8 O12 Zn2 -","2","1","BK1082","Yar, O.; Lessinger, L.","Bis(acetato-<i>O</i>)bis(urea-<i>O</i>)zinc(II), [Zn(H~2~NCONH~2~)~2~(CH~3~COO)~2~]","Acta Crystallographica Section C","1995","51","11","2282","2285","10.1107/S0108270195006974","","","0.71069","MoKα","","0.0423","0.0319","","","0.0806","","","","","1.052","1.052","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004092","11.416","0.001","11.749","0.001","14.501","0.001","105.08","0.01","109.83","0.01","95.33","0.01","1731.1","0.3","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C76 H60 Au2 N6 P4 S4 -","- C76 H60 Au2 N6 P4 S4 -","- C76 H60 Au2 N6 P4 S4 -","1","0.5","BK1099","Assefa, Z.; Staples, R. J.; Fackler, Jnr, J. P.","Bis[bis(triphenylphosphoranylidene)ammonium] Bis[cyanodithiocarbimatogold(I)], [PPN]~2~[Au~2~(S~2~CNCN)~2~]","Acta Crystallographica Section C","1995","51","11","2271","2273","10.1107/S0108270195004628","","","0.71073","MoKα","","","0.029","","","0.038","","","","","1.014","1.014","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004093","7.643","0.001","11.578","0.002","13.117","0.002","69.69","0.05","80.57","0.06","86.87","0.05","1073.9","0.5","297","","297","","","","","","","","","5","P -1","-P 1","2","","1-Amino-2-nitro-4,5-bis(p-toluenesulfonamido)-benzene","","- C20 H20 N4 O6 S2 -","- C20 H20 N4 O6 S2 -","- C40 H40 N8 O12 S4 -","2","1","BK1112","Bolger, J.; Gourdon, A.","1-Amino-2-nitro-4,5-bis(<i>p</i>-toluenesulfonamido)benzene","Acta Crystallographica Section C","1995","51","11","2395","2397","10.1107/S0108270195006950","","","0.71069","MoKα","","","0.034","","","0.034","","","","","2.13","2.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004094","5.682","0.002","7.186","0.006","17.775","0.002","90","","92.75","0.02","90","","724.9","0.7","294.2","","294.2","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H28 Cl N -","- C12 H28 Cl N -","- C24 H56 Cl2 N2 -","2","1","BK1118","Silver, J.; Marsh, P. J.; Frampton, C. S.","<i>n</i>-Dodecylammonium Chloride","Acta Crystallographica Section C","1995","51","11","2432","2434","10.1107/S0108270195006858","","","0.7107","MoKα","","","0.035","","","0.0307","","","","","1.928","1.928","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004095","8.6495","0.0014","9.857","0.002","12.375","0.003","102.11","0.02","89.77","0.02","104.65","0.02","996.7","0.4","293","","293","","","","","","","","","4","P -1","-P 1","2","","4-methyl-1,2,3,5-diselenadiazolyl","","- C4 H6 N4 Se4 -","- C4 H6 N4 Se4 -","- C16 H24 N16 Se16 -","4","2","BK1120","Bryan, C. D.; Cordes, A. W.; Oakley, R. T.; von Spence, R. E.","4,4'-Dimethyl-1,1'-bi(1,2,3,5-diselenadiazole)","Acta Crystallographica Section C","1995","51","11","2402","2404","10.1107/S0108270195006147","","","0.71073","MoKα","","0.133","0.047","","0.081","0.064","","","","","0.98","0.98","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004096","8.2444","0.0015","10.7401","0.0013","20.049","0.003","90","","95.057","0.014","90","","1768.3","0.5","294","1","294","1","","","","","","","","5","P 1 21 1","P 2yb","4","","3,3,7,7,10,10-Hexaphenyl-2,4,6,8,9,11-hexaoxa-1,5-diarsa-3,7,10-trisila- bicyclo[3,3,3]undecane","","- C36 H30 As2 O6 Si3 -","- C36 H30 As2 O6 Si3 -","- C72 H60 As4 O12 Si6 -","2","1","BK1128","Ferguson, G.; O'Leary, B.; Spalding, T. R.","An As~2~Si~3~O~6~ Cage Compound, 3,3,7,7,10,10-Hexaphenyl-2,4,6,8,9,11-hexaoxa-1,5-diarsa-3,7,10-trisilabicyclo[3.3.3]undecane","Acta Crystallographica Section C","1995","51","11","2312","2315","10.1107/S0108270195006159","","","0.7107","MolybdenumKα","","0.043","0.029","","0.04","0.038","","","","","1.06","1.06","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004097","15.163","0.003","28.912","0.008","16.286","0.006","90","","91.02","0.02","90","","7139","4","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C72 H84 Fe2 N12 O9 -","- C72 H84 Fe2 N12 O9 -","- C288 H336 Fe8 N48 O36 -","4","1","BK1130","Schaefer, W. P.; Ellis, P. E.; Lyons, J. E.; Shaikh, S. N.","A μ-Oxo-bis[iron(III) porphyrin] Complex","Acta Crystallographica Section C","1995","51","11","2252","2255","10.1107/S0108270195005701","","","0.71073","MoKα","","","","","","0.013","","","","","1.4","1.4","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004098","8.388","0.002","10.527","0.002","19.73","0.004","90","","90","","90","","1742.2","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Benzyl-1-deoxy-1-(hydroxyamino)-2,3-O-diisopropylidene-1- (N-methylimidazol-2-yl)-D-threo-triitol.","","- C17 H23 N3 O3 -","- C17 H23 N3 O3 -","- C68 H92 N12 O12 -","4","1","BK1141","Merino, P.; Merchan, F. L.; Tejero, T.","Chiral Hydroxylamines. I. 1-(<i>N</i>-Benzyl-<i>N</i>-hydroxyamino)-1-deoxy-2,3-<i>O</i>-isopropylidene-1-(1-methylimidazol-2-yl)-<small>D</small>-<i>threo</i>-triitol","Acta Crystallographica Section C","1995","51","11","2400","2401","10.1107/S0108270195006962","","","0.71073","MoKα","","0.0854","0.0467","","0.1251","0.1027","","","","1.029","1.063","1.063","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004099","11.5304","0.0006","12.2492","0.0005","10.2645","0.0006","90","","91.89","0.01","90","","1448.95","0.13","296","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis-(5-chloro-2-nitrophenyl)-disulphide","","- C12 H6 Cl2 N2 O4 S2 -","- C12 H6 Cl2 N2 O4 S2 -","- C48 H24 Cl8 N8 O16 S8 -","4","0.5","BK1145","Garcia, J. G.; Haydar, S. N.; Krapcho, A. P.; Fronczek, F. R.","Bis(5-chloro-2-nitrophenyl) Disulfide","Acta Crystallographica Section C","1995","51","11","2333","2335","10.1107/S0108270195008055","","","0.71073","MoKα","","","0.033","","","0.044","","","","","2.173","2.173","","","","","has coordinates","198476","2020-10-21","18:00:00",""
"2004100","6.658","0.001","11.528","0.002","5.695","0.002","101.47","0.03","95.59","0.02","92.24","0.02","425.58","0.19","295","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H6 As N O6 -","- C6 H3 As N O6 -","- C12 H6 As2 N2 O12 -","2","1","BM1011","Nuttall, R. H.; Hunter, W. N.","Redetermination of 4-Hydroxy-3-nitrobenzenearsonic Acid","Acta Crystallographica Section C","1995","51","11","2342","2344","10.1107/S0108270195007542","","","1.54184","CuKα","","","0.058","","","0.082","","","","","1.06","1.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004101","8.568","0.009","9.333","0.004","11.972","0.013","75.52","0.08","69.61","0.07","80.45","0.07","865.6","1.4","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-acetato-κO:κO')-bis(1,5,9-triazacyclododecane-2,4-dione-N^9^)- dicopper(II)","","- C26 H46 Cu2 N6 O12 -","- C26 H46 Cu2 N6 O12 -","- C26 H46 Cu2 N6 O12 -","1","0.5","BM1015","Clarke, A. J.; Carmichael, A. J.; Errington, W.; Moore, P.","Tetrakis(μ-acetato-<i>O</i>:<i>O</i>')bis(1,5,9-triazacyclododecane-2,4-dione-<i>N</i>^9^)dicopper(II)(<i>Cu</i>—<i>Cu</i>)","Acta Crystallographica Section C","1995","51","11","2279","2282","10.1107/S0108270195006512","","","0.71073","MoKα","","0.0524","0.0358","","0.1257","0.0863","","","","1.201","1.068","1.068","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004102","7.019","0.001","7.019","0.001","12.925","0.002","90","","90","","120","","551.46","0.14","296","","296","","","","","","","","","5","P 32 2 1","P 32 2""","154","sodium cerium sulfate monohydrate","","","- Ce H2 Na O9 S2 -","- Ce H2 Na O10 S2 -","- Ce3 H6 Na3 O30 S6 -","3","0.5","BR1102","Blackburn, A. C.; Gerkin, R. E.","Redetermination of Sodium Cerium(III) Sulfate Monohydrate, NaCe(SO~4~)~2~.H~2~O","Acta Crystallographica Section C","1995","51","11","2215","2218","10.1107/S0108270195006135","","","0.71073","MoKα","","","0.017","","","0.03","","","","","1.72","1.72","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004103","11.991","0.005","20.666","0.002","24.082","0.004","67.616","0.01","77.54","0.02","87.58","0.02","5383","3","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","fac-Tricarbonyl-tris(triphenyl phospite)molybdenum","","- C57 H45 Mo O12 P3 -","- C57 H45 Mo O12 P3 -","- C228 H180 Mo4 O48 P12 -","4","2","CF1001","Alyea, E. C.; Ferguson, G.; Song, S.-Q.","<i>fac</i>-Tricarbonyltris(triphenyl phosphite)molybdenum(0)","Acta Crystallographica Section C","1995","51","11","2238","2242","10.1107/S0108270195006603","","","0.7107","MolybdenumKα","","0.2479","0.0908","","0.22","0.1694","","","","0.808","1.154","1.154","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004104","4.5232","0.0008","10.5764","0.001","14.8003","0.0014","90","","90","","90","","708.03","0.16","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Bromo-3-deoxy-D-erythro-hex-2-enono-1,5-lactone and 2-Chloro-3-deoxy-D-erythro-hex-2-enono-1,5-lactone","","- C6 H7 Br0.34 Cl0.66 O3 -","- C6 H7 Br0.339 Cl0.661 O3 -","- C24 H28 Br1.356 Cl2.644 O12 -","4","1","CF1006","Fun, H.-K.; Sivakumar, K.; Ang, H.-B.; Sam, T.-W.; Gan, E.-K.","A 2:1 Solid Solution of 6-Chloro-2,3,6-trideoxy-<small>D</small>-<i>erythro</i>-hex-2-enono-1,5-lactone and its 6-Bromo Analogue","Acta Crystallographica Section C","1995","51","11","2450","2453","10.1107/S0108270195006615","","","0.71073","MoKα","","0.0508","0.0347","","0.0864","0.0821","","","","0.938","1.046","1.046","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004105","22.031","0.018","14.474","0.018","6.002","0.005","90","","90.42","0.1","90","","1914","3","220","2","220","2","","","","","","","","5","C 1 c 1","C -2yc","9","","3-[3'-(4-bromophenyl)-1'-phenylpyrazol-5'-yl] 2H-1-benzopyran-2-one","","- C24 H15 Br N2 O2 -","- C24 H15 Br N2 O2 -","- C96 H60 Br4 N8 O8 -","4","1","CF1011","Singh, S. K.; Kumar, N.; Malhotra, S.; Bisht, K. S.; Parmar, V. S.; Errington, W.","3-[3-(4-Bromophenyl)-1-phenylpyrazol-5-yl]-2<i>H</i>-1-benzopyran-2-one","Acta Crystallographica Section C","1995","51","11","2406","2407","10.1107/S0108270195007438","","","0.71073","MoKα","","0.0832","0.0832","","0.1623","0.1623","","","","1.062","1.062","1.062","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004106","30.061","0.014","7.218","0.004","14.283","0.008","90","","103.26","0.04","90","","3017","3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-phenyl-3-(4-methylphenyl)-5-cyanomethylpyrazole","","- C18 H15 N3 -","- C18 H15 N3 -","- C144 H120 N24 -","8","2","CF1012","Singh, S. K.; Kumar, A.; Vats, A.; Bisht, K. S.; Parmar, V. S.; Errington, W.","5-Cyanomethyl-3-(4-methylphenyl)-1-phenylpyrazole","Acta Crystallographica Section C","1995","51","11","2404","2406","10.1107/S0108270195007773","","","0.71073","MoKα","","0.1053","0.1053","","0.194","0.194","","","","1.035","1.035","1.035","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004107","25.585","0.0014","11.841","0.002","8.012","0.003","90","","104.03","0.02","90","","2354.8","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","9-(carboxymethyl)-2,6-dichloropurine ethyl ester","","- C9 H8 Cl2 N4 O2 -","- C9 H8 Cl2 N4 O2 -","- C72 H64 Cl16 N32 O16 -","8","1","CF1024","Chan, D. M. C.; Schwalbe, C. H.; Sood, G.; Fraser, W.","9-(Carboxymethyl)-2,6-dichloropurine Ethyl Ester. An Intermediate for Peptidic Nucleic Acid Synthesis","Acta Crystallographica Section C","1995","51","11","2383","2386","10.1107/S0108270195008705","","","0.71069","MoKα","","0.0682","0.0353","","0.1064","0.0906","","","","1.015","1.048","1.048","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004108","17.411","0.002","15.756","0.002","10.593","0.001","90","","107.19","0.01","90","","2776.1","0.6","300","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C35 H32 Co P -","- C35 H32 Co P -","- C140 H128 Co4 P4 -","4","1","CR1111","Fujita, T.; Uekusa, H.; Ohkubo, A.; Shimura, T.; Aramaki, K.; Nishihara, H.; Ohba, S.","Two Cobaltacyclopentadiene Complexes and One Cyclobutadiene Complex","Acta Crystallographica Section C","1995","51","11","2265","2269","10.1107/S0108270195005993","","","0.71073","MoKα","","","0.036","","","0.041","","","","","1.56","1.56","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004109","15.31","0.002","22.997","0.003","11.928","0.001","90","","103.35","0.01","90","","4086.2","0.8","297","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C55 H40 Co P -","- C55 H40 Co P -","- C220 H160 Co4 P4 -","4","1","CR1111","Fujita, T.; Uekusa, H.; Ohkubo, A.; Shimura, T.; Aramaki, K.; Nishihara, H.; Ohba, S.","Two Cobaltacyclopentadiene Complexes and One Cyclobutadiene Complex","Acta Crystallographica Section C","1995","51","11","2265","2269","10.1107/S0108270195005993","","","0.71073","MoKα","","","0.065","","","0.059","","","","","1.82","1.82","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004110","16.459","0.004","28.668","0.004","10.269","0.003","90","","100.54","0.02","90","","4764","2","300","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C49 H57 Co Si4 -","- C49 H57 Co Si4 -","- C196 H228 Co4 Si16 -","4","1","CR1111","Fujita, T.; Uekusa, H.; Ohkubo, A.; Shimura, T.; Aramaki, K.; Nishihara, H.; Ohba, S.","Two Cobaltacyclopentadiene Complexes and One Cyclobutadiene Complex","Acta Crystallographica Section C","1995","51","11","2265","2269","10.1107/S0108270195005993","","","0.71073","MoKα","","","0.06","","","0.083","","","","","2.64","2.64","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004111","6.86","0.008","18.938","0.002","16.224","0.004","90","","92.78","0.07","90","","2105","3","296","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H50 N2 Ni O4 P2 S4 -","- C36 H52 N2 Ni O4 P2 S4 -","- C72 H104 N4 Ni2 O8 P4 S8 -","2","0.5","CR1171","Xiong, R.-G.; You, X.-Z.; Huang, X.-Y.","The Adduct of Bis(<i>O</i>,<i>O</i>'-dibutyl dithiophosphato)nickel(II) with Isoquinoline","Acta Crystallographica Section C","1995","51","11","2263","2265","10.1107/S0108270195006019","","","0.71069","MoKα","","","0.049","","","0.058","","","","","1.27","1.27","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004112","13.758","0.005","5.391","0.001","16.844","0.004","90","","93","0.03","90","","1247.6","0.6","296","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 -","- C18 H16 -","- C72 H64 -","4","0.5","CR1180","Schaefer, W. P.; Abulū, J.","An Indanyl Precursor to a Chiral Spiro Compound","Acta Crystallographica Section C","1995","51","11","2364","2366","10.1107/S0108270195005609","","","0.71073","MoKα","","","","","","","","","","","2.95","2.95","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004113","10.989","0.004","20.086","0.003","11.058","0.003","90","","110.5","0.3","90","","2286","5","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H23 N O5 S -","- C25 H23 N O5 S -","- C100 H92 N4 O20 S4 -","4","1","CR1183","Krishnaiah, M.; Jagadeesh Kumar, N.; Bhaskar Reddy, D.; Muralidhar Reddy, M.; Soriano, M.; Chen, Y.-S.; Narasinga Rao, S.","Methyl 6-Benzoyl-3,5-diphenyl-1,4-thiomorpholine-2-carboxylate 1,1-Dioxide","Acta Crystallographica Section C","1995","51","11","2426","2428","10.1107/S010827019500583X","","","0.71073","MoKα","","","0.056","","","0.073","","","","","1.46","1.46","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004114","13.049","0.001","10.411","0.001","12.317","0.003","90","","105.5","0.1","90","","1612.4","0.9","293","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C16 H24 O5 -","- C16 H24 O5 -","- C64 H96 O20 -","4","1","CR1184","Selladurai, S.; Subramanian, K.; Lakshmi, S.; Rajagopalan, K.; Chen, Y. S.; Yang, J.; Narasinga Rao, S.","5,5-Dimethyl-1,3-dioxacyclohexane-2-spiro(2',γ-dimethyl-3'-oxo-2'-cyclohexaneacrylic Acid)","Acta Crystallographica Section C","1995","51","11","2424","2426","10.1107/S0108270195005555","","","0.71073","MoKα","","","0.05","","","0.062","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004115","17.5076","0.0001","6.6859","0.0001","13.0147","0.0001","90","","94.48","0.01","90","","1518.77","0.03","23","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H11 Cl O4 S -","- C17 H11 Cl O4 S -","- C68 H44 Cl4 O16 S4 -","4","1","CR1186","Krishnaiah, M.; Narayana Raju, K. V.; Lu, I-L.; Chen, Y.-S.; Narasinga Rao, S.","3-[2-(4-Chlorophenylsulfonyl)ethenyl]-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section C","1995","51","11","2429","2430","10.1107/S0108270195006597","","","0.71073","MoKα","","","0.033","","","0.05","","","","","1.48","1.48","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004116","7.6922","0.0005","14.1688","0.0008","19.3663","0.0011","90","","90","","90","","2110.7","0.2","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","9α-fluoro-11β-hydroxy-16α-methylandrosta-1,4-diene-3,17-dione 2-butynoate","","- C24 H27 F O4 -","- C24 H27 F O4 -","- C96 H108 F4 O16 -","4","1","CR1188","Brock, C. P.; Song, J.","9α-Fluoro-16α-methyl-3,17-dioxoandrosta-1,4-dien-11β-yl 2-Butynoate","Acta Crystallographica Section C","1995","51","11","2437","2439","10.1107/S0108270195006020","","","0.71073","MoKα","","0.0908","0.0387","","0.1065","0.0897","","","","1","1.108","1.108","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004117","10.3828","0.0007","12.2813","0.0007","10.931","0.0009","90","","91.207","0.006","90","","1393.55","0.17","295","1","295","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-phenyl-2,4,6-triazatricyclo[5.4.2.0^2,6^]tridec-12-ene-3,5-dione","","- C16 H17 N3 O2 -","- C16 H17 N3 O2 -","- C64 H68 N12 O8 -","4","1","CR1189","Brock, C. P.; Demir, A. S.; Watt, D. S.","An Almost Planar Hydrazine Moiety in a Diels‒Alder Adduct","Acta Crystallographica Section C","1995","51","11","2434","2437","10.1107/S010827019500624X","","","0.71073","MoKα","","0.1125","0.0415","","0.1181","0.095","","","","1.016","1.113","1.113","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004118","10.125","0.001","12.764","0.002","11.338","0.002","90","","90.39","0.01","90","","1465.2","0.4","158","2","158","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,4-Dimethyl-9-oxabicyclo[5.3.0]dec-5-en-1,3-diol Deuterochloroform solvate","","- C12 H18 Cl3 D O3 -","- C12 H19 Cl3 O3 -","- C48 H76 Cl12 O12 -","4","1","CR1194","Kumanovic, S.; Lautens, M.; Lough, A. J.","A Highly Substituted <i>trans</i>-Fused Bicyclo[5.3.0]decene","Acta Crystallographica Section C","1995","51","11","2370","2372","10.1107/S0108270195006573","","","0.71073","MoKα","","0.0637","0.0431","","0.1183","0.1051","","","","1.019","1.054","1.054","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004119","11.483","0.002","11.615","0.001","12.412","0.002","90","","111.44","0.01","90","","1540.9","0.4","295","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H24 O3 -","- C16 H24 O3 -","- C64 H96 O12 -","4","1","DE1006","Lakshmi, S.; Subramanian, K.; Rajagopalan, K.; Koellner, G.; Steiner, Th.","1β-Hydroxy-1α-propargyl-2β-methyl-2-(2-ethoxycarbonylvinyl)cycloheptane","Acta Crystallographica Section C","1995","51","11","2327","2329","10.1107/S0108270195005208","","","1.542","CuKα","","","0.072","","","0.072","","","","","0.99","0.99","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004121","13.877","0.006","10.446","0.004","8.109","0.003","79.72","0.03","97.26","0.04","93.14","0.04","1146.7","0.8","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H38 O -","- C26 H38 O -","- C52 H76 O2 -","2","1","DU1111","Ginderow, D.","5-(2,6,6-Triméthyl-2-cyclohexen-1-yl)-3-[2-(2,6,6-triméthyl-2-cyclohexen-1-yl)éthenyl]-2-cyclohexen-1-one","Acta Crystallographica Section C","1995","51","11","2455","2458","10.1107/S0108270195006585","","","1.5418","CuKα","","0.0766","0.0726","","0.1999","0.1926","","","","1.063","1.063","1.063","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004122","45.92","0.05","10.418","0.003","7.923","0.008","90","","92.94","0.05","90","","3785","6","293","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Cs2 Mo4 O13 -","- Cs2 Mo4 O13 -","- Cs24 Mo48 O156 -","12","1.5","DU1116","Marrot, J.; Savariault, J.-M.","Two Original Infinite Chains in the New Caesium Tetramolybdate Compound Cs~2~Mo~4~O~13~","Acta Crystallographica Section C","1995","51","11","2201","2205","10.1107/S0108270195004811","","","0.71073","MoKα","","","0.066","","","0.16","","","","","1.161","1.161","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004123","9.368","0.002","3.396","0.001","7.799","0.003","90","","119.42","0.01","90","","216.12","0.12","295","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","","","- As2 Nb -","- As2 Nb -","- As8 Nb4 -","4","0.5","DU1121","Bensch, W.; Heid, W.","NbAs~2~","Acta Crystallographica Section C","1995","51","11","2205","2207","10.1107/S0108270195007062","","","0.7107","MoKα","","","0.0303","","","0.0363","","","","","0.9536","0.9536","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004124","10.6883","0.0006","18.27","0.002","10.9819","0.0007","90","","117.706","0.005","90","","1898.6","0.3","293","","293","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C33 H57 Cl O6 Zr -","- C33 H57 Cl O6 Zr -","- C66 H114 Cl2 O12 Zr2 -","2","0.5","DU1125","Jardin, M.; Gao, Y.; Guéry, J.; Jacoboni, C.","Chlorotris(2,2,6,6-tetramethyl-3,5-heptanedionato-<i>O</i>,<i>O</i>')zirconium(IV)","Acta Crystallographica Section C","1995","51","11","2230","2232","10.1107/S0108270195006494","","","0.71073","MoKα","","","0.041","","","0.041","","","","","1.212","1.212","","","","","has coordinates","192024","2020-10-21","18:00:00",""
"2004125","6.853","0.001","7.878","0.001","18.299","0.003","79.11","0.01","82.37","0.01","68.96","0.01","903.2","0.2","298","","298","","","","","","","","","7","P -1","-P 1","2","","3,4;3',4'-Bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalene Hexafluorophosphate Chloroacetyl chloride solvate","","- C11 H9 Cl F3 O0.5 P0.5 S8 -","- C12 H8 Cl F3 O P0.5 S8 -","- C24 H16 Cl2 F6 O2 P S16 -","2","1","FG1017","Abboud, K. A.; Chou, L.-K.; Clevenger, M. B.; de Oliveira, G. F.; Talham, D. R.","Three BEDT-TTF Salts","Acta Crystallographica Section C","1995","51","11","2356","2362","10.1107/S0108270195005592","","","0.71073","MoKα","","0.0599","0.0397","","0.0487","0.0455","","","","","1.42","1.42","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004126","8.019","0.002","9.889","0.002","12.726","0.002","80.21","0.02","85.31","0.02","81.69","0.02","982.3","0.4","298","","298","","","","","","","","","6","P -1","-P 1","2","","3,4;3',4'-Bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalene Hexafluorophosphate Tetrahydrofuran solvate","","- C12 H12 F6 O0.5 P S8 -","- C17 H22 F6 O P S8 -","- C34 H44 F12 O2 P2 S16 -","2","1","FG1017","Abboud, K. A.; Chou, L.-K.; Clevenger, M. B.; de Oliveira, G. F.; Talham, D. R.","Three BEDT-TTF Salts","Acta Crystallographica Section C","1995","51","11","2356","2362","10.1107/S0108270195005592","","","0.71073","MoKα","","0.0891","0.0453","","0.0638","0.0523","","","","","1.57","1.57","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004127","14.172","0.002","10.63","0.002","5.751","0.001","90","","103.78","0.01","90","","841.4","0.2","298","","298","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","3,4;3',4'-Bis(ethylenedithio)-2,2',5,5'-tetrathiafulvalene Perchlorate","","- C10 H8 Cl O4 S8 -","- C15 H16 O8 S8 -","- C30 H32 O16 S16 -","2","0.25","FG1017","Abboud, K. A.; Chou, L.-K.; Clevenger, M. B.; de Oliveira, G. F.; Talham, D. R.","Three BEDT-TTF Salts","Acta Crystallographica Section C","1995","51","11","2356","2362","10.1107/S0108270195005592","","","0.71073","MoKα","","0.0655","0.0488","","0.0692","0.0644","","","","","2.26","2.26","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004128","8.634","0.001","8.863","0.002","11.745","0.001","90","","98.33","0.01","90","","889.3","0.2","294","","294","","","","","","","","","4","P 1 21 1","P 2yb","4","","Dimethyl 9-chloromethyl-9,10-dihydro-9,10-ethenoanthracene- 11,12-dicarboxylate","","- C21 H17 Cl O4 -","- C21 H17 Cl O4 -","- C42 H34 Cl2 O8 -","2","1","FG1072","Jones, R.; Rettig, S. J.; Trotter, J.","α- and γ-Polymorphs of Dimethyl 9-Chloromethyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate","Acta Crystallographica Section C","1995","51","11","2392","2395","10.1107/S0108270195005336","","","1.5418","CopperKα","","","0.079","","","0.088","","","","","4.6","4.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004129","20.55","0.001","10.513","0.001","17.813","0.001","90","","108.11","0.01","90","","3657.7","0.5","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl 9-chloromethyl-9,10-dihydro-9,10-ethenoanthracene- 11,12-dicarboxylate","","- C21 H17 Cl O4 -","- C21 H17 Cl O4 -","- C168 H136 Cl8 O32 -","8","2","FG1072","Jones, R.; Rettig, S. J.; Trotter, J.","α- and γ-Polymorphs of Dimethyl 9-Chloromethyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate","Acta Crystallographica Section C","1995","51","11","2392","2395","10.1107/S0108270195005336","","","1.5418","CopperKα","","","0.048","","","0.056","","","","","4","4","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004130","8.324","0.002","24.833","0.005","8.178","0.001","95.76","0.02","90.62","0.02","90.87","0.02","1681.6","0.6","296","","296","","","","","","","","","5","P -1","-P 1","2","Dichloro-bis(antazoline)-zinc(II)","","","- C34 H38 Cl2 N6 Zn -","- C34 H38 Cl2 N6 Zn -","- C68 H76 Cl4 N12 Zn2 -","2","1","FG1074","Parvez, M.; Rusiewicz, M.","Bis(antazoline)dichlorozinc(II)","Acta Crystallographica Section C","1995","51","11","2277","2279","10.1107/S0108270195006548","","","0.71069","MoKα","","","0.061","","","0.059","","","","","1.99","1.99","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004131","7.203","0.003","34.626","0.005","7.048","0.001","90","","90","","90","","1757.8","0.8","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1S,8S,8aS)-(+)-1-(t-Butyldimethylsilyloxy)-8-hydroxy-5-indolizidinone","","- C14 H27 N O3 Si -","- C14 H27 N O3 Si -","- C56 H108 N4 O12 Si4 -","4","1","FG1075","Hua, D. H.; Lagneau, N.; Park, J.-G.; Good, L. A.; Robinson, P. D.","(1<i>S</i>,8<i>S</i>,8a<i>S</i>)-(+)-1-(<i>tert</i>-Butyldimethylsilyloxy)-8-hydroxy-1,2,3,5,6,7,8,8a-octahydro-5-indolizinone","Acta Crystallographica Section C","1995","51","11","2301","2304","10.1107/S0108270195004963","","","0.71069","MoKα","","","0.054","","","0.059","","","","","1.8","1.8","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004132","5.615","0.002","10.0655","0.001","13.0482","0.001","90","","100.13","0.02","90","","726","0.3","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C11 H18 N4 S3 -","- C11 H18 N4 S3 -","- C22 H36 N8 S6 -","2","1","HU1123","Billing, D. G.; Boeyens, J. C. A.; Lai, L.-L.; Reid, D. H.","2,3-Diethyl-5,6,7,8-tetrahydro-2aλ^4^-thia-2,3,4a,8a-tetraazacyclopent[<i>cd</i>]azulene-1(2<i>H</i>),4(3<i>H</i>)-dithione","Acta Crystallographica Section C","1995","51","11","2354","2356","10.1107/S010827019500343X","","","0.71069","MoKα","","","","","","","","","","","0.946","0.946","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004133","10.711","0.004","6.115","0.003","21.514","0.004","90","","99.919","0.02","90","","1388.1","0.9","120","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 -","- C19 H16 -","- C76 H64 -","4","1","HU1135","Rajnikant; Watkin, D. J.; Tranter, G.","4-Benzylbiphenyl","Acta Crystallographica Section C","1995","51","11","2388","2390","10.1107/S0108270195006329","","","0.71069","MoKα","","","0.0429","","","0.051","","","","","0.994","0.994","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004134","13.363","0.003","12.802","0.002","10.828","0.002","90","","107.04","0.02","90","","1771.1","0.6","293","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C16 H20 Fe O6 -","- C16 H20 Fe O6 -","- C64 H80 Fe4 O24 -","4","1","JZ1034","Solans, X.; Font-Bardia, M.","3,4-Bis(<i>tert</i>-butoxy)-2,4-cyclopentadien-1-one and its <i>fac</i>-Tricarbonyliron(0) Complex","Acta Crystallographica Section C","1995","51","11","2255","2258","10.1107/S0108270195003039","","","0.71069","MoKα","","","0.048","","","0.124","","","","","0.972","0.972","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004135","11.679","0.003","9.741","0.002","11.74","0.003","90","","95.5","0.03","90","","1329.5","0.6","293","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H20 O3 -","- C13 H20 O3 -","- C52 H80 O12 -","4","1","JZ1034","Solans, X.; Font-Bardia, M.","3,4-Bis(<i>tert</i>-butoxy)-2,4-cyclopentadien-1-one and its <i>fac</i>-Tricarbonyliron(0) Complex","Acta Crystallographica Section C","1995","51","11","2255","2258","10.1107/S0108270195003039","","","0.71069","MoKα","","","0.052","","","0.126","","","","","0.93","0.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004136","5.381","0.001","24.265","0.002","8.988","0.002","90","","90.61","0.01","90","","1173.5","0.4","130","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H13 N5 O4 -","- C10 H13 N5 O4 -","- C40 H52 N20 O16 -","4","2","JZ1044","Schaible, H.-G.; Bats, J. W.; Engels, J. W.","5'-Azido-2',5'-dideoxythymidine","Acta Crystallographica Section C","1995","51","11","2410","2412","10.1107/S0108270195009310","","","1.54184","CuKα","","","0.027","","","0.081","","","","","2.39","2.39","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004137","12.551","0.002","5.0137","0.001","12.7","0.002","90","","104.62","0.02","90","","773.3","0.2","135","","","","","","","","","","","4","I 1 2 1","I 2y","5","","","","- C4 H5 K2 O6.5 -","- C4 H5 K2 O6.5 -","- C16 H20 K8 O26 -","4","1","JZ1050","Boese, R.; Bläser, D.; Latz, R.; Piennisch, M.","Dipotassium <small>L</small>-Tartrate Semihydrate","Acta Crystallographica Section C","1995","51","11","2227","2229","10.1107/S010827019500566X","","","0.71069","MoKα","","","0.0339","","","0.0341","","","","","1.0505","1.0505","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004138","9.503","0.003","8.05","0.001","18.033","0.002","90","","98.68","0.02","90","","1363.7","0.5","228","2","228","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Bis(η^5^-Cyclopentadienyl)zirkonium(2-n-butyl)acetylid Dimer","","- C32 H38 Zr2 -","- C32 H38 Zr2 -","- C64 H76 Zr4 -","2","0.5","JZ1052","Heshmatpour, F.; Wocadlo, S.; Massa, W.; Dehnicke, K.","Bis(η^5^-Cyclopentadienyl)zirkonium(2-<i>n</i>-butyl)acetylid Dimer","Acta Crystallographica Section C","1995","51","11","2225","2227","10.1107/S0108270195006482","","","0.71073","MoKα","","0.0495","0.0352","","0.086","0.082","","","","0.907","1.018","1.018","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004139","4.5164","0.0005","6.1355","0.0009","18.515","0.003","90","","94.58","0.02","90","","511.42","0.13","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C H6 Fe N O5 P -","- C H6 Fe N O5 P -","- C4 H24 Fe4 N4 O20 P4 -","4","1","JZ1053","Cavellec, M.; Riou, D.; Ferey, G.","A Two-Dimensional Iron Phosphate Templated by Ethylenediamine","Acta Crystallographica Section C","1995","51","11","2242","2244","10.1107/S0108270195006731","","","0.71073","MoKα","","0.0246","0.0246","","0.0641","0.0641","","","","1.072","1.072","1.072","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004140","10.625","0.001","12.598","0.002","13.551","0.001","101.85","0.01","112.3","0.01","90.66","0.01","1634.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","N,N'[1,1'-dimethylene-3,3'-biisoquinoline 2,2'-dioxide]4,13-diaza-18-crown-6 sodium bromide","","- C32 H40 Br N4 Na O7 -","- C32 H40 Br N4 Na O7 -","- C64 H80 Br2 N8 Na2 O14 -","2","1","KA1105","Suwinska, K.","Inclusion Complex of <i>N</i>,<i>N</i>'-(1,1'-Dimethylene-3,3'-biisoquinoline 2,2'-dioxide)-4,13-diaza-18-crown-6 with Sodium Bromide","Acta Crystallographica Section C","1995","51","11","2232","2235","10.1107/S0108270195004136","","","1.54178","CuKα","","0.0379","0.0361","","0.1068","0.105","","","","1.052","1.065","1.065","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004141","7.4393","0.0008","7.6507","0.0004","15.6806","0.0008","90","","90","","90","","892.47","0.12","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Ethylenediammonium Tartrate","","- C6 H14 N2 O6 -","- C6 H14 N2 O6 -","- C24 H56 N8 O24 -","4","1","KA1121","Güneş, B.; Soylu, H.; Akkurt, O.; Özbey, S.","Aminoethylammonium Tartrate","Acta Crystallographica Section C","1995","51","11","2346","2348","10.1107/S0108270195006202","","","0.71069","MoKα","","0.0652","0.0618","","0.1706","0.1638","","","","1.131","1.148","1.148","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004142","9.211","0.004","14.671","0.004","11.533","0.004","90","","111.14","0.04","90","","1453.6","1","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H19 N3 O -","- C17 H19 N3 O -","- C68 H76 N12 O4 -","4","1","KA1123","Sudha, L.; Senthil Selvan, J.; Subramanian, K.; Steiner, Th.; Koellner, G.; Srinivasan, N.; Ramdas, K.","3,3-(Oxydiethyl)-1,2-diphenylguanidine","Acta Crystallographica Section C","1995","51","11","2329","2331","10.1107/S0108270195007645","","","1.54184","CuKα","","","0.065","","","0.065","","","","","1.26","1.26","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004143","8.526","0.006","10.815","0.005","17.547","0.009","90","","90.4","0.06","90","","1617.9","1.6","295","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H24 O3 -","- C16 H24 O3 -","- C64 H96 O12 -","4","1","KA1125","Lakshmi, S.; Subramanian, K.; Rajagopalan, K.; Koellner, G.; Steiner, Th.","Alkynyl Contacts in 1β-Hydroxy-1α-propargyl-2α-(2-ethoxycarbonylvinyl)-2,4,4-trimethylcyclopentane","Acta Crystallographica Section C","1995","51","11","2325","2327","10.1107/S0108270195007499","","","1.54184","CuKα","","","0.057","","","0.057","","","","","0.82","0.82","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004144","10.832","0.002","8.524","0.002","15.634","0.003","90","","108.31","0.03","90","","1370.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(phenylsulfonyl)-1,6-dioxaspiro[4.5]decan-10-one","","- C14 H16 O5 S -","- C14 H16 O5 S -","- C56 H64 O20 S4 -","4","1","KA1126","Alonso, I.; López-Solera, I.; Raithby, P. R.","4-Sulfonyl-1,6-dioxaspiro[4.5]decanes","Acta Crystallographica Section C","1995","51","11","2381","2383","10.1107/S0108270195006214","","","0.71073","MoKα","","0.0942","0.0496","","0.1255","0.1037","","","","1.017","1.081","1.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004145","8.613","0.002","10.453","0.002","10.561","0.002","63.55","0.03","68.81","0.03","84.74","0.03","791","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2,7-dimethyl-4-(phenylsulfonyl)-1,6-dioxaspiro[4.5]decan-10-one","","- C16 H20 O5 S -","- C16 H20 O5 S -","- C32 H40 O10 S2 -","2","1","KA1126","Alonso, I.; López-Solera, I.; Raithby, P. R.","4-Sulfonyl-1,6-dioxaspiro[4.5]decanes","Acta Crystallographica Section C","1995","51","11","2381","2383","10.1107/S0108270195006214","","","1.54178","CuKα","","0.046","0.0427","","0.1232","0.1199","","","","1.05","1.077","1.077","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004146","14.928","0.003","14.999","0.002","18.952","0.002","90","","90","","90","","4243.4","1.1","294","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C22 H26 N4 O2 S -","- C22 H26 N4 O2 S -","- C176 H208 N32 O16 S8 -","8","1","KA1128","Sudha, L.; Senthil Selvan, J.; Subramanian, K.; Steiner, Th.; Koellner, G.; Srinivasan, N.; Ramdas, K.","1-(Morpholinothiocarbonyl)-3,3-(oxydiethyl)-1,2-diphenylguanidine","Acta Crystallographica Section C","1995","51","11","2323","2325","10.1107/S0108270195007165","","","1.54184","CuKα","","","0.068","","","0.073","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004147","7.764","0.0008","13.784","0.002","15.692","0.0015","90","","103.77","0.008","90","","1631.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","none","2'-Methoxy-5'-methoxycarbonylspiro[dihydroacridine-9(10H),4'-thiazoline]","","- C18 H16 N2 O3 S -","- C18 H16 N2 O3 S -","- C72 H64 N8 O12 S4 -","4","1","KA1131","Černák, J.; Kristian, P.; Bernát, J.; Lipkowski, J.","2'-Methoxy-5'-methoxycarbonylspiro[acridine-9(10<i>H</i>),4'(5'<i>H</i>)-thiazole]","Acta Crystallographica Section C","1995","51","11","2397","2399","10.1107/S0108270195006925","","","1.54178","CuKα","","0.0663","0.0538","","0.1628","0.1445","","","","1.07","1.104","1.104","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004148","7.625","0.003","11.262","0.002","13.883","0.002","90","","90","","90","","1192.2","0.5","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","N-(p-tolyl)phthalimide","","","- C15 H11 N O2 -","- C15 H11 N O2 -","- C60 H44 N4 O8 -","4","1","KA1133","Bocelli, G.; Cantoni, A.; Cozzini, P.","<i>N</i>-(<i>p</i>-Tolyl)phthalimide","Acta Crystallographica Section C","1995","51","11","2372","2374","10.1107/S0108270195007177","","","1.54178","CuKα","","0.0334","0.0304","","0.0806","0.0781","","","","1.027","1.031","1.031","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004149","7.286","0.002","7.408","0.002","30.52","0.01","90","","90","","90","","1647.3","0.8","296","","","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C12 H14 Cd Cl4 N2 O -","- C12 H14 Cd Cl4 N2 O -","- C48 H56 Cd4 Cl16 N8 O4 -","4","0.5","KH1005","Huang, X.-Y.; Ye, Q.; Meng, Q.-J.; You, X.-Z.","4,4'-Oxydianilinium Tetrachlorocadmate(II), an Intercalation Compound","Acta Crystallographica Section C","1995","51","11","2285","2287","10.1107/S0108270195005762","","","0.71069","MoKα","","","0.041","","","0.054","","","","","1.86","1.86","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004150","14.664","0.002","13.913","0.001","17.592","0.008","90","","102.65","0.02","90","","3502","1.7","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H23 Cl6 Eu N4 O8 -","- C30 H23 Cl6 Eu N4 O8 -","- C120 H92 Cl24 Eu4 N16 O32 -","4","1","KH1017","Lu, W.; Cheng, Y.; Dong, N.; Gu, J.; Xu, C.","Diaquabis(dichloroacetato)bis(1,10-phenanthroline)europium(III) Dichloroacetate and the Corresponding Erbium(III) Complex","Acta Crystallographica Section C","1995","51","11","2295","2299","10.1107/S0108270195004756","","","0.71073","MoKα","","","0.043","","","0.052","","","","","3.556","3.556","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004151","14.564","0.002","13.879","0.002","17.505","0.008","90","","102.36","0.02","90","","3456.3","1.7","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H23 Cl6 Er N4 O8 -","- C30 H23 Cl6 Er N4 O8 -","- C120 H92 Cl24 Er4 N16 O32 -","4","1","KH1017","Lu, W.; Cheng, Y.; Dong, N.; Gu, J.; Xu, C.","Diaquabis(dichloroacetato)bis(1,10-phenanthroline)europium(III) Dichloroacetate and the Corresponding Erbium(III) Complex","Acta Crystallographica Section C","1995","51","11","2295","2299","10.1107/S0108270195004756","","","0.71073","MoKα","","","0.054","","","0.059","","","","","4.785","4.785","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004152","9.632","0.001","13.094","0.001","13.226","0.001","90","","101.65","0.01","90","","1633.7","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(p-Chlorophenyl)-4β(2'-thienyl)-5α-carbomethoxy methyl pyrrolydin-2-one.","","- C17 H16 Cl N O3 S -","- C17 H16 Cl N O3 S -","- C68 H64 Cl4 N4 O12 S4 -","4","1","KH1028","Sivakumar, K.; Fun, H.-K.; Ray, J. K.; Roy, B. C.; Nigam, G. D.","1-(<i>p</i>-Chlorophenyl)-5α-methoxycarbonylmethyl-4β-(2-thienyl)pyrrolidin-2-one","Acta Crystallographica Section C","1995","51","11","2444","2446","10.1107/S0108270195006111","","","0.71073","MoKα","","0.0559","0.0424","","0.1266","0.1215","","","","1.082","1.206","1.206","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004153","12.119","0.001","12.984","0.001","10.335","0.001","90","","90.67","0.01","90","","1626.1","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2,3,4,6,7-hexahydro-10-chloronaphtho[6,7-c]acridine","","- C21 H18 Cl N -","- C21 H16.304 Cl N -","- C84 H65.216 Cl4 N4 -","4","1","KH1029","Ray, J. K.; Haldar, M.; Nigam, G. D.; Sivakumar, K.; Fun, H.-K.","1,2,3,4,6,7-Hexahydro-10-chloronaphtho-[3,2-<i>c</i>]acridine","Acta Crystallographica Section C","1995","51","11","2441","2443","10.1107/S0108270195006123","","","0.71073","MoKα","","0.0676","0.0454","","0.1383","0.1278","","","","0.967","1.117","1.117","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004154","8.535","0.002","8.535","0.002","17.339","0.006","90","","90","","90","","1263.1","0.6","138","","","","","","","","","","","3","P 41","P 4w","76","","","","- C14 H18 O4 -","- C14 H18 O4 -","- C56 H72 O16 -","4","1","KH1035","Gainsford, G. J.; Furneaux, R. H.; Mason, J. M.; Tyler, P. C.","1,6-Anhydro-4-<i>O</i>-benzyl-3-deoxy-2-<i>O</i>-methyl-β-<small>D</small>-<i>ribo</i>-hexopyranose and 1,6-Anhydro-4-<i>O</i>-benzyl-2-<i>C</i>-(2-cyanoethyl)-2,3-dideoxy-β-<small>D</small>-<i>ribo</i>-hexopyranose","Acta Crystallographica Section C","1995","51","11","2418","2421","10.1107/S0108270195007256","","","0.71073","MoKα","","","0.036","","","0.043","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004155","6.229","0.002","11.951","0.003","18.865","0.006","90","","90","","90","","1404.4","0.7","143","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H19 N O3 -","- C16 H19 N O3 -","- C64 H76 N4 O12 -","4","1","KH1035","Gainsford, G. J.; Furneaux, R. H.; Mason, J. M.; Tyler, P. C.","1,6-Anhydro-4-<i>O</i>-benzyl-3-deoxy-2-<i>O</i>-methyl-β-<small>D</small>-<i>ribo</i>-hexopyranose and 1,6-Anhydro-4-<i>O</i>-benzyl-2-<i>C</i>-(2-cyanoethyl)-2,3-dideoxy-β-<small>D</small>-<i>ribo</i>-hexopyranose","Acta Crystallographica Section C","1995","51","11","2418","2421","10.1107/S0108270195007256","","","0.71073","MoKα","","","0.041","","","0.043","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004156","18.541","0.001","8.291","0.002","15.366","0.001","90","","97.26","0.01","90","","2343.2","0.6","298","","298","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","cis-(±)-1,2,3,6,11,11a-Hexahydro-6-methyl-4H-benzo[b]quinolizin-4-one","","- C14 H17 N O -","- C14 H17 N O -","- C112 H136 N8 O8 -","8","1","KH1038","Beckwith, A. L. J.; Joseph, S. P.; Mayadunne, R. T. A.; Willis, A. C.","<i>cis</i>-(±)-1,2,3,6,11,11a-Hexahydro-6-methyl-4<i>H</i>-benzo[<i>b</i>]quinolizin-4-one","Acta Crystallographica Section C","1995","51","11","2307","2309","10.1107/S0108270195005750","","","1.5418","CopperKα","","0.067","0.047","","0.072","0.063","","","","1.449","1.555","1.555","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004157","38.48","0.01","9.046","0.002","12.344","0.001","90","","106.08","0.03","90","","4128.7","1.6","300","","300","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(2-hydroxyphenyl)salicylaldimin","","- C13 H11 N O2 -","- C13 H9 N O3 -","- C208 H144 N16 O48 -","16","2","LI1119","Elerman, Y.; Elmali, A.; Atakol, O.; Svoboda, I.","<i>N</i>-(2-Hydroxyphenyl)salicylaldimine","Acta Crystallographica Section C","1995","51","11","2344","2346","10.1107/S010827019500388X","","","0.71069","MoKα","","","0.09","","","0.09","","","","","1.15","1.15","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004158","4.845","0.001","5.517","0.001","23.033","0.003","90","","93.62","0.01","90","","614.44","0.19","296","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H14 N O5 P -","- C10 H14 N O5 P -","- C20 H28 N2 O10 P2 -","2","1","MD1002","Chadha, R. K.; Ösapay, G.","(<i>S</i>)-[1-(Benzyloxycarbonylamino)ethyl]phosphonic Acid","Acta Crystallographica Section C","1995","51","11","2340","2342","10.1107/S0108270195004355","","","1.54178","CuKα","","","0.045","","","0.061","","","","","1.68","1.68","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004159","9.381","0.003","17.599","0.006","18.111","0.003","90","","95.09","0.03","90","","2978.3","1.5","296","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H22 F6 N2 Ni O4 S2 -","- C28 H22 F6 N2 Ni O4 S2 -","- C112 H88 F24 N8 Ni4 O16 S8 -","4","0.5","MU1173","Xiong, R.-G.; You, X.-Z.; Huang, X.-Y.","Redetermination of <i>cis</i>-Bis(4-methylpyridine)bis[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato-<i>O</i>,<i>O</i>']nickel(II)","Acta Crystallographica Section C","1995","51","11","2260","2261","10.1107/S0108270195005877","","","0.71069","MoKα","","","0.064","","","0.074","","","","","1.71","1.71","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004160","8.459","0.002","9.132","0.003","9.903","0.002","95.22","0.02","84.14","0.02","104.72","0.02","734.3","0.3","296","","","","","","","","","","","7","P -1","-P 1","2","","","","- C20 H34 N2 Ni O4 P2 S4 -","- C20 H34 N2 Ni O4 P2 S4 -","- C20 H34 N2 Ni O4 P2 S4 -","1","0.5","MU1176","Song, B.-L.; Xiong, R.-G.; You, X.-Z.; Huang, X.-Y.","<i>trans</i>-Bis(<i>O</i>,<i>O</i>'-diethyl dithiophosphato-<i>S</i>,<i>S</i>')bis(4-methylpyridine)nickel(II)","Acta Crystallographica Section C","1995","51","11","2258","2259","10.1107/S0108270195005130","","","0.71073","MoKα","","","0.052","","","0.065","","","","","1.56","1.56","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004161","17.755","0.002","5.29","0.005","17.383","0.003","90","","121.48","0.01","90","","1392.4","1.4","298","2","","","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C24 H30 Cd N4 O10 S2 -","- C24 H30 Cd N4 O10 S2 -","- C48 H60 Cd2 N8 O20 S4 -","2","0.5","MU1179","Lusvardi, G.; Menabue, L.; Saladini, M.","Cadmium(II) <i>N</i>-(<i>p</i>-Tolylsulfonyl)glutaminate","Acta Crystallographica Section C","1995","51","11","2287","2289","10.1107/S0108270195005385","","","0.71069","MoKα","","","0.041","","","0.038","","","","","0.56","0.56","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004162","24.4935","0.0004","24.4935","0.0004","19.1219","0.0006","90","","90","","120","","9934.9","0.4","298","","298","","","","","","","","","4","R -3 :H","-R 3","148","chlorotriphenyltin","chlorotriphenyltin","","- C18 H15 Cl Sn -","- C18 H15 Cl Sn -","- C432 H360 Cl24 Sn24 -","24","1.33333","MU1190","Ng, S. W.","Rhombohedral Chlorotriphenyltin","Acta Crystallographica Section C","1995","51","11","2292","2293","10.1107/S0108270195006998","","","0.71073","MoKα","","0.0546","0.0344","","0.0871","0.0766","","","","1.088","1.134","1.134","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004163","5.561","0.002","8.159","0.003","11.353","0.004","90","","100.73","0.04","90","","506.1","0.3","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 N2 -","- C12 H12 N2 -","- C24 H24 N4 -","2","0.5","NA1166","Ide, S.; Karacan, N.; Tufan, Y.","1,2-Bis(4-pyridyl)ethane","Acta Crystallographica Section C","1995","51","11","2304","2305","10.1107/S0108270195005221","","","0.71073","MoKα","","","0.035","","","0.038","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004164","38.4","0.01","38.4","0.01","12.092","0.009","90","","90","","120","","15442","13","80","2","80","2","","","","","","","","7","R 3 :H","R 3","146","","fac-tris(thiocyanato)-tris(triphenylphosphine oxide)iron(III)","","- C57 H45 Fe N3 O3 P3 S3 -","- C57 H45 Fe N3 O3 P3 S3 -","- C684 H540 Fe12 N36 O36 P36 S36 -","12","1.33333","NA1168","Olejnik, Z.; Lis, T.; Ondrejkovicová, I.","<i>fac</i>-Tris(isothiocyanato)tris(triphenylphosphine oxide)iron(III) at 80 K","Acta Crystallographica Section C","1995","51","11","2246","2249","10.1107/S0108270195006354","","","0.71069","MoKα","","","0.0289","","","0.0759","","","","","1.03","1.03","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004165","14.806","0.002","10.677","0.002","19.669","0.005","90","","108.55","0.02","90","","2947.8","1.1","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H27 F12 Fe N7 P2 -","- C24 H27 F12 Fe N7 P2 -","- C96 H108 F48 Fe4 N28 P8 -","4","1","NA1171","Boubekeur, K.; Deroche, A.; Lambert, F.; Morgenstern-Badarau, I.","{Tris[4-(2-pyridyl)-3-aza-3-butenyl]amine}iron(II) Bis(hexafluorophosphate), [Fe(py~3~tren)](PF~6~)~2~","Acta Crystallographica Section C","1995","51","11","2244","2246","10.1107/S010827019500597X","","","0.71073","MoKα","","","0.051","","","0.061","","","","","1.854","1.854","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004166","6.967","0.001","10.346","0.002","12.877","0.003","90","","94.12","0.03","90","","925.8","0.3","293","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H18 Cl4 N6 O2 Sn -","- C10 H18 Cl4 N6 O2 Sn -","- C20 H36 Cl8 N12 O4 Sn2 -","2","0.5","NA1172","Casellato, U.; Graziani, R.; Martelli, M.; Plazzogna, G.","Bis(cytosinium) Tetrachlorodimethylstannate(IV)","Acta Crystallographica Section C","1995","51","11","2293","2295","10.1107/S0108270195005312","","","0.7107","MoKα","","","0.028","","","0.028","","","","","1.024","1.024","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004167","7.75","0.004","13.131","0.006","10.912","0.003","90","","91.22","0.03","90","","1110.2","0.8","173","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C10 H10 Br2 O2 -","- C10 H10 Br2 O2 -","- C40 H40 Br8 O8 -","4","1","NA1173","Li, S.; Lundquist, K.; Soubbotin, N.; Stomberg, R.","2-Bromo-4-[2-bromo-(<i>E</i>)-propylidene]-6-methoxy-2,5-cyclohexadien-1-one","Acta Crystallographica Section C","1995","51","11","2366","2369","10.1107/S0108270195006317","","","0.71073","MoKα","","","0.029","","","0.031","","","","","1.19","1.19","","","","","has coordinates,has disorder","192026","2020-10-21","18:00:00",""
"2004168","12.811","0.002","7.771","0.001","18.098","0.002","90","","109.6","0.1","90","","1697.3","1.1","295","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H16 Cl4 Cu N6 O2 -","- C10 H16 Cl4 Cu N6 O2 -","- C40 H64 Cl16 Cu4 N24 O8 -","4","0.5","NA1174","Valle, G.; Ettorre, R.; Peruzzo, V.","Bis(1-methylcytosinium) Tetrachlorocuprate(II)","Acta Crystallographica Section C","1995","51","11","2273","2275","10.1107/S0108270195006937","","","0.7107","MoKα","","","0.05","","","0.055","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004169","13.529","0.008","14.323","0.008","8.447","0.004","90","","91.93","0.02","90","","1635.9","1.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","II","4,6-Dimethoxy-3-methyl-dihydrotriazine-2-one","","- C6 H9 N3 O3 -","- C6 H9 N3 O3 -","- C48 H72 N24 O24 -","8","2","NA1180","Handelsman-Benory, E.; Botoshansky, M.; Kaftory, M.","4,6-Dimethoxy-3-methyl-1,3,5-triazin-2(3<i>H</i>)-one and 6-Methoxy-3,5-dimethyl-1,3,5-triazine-2,4(3<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section C","1995","51","11","2421","2424","10.1107/S0108270195007220","","","0.71069","MoKα","","0.1125","0.067","","0.1853","0.16","","","","1.064","1.232","1.232","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004170","8.362","0.004","14.356","0.008","7.168","0.004","90","","114.41","0.02","90","","783.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","III","6-Methoxy-3,5-dimethyl-tetrahydrotriazine-2,4,-dione","","- C6 H9 N3 O3 -","- C6 H9 N3 O3 -","- C24 H36 N12 O12 -","4","1","NA1180","Handelsman-Benory, E.; Botoshansky, M.; Kaftory, M.","4,6-Dimethoxy-3-methyl-1,3,5-triazin-2(3<i>H</i>)-one and 6-Methoxy-3,5-dimethyl-1,3,5-triazine-2,4(3<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section C","1995","51","11","2421","2424","10.1107/S0108270195007220","","","0.71069","MoKα","","0.1071","0.078","","0.1986","0.167","","","","1.13","1.241","1.241","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004171","6.908","0.006","9.662","0.001","14.012","0.002","84.53","0.01","74.5","0.03","86.98","0.03","896.8","0.8","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H18 N8 O7 -","- C14 H18 N8 O7 -","- C28 H36 N16 O14 -","2","1","NS1005","Gallardo, H.; Meyer, E.; Vencato, I.","5-(2,4-Dihydroxyphenyl)tetrazole Sesquihydrate","Acta Crystallographica Section C","1995","51","11","2430","2432","10.1107/S0108270195007505","","","0.7107","Mo","","","0.0468","","","0.06","","","","","0.75","0.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004172","10.427","0.001","7.197","0.001","11.805","0.001","90","","99.755","0.008","90","","873.08","0.17","296","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C16 H21 N7 -","- C16 H21 N7 -","- C32 H42 N14 -","2","1","OH1073","Saito, H.; Eda, M.; Sugio, S.; Ueda, Y.","Chiral <i>N</i>-(6-Amino-3-pyridyl)-<i>N</i>'-bicycloalkyl-<i>N</i>''-cyanoguanidine Derivative: a Novel Potassium-Channel Opener","Acta Crystallographica Section C","1995","51","11","2331","2333","10.1107/S010827019500031X","","","1.5418","CuKα","","","0.045","","","0.071","","","","","1.45","1.45","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004173","11.4603","0.0002","11.4603","0.0002","11.4603","0.0002","90","","90","","90","","1505.18","0.05","298","","","","","","","","","","","4","I a -3 d","","","","","","- Al2 Co3 O12 Si3 -","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","8","0.0833333","OH1074","Ohashi, H.; Osawa, T.; Sato, A.","Low-Pressure Polymorph of Co~3~Al~2~Si~3~O~12~","Acta Crystallographica Section C","1995","51","11","2213","2215","10.1107/S0108270195004719","","","0.71073","MoKα","","","0.021","","","0.03","","","","","1.014","1.014","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004174","10.494","0.001","10.494","0.001","8.939","0.002","90","","90","","90","","984.4","0.3","296","","","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","","","- B6 Cs Li O10 -","- B6 Cs Li O10 -","- B24 Cs4 Li4 O40 -","4","0.25","OH1076","Sasaki, T.; Mori, Y.; Kuroda, I.; Nakajima, S.; Yamaguchi, K.; Watanabe, S.; Nakai, S.","Caesium Lithium Borate: a New Nonlinear Optical Crystal","Acta Crystallographica Section C","1995","51","11","2222","2224","10.1107/S0108270195005798","","","0.71073","MoKα","","","0.023","","","0.035","","","","","2.37","2.37","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004175","5.23","0.003","6.822","0.001","5.175","0.002","91.54","0.02","117.51","0.03","90.46","0.03","163.66","0.12","293","","","","","","","","","","","5","P -1","-P 1","2","","magnesium sodium monophosphate","","- H Mg Na3 O8 P2 -","- H Mg Na3 O8 P2 -","- H Mg Na3 O8 P2 -","1","0.5","OH1084","Kawahara, A.; Yamakawa, J.; Yamada, T.; Kobashi, D.","Synthetic Magnesium Sodium Hydrogen Monophosphate: MgNa~3~H(PO~4~)~2~","Acta Crystallographica Section C","1995","51","11","2220","2222","10.1107/S0108270195006901","","","0.71069","MoKα","","","0.026","","","0.033","","","","","2.34","2.34","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004176","7.181","0.002","8.485","0.003","11.446","0.003","90","","103.11","0.02","90","","679.2","0.4","298","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H17 Br N2 O -","- C13 H17 Br N2 O -","- C26 H34 Br2 N4 O2 -","2","1","PA1181","Belin, C.; Chauvet, A.; Leloup, J. M.; Ribet, J. P.; Maurel, J. L.","2-[2-(2-Ethyl-2,3-dihydrobenzofuranyl)]-2-imidazoline Hydrobromide","Acta Crystallographica Section C","1995","51","11","2439","2441","10.1107/S0108270195006706","","","0.7107","MoKα","","","0.0391","","","0.0494","","","","","0.87","0.87","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004177","9.61","0.003","11.468","0.003","9.043","0.002","109.26","0.03","98.36","0.02","73.59","0.03","901","0.5","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","","","- C17 H22 O8 -","- C17 H22 O8 -","- C34 H44 O16 -","2","1","PA1182","Bocelli, G.; Cantoni, A.; Costa, M.","Dimethyl 4,4-Bis(ethoxycarbonyl)-1,2-cyclopentanediylidenediacetate","Acta Crystallographica Section C","1995","51","11","2374","2376","10.1107/S010827019500669X","","","0.71069","MoKα","","0.1558","0.0436","","0.1071","0.0947","","","","0.7","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004178","21.184","0.005","21.184","0.005","15.412","0.004","90","","90","","90","","6916","3","291","2","293","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H12 Cl N O3 -","- C16 H12 Cl N O3 -","- C256 H192 Cl16 N16 O48 -","16","1","PA1184","Palmer, R. A.; Richards, A. J.; Lisgarten, J. N.","2-Benzamido-3-(<i>p</i>-chlorophenyl)propenoic Acid (Antrex)","Acta Crystallographica Section C","1995","51","11","2338","2340","10.1107/S010827019500672X","","","1.54178","CuKα","","0.1133","0.0695","","0.3261","0.1838","","","","1.07","1.128","1.128","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004179","7.9184","0.001","8.9446","0.0014","10.861","0.002","109.41","0.009","107.918","0.006","90.336","0.006","685.31","0.19","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2,4,7-Trimethyl-2,3-dihydro-4H-pyrido[4,3-e]-1,2,4-thiadiazinium 1,1-Dioxide Iodide","","- C9 H14 I N3 O2 S -","- C9 H14 I N3 O2 S -","- C18 H28 I2 N6 O4 S2 -","2","1","PA1187","Dupont, L.; Pirotte, B.; de Tullio, P.; Diouf, O.; Masereel, B.; Delarge, J.","2,4,7-Trimethyl-2,3-dihydro-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazinium 1,1-Dioxide Iodide","Acta Crystallographica Section C","1995","51","11","2412","2414","10.1107/S0108270195008006","","","1.5418","CuKα","","0.0743","0.0692","","0.2008","0.1896","","","","1.072","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004180","12.641","0.002","5.5304","0.001","13.615","0.003","90","","105.847","0.015","90","","915.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","3,7-Dimethyl-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-dioxide inner salt","","- C8 H9 N3 O2 S -","- C8 H9 N3 O2 S -","- C32 H36 N12 O8 S4 -","4","1","PA1192","Dupont, L.; Pirotte, B.; de Tullio, P.; Masereel, B.; Delarge, J.","3,7-Dimethyl-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-Dioxide Zwitterion","Acta Crystallographica Section C","1995","51","11","2414","2416","10.1107/S010827019500802X","","","1.5418","CuKα","","0.0636","0.0454","","0.1281","0.1208","","","","0.948","1.063","1.063","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2004181","7.3767","0.0007","8.1696","0.0007","8.5483","0.0007","82.557","0.009","83.195","0.007","84.162","0.005","505.27","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","7-Methyl-3-methylsulfanyl-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-Dioxide Inner Salt","","- C8 H9 N3 O2 S2 -","- C8 H9 N3 O2 S2 -","- C16 H18 N6 O4 S4 -","2","1","PA1194","Dupont, L.; de Tullio, P.; Pirotte, B.; Masereel, B.; Delarge, J.","7-Methyl-3-methylthio-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazin-7-ium-4-ide 1,1-Dioxide Zwitterion","Acta Crystallographica Section C","1995","51","11","2416","2417","10.1107/S0108270195008031","","","1.5418","CuKα","","0.0447","0.042","","0.1297","0.1145","","","","1.051","1.084","1.084","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004182","11.742","0.003","9.1","0.002","15.705","0.003","90","","90","","90","","1678.1","0.7","297","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C8 H12 O3 -","- C8 H11 O3 -","- C64 H88 O24 -","8","1","PT1006","Coté, M. L.; Lalancette, R. A.; Thompson, H. W.","(±)-2-Oxocyclohexaneacetic Acid: Structure and Hydrogen-Bonding Pattern of a γ-Keto Acid","Acta Crystallographica Section C","1995","51","11","2305","2307","10.1107/S0108270195006640","","","0.71073","MoKα","","","0.0446","","","0.0529","","","","","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004183","4.463","0.003","11.546","0.005","15.697","0.005","90","","95.75","0.05","90","","804.8","0.7","150","0.2","150","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-acetoxymethylpyrrole-2-carbaldehyde","","- C8 H9 N O3 -","- C8 H9 N O3 -","- C32 H36 N4 O12 -","4","1","PT1024","Blake, A. J.; McNab, H.; Parsons, S.; Thornley, C.","3-Acetoxymethylpyrrole-2-carbaldehyde","Acta Crystallographica Section C","1995","51","11","2348","2350","10.1107/S0108270195006238","","","0.71073","MoKα","","0.0873","0.0538","","0.1703","0.1244","","","","1.045","0.983","0.983","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2004184","7.5018","0.001","17.358","0.004","5.6204","0.0004","90","","90","","90","","731.9","0.2","293","2","293","2","","","","","","","","3","A b m 2","A 2 -2b","39","","","","- S1.68 Se0.32 Ta3 -","- S1.673 Se0.327 Ta3 -","- S13.384 Se2.616 Ta24 -","8","","SE1065","Degen, T.; Harbrecht, B.","Ta~3~S~2{-~<i>x</i>}Se~<i>x~</i>, Partial Substitution of Selenium for Sulfur into a Tantalum-Rich Sulfide","Acta Crystallographica Section C","1995","51","11","2218","2220","10.1107/S0108270194009923","","","0.7093","MoKα","","0.0439","0.0222","","0.0425","0.0397","","","","0.916","0.97","0.97","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004185","13.719","0.002","7.726","0.001","3.875","0.001","90","","95.5","0.02","90","","408.83","0.13","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","sym-Tricyanobenzene","1,3,5-Tricyanobenzene","","- C9 H3 N3 -","- C9 H3 N3 -","- C18 H6 N6 -","2","1","SE1078","Reddy, D. S.; Panneerselvam, K.; Desiraju, G. R.; Carrell, H. L.; Carrell, C. J.","1,3,5-Tricyanobenzene","Acta Crystallographica Section C","1995","51","11","2352","2354","10.1107/S0108270195004483","","","0.7107","MoKα","","0.052","0.0428","","0.1328","0.1149","","","","0.628","0.611","0.611","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004186","8.575","0.002","20.711","0.004","16.583","0.003","90","","99.91","0.02","90","","2901.1","1","293","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H44 N2 Ni O P2 -","- C26 H44 N2 Ni O P2 -","- C104 H176 N8 Ni4 O4 P8 -","4","1","SZ1022","Penney, J.; VanderLende, D. D.; Boncella, J. M.; Abboud, K. A.","<i>trans</i>-Ni(Mes)[N(Ph)C(O)N(H)CMe~3~](PMe~3~)~2~","Acta Crystallographica Section C","1995","51","11","2269","2271","10.1107/S0108270195004513","","","0.71073","MoKα","","","0.0571","","","0.0627","","","","","1.7","1.7","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004187","6.336","0.004","7.986","0.005","17.602","0.009","90","","92.88","0.06","90","","889.5","0.9","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,4'-dinitro-2,2'-biimidazole","","- C12 H18 N8 O6 -","- C12 H18 N8 O6 -","- C24 H36 N16 O12 -","2","0.5","SZ1034","Bryan, C. D.; Scott, S.; Cordes, A. W.; Folkert, S. L.; Hester, C.; Collier, H.","4,4'-Dinitro-2,2'-biimidazole Dimethylformamide Solvate","Acta Crystallographica Section C","1995","51","11","2300","2301","10.1107/S0108270195004525","","","0.7107","MoKα","","0.14","0.051","","0.087","0.067","","","","","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004188","17.833","0.003","17.833","0.003","8.543","0.001","90","","90","","120","","2352.8","0.6","296","","","","","","","","","","","4","P 31","P 31","","","","","- C12 H10 N2 O -","- C12 H8 N2 O -","- C108 H72 N18 O9 -","9","3","TA1000","Tian, Y.-P.; Duan, C.-Y.; Xu, X.-X.; You, X.-Z.","Screw-Chain Structure of 1,10-Phenanthroline Hydrate, C~12~H~8~N~2~.H~2~O","Acta Crystallographica Section C","1995","51","11","2309","2312","10.1107/S010827019500549X","","","0.71073","MoKα","","","0.07","","","0.061","","","","","1.77","1.77","","","","","has coordinates","281832","2023-03-13","07:40:49",""
"2004189","13.887","0.002","8.121","0.001","16.201","0.003","90","","98.15","0.01","90","","1808.6","0.5","300","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H25 N O2 S -","- C20 H25 N O2 S -","- C80 H100 N4 O8 S4 -","4","1","VJ1009","Das, B. C.; Pain (Biswas), S.; Biswas, G.; Ganguly, S. N.; Banerjee, A.; Duax, W. L.; Maji, B. B.; Ghatak, K. L.","Tropinyl 2-Isopropylbenzo[<i>b</i>]thiophene-3-carboxylate, C~20~H~25~NO~2~S","Acta Crystallographica Section C","1995","51","11","2386","2388","10.1107/S0108270195004872","","","0.71073","MoKα","","","0.04","","","0.041","","","","","1.01","1.01","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004190","11.346","0.002","12.305","0.001","14.327","0.001","90","","90","","90","","2000.2","0.4","295","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H22 Cl N5 O4 -","- C19 H22 Cl N5 O4 -","- C76 H88 Cl4 N20 O16 -","4","1","VJ1015","Das, A. K.; Bertolasi, V.","<i>N</i>-[1-Phenyl-2(<i>R</i>)-propyl]-2-chloroadenosine. An Activating Agent of the Adenosine A2 Receptor","Acta Crystallographica Section C","1995","51","11","2408","2409","10.1107/S0108270195004793","","","0.71069","MoKα","","","0.0366","","","0.0452","","","","","0.57","0.57","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004191","9.397","0.006","9.627","0.008","13.805","0.008","96.2","0.06","102.31","0.05","115.17","0.06","1076.1","1.5","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H20 N8 S4 -","- C17 H20 N8 S4 -","- C34 H40 N16 S8 -","2","1","VJ1023","Biswas, G.; Chandra, T.; Avasthi, K.; Maulik, P. R.","1,3-Bis[4,6-bis(methylthio)-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidin-1-yl]propane","Acta Crystallographica Section C","1995","51","11","2453","2455","10.1107/S0108270195006524","","","0.71073","MoKα","","","0.037","","","0.079","","","","","0.782","0.782","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004192","12.416","0.001","6.391","0.001","15.552","0.002","90","","90","","90","","1234.1","0.3","295","","295","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C6 H12 Hg I2 N4 -","- C6 Hg I2 N4 -","- C24 Hg4 I8 N16 -","4","0.5","NA1153","Svensson, P. H.; Bengtsson-Kloo, L. A.; Stegemann, H.","(Hexamethylenetetramine)diiodomercury(II), HgI~2~.hmt","Acta Crystallographica Section C","1995","51","11","2289","2292","10.1107/S0108270195005567","","","0.7109","MoKα","","","0.0335","","","0.0344","","","","","2.07","2.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004193","7.346","0.001","5.87","0.002","15.959","0.003","90","","99.64","0.01","90","","678.5","0.3","300","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H17 F O3 S -","- C13 H17 F O3 S -","- C26 H34 F2 O6 S2 -","2","1","AB1200","Yakoubi, A.; Kallel, A.; Bizid, A.; Baklouti, A.","<i>trans</i>-2-Fluorocyclohexyl <i>p</i>-Toluenesulfonate and <i>trans</i>-2-Fluorocycloheptyl <i>p</i>-Toluenesulfonate","Acta Crystallographica Section C","1995","51","12","2705","2707","10.1107/S0108270195008080","","","0.71073","MoKα","","","0.029","","","0.032","","","","","1.1","1.1","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004194","6.022","0.001","7.319","0.001","32.279","0.005","90","","90","","90","","1422.7","0.4","300","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 F O3 S -","- C14 H19 F O3 S -","- C56 H76 F4 O12 S4 -","4","1","AB1200","Yakoubi, A.; Kallel, A.; Bizid, A.; Baklouti, A.","<i>trans</i>-2-Fluorocyclohexyl <i>p</i>-Toluenesulfonate and <i>trans</i>-2-Fluorocycloheptyl <i>p</i>-Toluenesulfonate","Acta Crystallographica Section C","1995","51","12","2705","2707","10.1107/S0108270195008080","","","0.71073","MoKα","","","0.044","","","0.046","","","","","1.6","1.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004195","6.576","0.002","7.517","0.002","8.227","0.003","89.88","0.05","70.69","0.05","74","0.05","367.1","0.3","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C5 H9 N S2 -","- C5 H9 N S2 -","- C10 H18 N2 S4 -","2","1","AB1269","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","Six Substituted Thiazolidine-2-thiones","Acta Crystallographica Section C","1995","51","12","2661","2665","10.1107/S0108270195007955","","","0.71073","MoKα","","","0.047","","","0.045","","","","","0.539","0.539","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004196","6.312","0.002","10.036","0.003","11.887","0.004","90","","105.39","0.05","90","","726","0.4","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H9 N S2 -","- C5 H9 N S2 -","- C20 H36 N4 S8 -","4","1","AB1269","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","Six Substituted Thiazolidine-2-thiones","Acta Crystallographica Section C","1995","51","12","2661","2665","10.1107/S0108270195007955","","","0.71073","MoKα","","","0.063","","","0.072","","","","","1.59","1.59","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004197","9.465","0.003","7.036","0.002","12.236","0.004","90","","93.15","0.05","90","","813.6","0.4","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H11 N S2 -","- C6 H11 N S2 -","- C24 H44 N4 S8 -","4","1","AB1269","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","Six Substituted Thiazolidine-2-thiones","Acta Crystallographica Section C","1995","51","12","2661","2665","10.1107/S0108270195007955","","","0.71073","MoKα","","","0.062","","","0.074","","","","","1.42","1.42","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004198","8.583","0.003","8.71","0.003","17.03","0.006","90","","90","","90","","1273.1","0.8","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H7 N S2 -","- C4 H7 N S2 -","- C32 H56 N8 S16 -","8","2","AB1269","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","Six Substituted Thiazolidine-2-thiones","Acta Crystallographica Section C","1995","51","12","2661","2665","10.1107/S0108270195007955","","","0.71073","MoKα","","","0.045","","","0.04","","","","","1.209","1.209","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004199","9.351","0.003","9.098","0.003","10.838","0.003","90","","81.54","0.05","90","","912","0.5","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H13 N S2 -","- C7 H13 N S2 -","- C28 H52 N4 S8 -","4","1","AB1269","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","Six Substituted Thiazolidine-2-thiones","Acta Crystallographica Section C","1995","51","12","2661","2665","10.1107/S0108270195007955","","","0.71073","MoKα","","","0.0352","","","0.0345","","","","","0.701","0.701","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004200","13.494","0.004","8.205","0.003","7.491","0.002","90","","90","","90","","829.4","0.4","293","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C6 H11 N S2 -","- C6 H11 N S2 -","- C24 H44 N4 S8 -","4","1","AB1269","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","Six Substituted Thiazolidine-2-thiones","Acta Crystallographica Section C","1995","51","12","2661","2665","10.1107/S0108270195007955","","","0.71073","MoKα","","","0.0398","","","0.0383","","","","","0.556","0.556","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004201","9.432","0.001","12.08","0.002","12.542","0.002","97.98","0.01","96.42","0.01","107.87","0.01","1328.7","0.4","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C29 H32 N6 O4 -","- C29 H32 N6 O5 -","- C58 H64 N12 O10 -","2","1","AB1278","Karczmarzyk, Z.; Karolak-Wojciechowska, J.; Pawlowski, M.","7-[3-(Dibenzylamino)-2-hydroxypropyl]-8-(furfurylamino)theophylline","Acta Crystallographica Section C","1995","51","12","2608","2610","10.1107/S0108270195008547","","","1.54184","CuKα","","","0.0563","","","0.0723","","","","","1.49","1.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004202","12.0126","0.0008","13.075","0.002","7.4562","0.0008","90","","90","","90","","1171.1","0.2","293","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H10 O3 -","- C15 H10 O3 -","- C60 H40 O12 -","4","1","AS1193","Honda, T.; Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A.","7-Hydroxy-3-phenylcoumarin, C~15~H~10~O~3~","Acta Crystallographica Section C","1995","51","12","2712","2714","10.1107/S0108270195008821","","","1.54184","CuKα","","","0.038","","","0.043","","","","","2.01","2.01","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004203","12.421","0.008","12.67","0.007","18.45","0.009","90","","95.48","0.05","90","","2890","3","298","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C30 H48 N2 O -","- C30 H48 N2 O -","- C120 H192 N8 O4 -","4","1","AS1196","Satake, K.; Hattori, T.; Kimura, M.; Kashino, S.","<i>N</i>-Acetyl-3,6-di-<i>tert</i>-butyl-2-(3,6-di-<i>tert</i>-butyl-3<i>H</i>-azepin-2-yl)-2,3-dihydro-1<i>H</i>-azepine","Acta Crystallographica Section C","1995","51","12","2707","2710","10.1107/S0108270195008833","","","0.71073","MoKα","","","0.047","","","0.03","","","","","1.33","1.33","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004204","18.248","0.001","4.442","0.003","15.913","0.002","90","","98.366","0.006","90","","1276.1","0.9","296","","","","","","","","","","","5","C 1 2 1","","","","","","- C4 H4 I N3 O -","- C4 H4 I N3 O -","- C32 H32 I8 N24 O8 -","8","2","AS1199","Okabe, N.; Tamaki, K.; Suga, T.","5-Iodocytosine","Acta Crystallographica Section C","1995","51","12","2696","2698","10.1107/S0108270195008845","","","0.71069","MoKα","","","0.04","","","0.045","","","","","1.75","1.75","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004205","13.464","0.001","6.225","0.001","13.476","0.001","90","","118.52","","90","","992.41","0.19","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H25 N7 O3 -","- C20 H25 N7 O3 -","- C40 H50 N14 O6 -","2","1","BK1090","Howell, P. L.; Pangborn, W. A.; Marshall, G. R.; Zabrocki, J.; Smith, G. D.","A Thyrotropin-Releasing Hormone Analogue: pGlu-Phe-<small>D</small>-Pro-Ψ[CN~4~]-NMe at 293 and 107K","Acta Crystallographica Section C","1995","51","12","2575","2579","10.1107/S0108270194014952","","","0.71069","MoKα","","","0.057","","","0.034","","","","","1.653","1.653","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004206","13.397","0.001","6.171","0.001","13.331","0.001","90","","118.44","0.01","90","","969.1","0.2","107","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H25 N7 O3 -","- C20 H25 N7 O3 -","- C40 H50 N14 O6 -","2","1","BK1090","Howell, P. L.; Pangborn, W. A.; Marshall, G. R.; Zabrocki, J.; Smith, G. D.","A Thyrotropin-Releasing Hormone Analogue: pGlu-Phe-<small>D</small>-Pro-Ψ[CN~4~]-NMe at 293 and 107K","Acta Crystallographica Section C","1995","51","12","2575","2579","10.1107/S0108270194014952","","","0.71069","MoKα","","","0.033","","","0.032","","","","","1.828","1.828","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004207","4.663","0.001","13.275","0.002","20.551","0.003","90","","90","","90","","1272.1","0.4","296","","","","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- C12 H18 O5 -","- C12 H18 O5 -","- C48 H72 O20 -","4","0.5","BK1105","Lalancette, R. A.; Thompson, H. W.; Coté, M. L.","<i>cis</i>-2-Oxo-1,3-cyclohexanedipropionic Acid: Structure and Hydrogen-Bonding Pattern of a δ-Keto 1,9-Diacid","Acta Crystallographica Section C","1995","51","12","2617","2619","10.1107/S0108270195008493","","","0.71073","MoKα","","","0.049","","","0.053","","","","","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004208","5.7473","0.0006","6.8421","0.0008","32.155","0.004","90","","90.634","0.008","90","","1264.4","0.3","297","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16.5 O3.25 -","- C14 H16.534 O3.267 -","- C56 H66.136 O13.068 -","4","1","BK1110","Coté, M. L.; Lalancette, R. A.; Long, D. J.; Thompson, H. W.","(±)-3-Oxo-<i>trans</i>-2-phenylcyclohexaneacetic Acid: Structure and Hydrogen-Bonding Pattern of a Partially Hydrated δ-Keto Acid","Acta Crystallographica Section C","1995","51","12","2615","2617","10.1107/S0108270195008213","","","0.71073","MoKα","","","0.056","","","0.06","","","","","1.32","1.32","","","","","has coordinates","203832","2020-10-21","18:00:00",""
"2004209","11.3031","0.0008","10.9569","0.0012","16.7039","0.0014","90","","105.644","0.006","90","","1992.1","0.3","294","1","294","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Tribenzyltin acetate","Tribenzyltin acetate","","- C23 H24 O2 Sn -","- C23 H24 O2 Sn -","- C92 H96 O8 Sn4 -","4","1","BK1129","Ferguson, G.; Spalding, T. R.; O'Dowd, A. T.; O'Shea, K. C.","Tribenzyltin Acetate, a Redetermination","Acta Crystallographica Section C","1995","51","12","2546","2548","10.1107/S010827019500816X","","","0.7107","MolybdenumKα","","0.0382","0.0261","","0.0724","0.0693","","","","1.068","1.153","1.153","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004210","8.571","0.001","8.842","0.001","16.607","0.001","90","","90","","90","","1258.6","0.2","295","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H18 Cl N O4 -","- C9 H18 Cl N O4 -","- C36 H72 Cl4 N4 O16 -","4","1","BK1131","Weber, H. P.; Anderson, R. C.; Shapiro, M.; Villhauer, E. B.; Gullion, T.","Acetyl-<small>L</small>-carnitine Hydrochloride","Acta Crystallographica Section C","1995","51","12","2570","2572","10.1107/S0108270195008420","","","1.54184","CuKα","","","0.0543","","","0.0639","","","","","3.231","3.231","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004211","13.934","0.002","14.316","0.002","7.101","0.002","97.86","0.01","103.79","0.02","79.6","0.01","1346.5","0.5","293","","293","","","","","","","","","4","P -1","-P 1","2","","7,19,28-trithiatetracyclo[11,11,7,1^3,23^,1^11,15^]tritriaconta- 1,3(32),11,12,14,23- hexaene-4,9,16,22,25,30-hexayne","","- C31 H20 Cl2 S3 -","- C30.55 H19.1 Cl1.1 S3 -","- C61.1 H38.2 Cl2.2 S6 -","2","1","BK1142","Mague, J. T.; Ensley, H. E.; Mahadevan, S.","A Precursor to Highly Unsaturated Cyclophanes: 7,19,28-Trithiatetracyclo[11.11.7.1^3,23^.1^11,15^]tritriaconta-1,3(32),11(33),12,14,23-hexaene-4,9,16,22,25,30-hexayne","Acta Crystallographica Section C","1995","51","12","2595","2598","10.1107/S0108270195009073","","","0.71073","MoKα","","0.074","0.054","","","0.085","","","","","3.085","3.085","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2004212","12.131","0.001","6.167","0.0005","16.507","0.002","90","","108.69","0.01","90","","1169.8","0.2","296","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,3-diphenyl-1-propyn-3-ol","","- C15 H12 O -","- C15 H12 O -","- C60 H48 O4 -","4","1","BK1146","Garcia, J. G.; Ramos, B.; Rodriguez, A.; Fronczek, F. R.","1,1-Diphenyl-3-propyn-1-ol","Acta Crystallographica Section C","1995","51","12","2674","2676","10.1107/S0108270195008171","","","1.54184","CuKα","","","0.045","","","0.054","","","","","2.566","2.566","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2004213","9.511","0.001","11.716","0.001","12.138","0.002","67.68","0.02","73.19","0.02","73.45","0.02","1174.1","0.3","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C23 H33 N7 O4 -","- C23 H33 N7 O4 -","- C46 H66 N14 O8 -","2","1","BM1000","Karczmarzyk, Z.; Karolak-Wojciechowska, J.; Pawlowski, M.","8-Benzylamino-7-{2-hydroxy-3-[4-(2-hydroxyethyl)-1-piperazinyl]propyl}theophylline","Acta Crystallographica Section C","1995","51","12","2610","2612","10.1107/S0108270195007207","","","1.54184","CuKα","","","0.0552","","","0.061","","","","","1.98","1.98","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2004214","8.854","0.004","9.832","0.004","27.11","0.008","90","","90","","90","","2360","1.6","293","","293","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C15 H14 O -","- C15 H14 O -","- C120 H112 O8 -","8","1","BM1013","Judas, N.; Kaitner, B.; Mestrovic, E.","1,3-Diphenylpropan-1-one","Acta Crystallographica Section C","1995","51","12","2656","2658","10.1107/S0108270195008730","","","0.71073","MoKα","","","0.037","","","0.061","","","","","1.21","1.21","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004215","9.504","0.002","15.059","0.003","5.295","0.002","90","","90","","90","","757.8","0.4","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","3-methylphthalic anhydride","","","- C9 H6 O3 -","- C9 H6 O3 -","- C36 H24 O12 -","4","1","BM1019","Bocelli, G.; Cantoni, A.","3-Methylphthalic Anhydride","Acta Crystallographica Section C","1995","51","12","2652","2654","10.1107/S0108270195008869","","","1.54178","CuKα","","0.085","0.0323","","0.0746","0.0433","","","","0.647","0.929","0.929","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004216","6.688","0.001","6.688","0.001","18.479","0.007","90","","90","","120","","715.8","0.3","293","2","293","2","","","","","","","","6","P 63/m c m","-P 6c 2","193","Europium(III) Tris-[dicyanoArgentate(I)]","","","- C12 H12 Ag6 Eu2 N12 O6 -","- C6 H6 Ag3 Eu N6 O3 -","- C12 H12 Ag6 Eu2 N12 O6 -","2","0.0833333","BR1098","Assefa, Z.; Staples, R. J.; Fackler, Jnr, J. P.; Patterson, H. H.; Shankle, G.","Europium(III) Tris[dicyanoargentate(I)] Trihydrate, Eu[Ag(CN)~2~]~3~.3H~2~O","Acta Crystallographica Section C","1995","51","12","2527","2529","10.1107/S0108270195008596","","","0.71073","MoKα","","0.0373","0.0351","","0.0924","0.0899","","","","1.13","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004217","14.3","0.002","6.43","0.001","8.754","0.002","90","","98.36","0.02","90","","796.4","0.3","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Cl O8 Pr3 Si2 -","- Cl0.5 O8 Pr2.5 Si2 -","- Cl2 O32 Pr10 Si8 -","4","0.5","BR1101","Guo, G.-C.; Wang, Y.-G.; Zhuang, J.-N.; Chen, J.-T.; Huang, J.-S.; Zhang, Q.-E.","Tripraseodymium Chloride Bis(orthosilicate), Pr~3~(SiO~4~)~2~Cl","Acta Crystallographica Section C","1995","51","12","2471","2473","10.1107/S0108270195008390","","","0.71069","MoKα","","","0.0323","","","0.04","","","","","1.06","1.06","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004218","7.121","0.004","7.121","0.004","11.4","0.007","90","","90","","120","","500.6","0.5","298","","298","","","","","","","","","4","P 63","P 6c","173","Potassium vanadium selenite","Potassium vanadium selenite","","- K O12 Se2 V3 -","- K O12 Se2 V3 -","- K2 O24 Se4 V6 -","2","0.333333","BR1110","Harrison, W. T. A.; Dussack, L. L.; Jacobson, A. J.","Potassium Vanadium Selenite, K(VO~2~)~3~(SeO~3~)~2~","Acta Crystallographica Section C","1995","51","12","2473","2476","10.1107/S0108270195008407","","","0.71073","MolybdenumKα","","0.035","0.035","","0.027","0.027","","","","1.07","1.07","1.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004219","12.523","0.003","8.583","0.002","15.93","0.003","90","","90.52","0.03","90","","1712.2","0.7","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Diflufenican","Diflufenican,2',4'-difluoro-2-(α,α,α,trifluoro-m-tolyloxy) nicotinanilide.","","- C19 H11 F5 N2 O2 -","- C19 H11 F5 N2 O2 -","- C76 H44 F20 N8 O8 -","4","1","CF1003","Pèpe, G.; Pfefer, G.; Boistelle, R.; Marchal, P.","Diflufenican, <i>N</i>-(2,4-Difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]-3-pyridinecarboxamide","Acta Crystallographica Section C","1995","51","12","2671","2672","10.1107/S010827019500789X","","","1.5418","CuKα","","0.057","0.057","","0.057","0.057","","","","0.84","0.84","0.84","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2004220","17.601","0.011","17.601","0.011","12.235","0.008","90","","90","","90","","3790","4","288","","288","","","","","","","","","5","P 4/n :2","-P 4a","85","","tetrakis(N,N'-diphenylbenzamidinato)dicopper(II) dichloromethane solvate","","- C78 H64 Cl4 Cu2 N8 -","- C78 H60 Cl4 Cu2 N8 -","- C156 H120 Cl8 Cu4 N16 -","2","0.25","CF1005","Halfpenny, J.","Tetrakis(<i>N</i>,<i>N</i>'-diphenylbenzamidinato)dicopper(II) Dichloromethane Solvate","Acta Crystallographica Section C","1995","51","12","2542","2544","10.1107/S0108270195008651","","","0.7107","MoKα","","","0.056","","","0.056","","","","","1.427","1.427","","","","","has coordinates,has disorder","192027","2020-10-21","18:00:00",""
"2004221","18.479","0.004","14.511","0.005","14.389","0.004","90","","90","","90","","3858.4","1.9","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Tetracarbonylbis(3-aminopropyl)phenylphosphinemolybdenum(0)","","- C16 H21 Mo N2 O4 P -","- C16 H21 Mo N2 O4 P -","- C128 H168 Mo8 N16 O32 P8 -","8","1","CF1007","Hursthouse, M. B.; Malik, K. M. A.; Beckett, M. A.","[Bis(3-aminopropyl)phenylphosphine-<i>N</i>,<i>P</i>]tetracarbonylmolybdenum(0)","Acta Crystallographica Section C","1995","51","12","2480","2482","10.1107/S0108270195007426","","","0.71069","MoKα","","0.0886","0.0362","","0.1275","0.0858","","","","0.653","0.617","0.617","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004222","12.826","0.0005","16.9115","0.0004","9.0052","0.0003","90","","90","","90","","1953.29","0.11","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","","1,1,3,4-tetramethyl-3-(1-methyl-1H-indole-3-yl)-2,2,3,4-tetrahydro-cyclo- penta[b]indole","","- C24 H26 N2 -","- C24 H26 N2 -","- C96 H104 N8 -","4","1","CF1009","Schollmeyer, D.; Fischer, G.; Pindur, U.","Dimeric 3-Vinylindoles as Potential Antitumor Active Compounds: 1,1,3,4-Tetramethyl-3-(1-methyl-1<i>H</i>-indol-3-yl)-1,2,3,4-tetrahydrocyclopenta[<i>b</i>]indole and 1,1,3-Trimethyl-4-phenylsulfonyl-3-(1-phenylsulfonyl-1<i>H</i>-indol-3-yl)-1,2,3,4-tetrahydrocyclopenta[<i>b</i>]indole","Acta Crystallographica Section C","1995","51","12","2572","2575","10.1107/S0108270195007761","","","1.54178","CuKα","","0.0504","0.0494","","0.1383","0.1362","","","","1.031","1.033","1.033","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004223","12.34","0.001","13.766","0.002","17.1648","0.0009","90","","92.258","0.009","90","","2913.6","0.5","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1,3-trimethyl-4-benzenesulfonyl-3-(1-benzenesulfonyl-1H-indole-3-yl)- 2,2,3,4-tetrahydro-cyclopenta[b]indole","","- C34 H30 N2 O4 S2 -","- C34 H30 N2 O4 S2 -","- C136 H120 N8 O16 S8 -","4","1","CF1009","Schollmeyer, D.; Fischer, G.; Pindur, U.","Dimeric 3-Vinylindoles as Potential Antitumor Active Compounds: 1,1,3,4-Tetramethyl-3-(1-methyl-1<i>H</i>-indol-3-yl)-1,2,3,4-tetrahydrocyclopenta[<i>b</i>]indole and 1,1,3-Trimethyl-4-phenylsulfonyl-3-(1-phenylsulfonyl-1<i>H</i>-indol-3-yl)-1,2,3,4-tetrahydrocyclopenta[<i>b</i>]indole","Acta Crystallographica Section C","1995","51","12","2572","2575","10.1107/S0108270195007761","","","0.71069","MoKα","","0.129","0.0502","","0.1446","0.1151","","","","1.008","1.101","1.101","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004224","7.774","0.016","7.973","0.012","8.053","0.017","94.28","0.15","109.45","0.19","105.67","0.13","445.7","1.7","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C7 H4 N2 O2 S2 -","- C7 H4 N2 O2 S2 -","- C14 H8 N4 O4 S4 -","2","1","CF1016","Howie, R. A.; Wardell, J. L.","2-Nitrobenzenesulfenyl Thiocyanate","Acta Crystallographica Section C","1995","51","12","2651","2652","10.1107/S0108270195009474","","","0.71073","MoKα","","","0.07","","","0.071","","","","","1.38","1.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004225","14.04","0.003","5.804","0.001","17.728","0.002","90","","90","","90","","1444.6","0.4","300","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H14 Cl N O2 -","- C17 H14 Cl N O2 -","- C68 H56 Cl4 N4 O8 -","4","1","CR1165","Kokila, M. K.; Jain, A.; Puttaraja; Kulkarni, M. V.; Shivaprakash, N. C.","4-(4-Chloroanilinomethyl)-6-methylcoumarin","Acta Crystallographica Section C","1995","51","12","2585","2586","10.1107/S0108270195006263","","","0.7093","MoKα","","","0.041","","","0.033","","","","","4.41","4.41","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004226","13.5","0.02","9.24","0.02","11.74","0.02","90","","104.4","0.2","90","","1418","5","20","","20","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","hexaammineruthenium(III)tristhiocyanate","","- C3 D18 N9 Ru S3 -","- C3 H24 N9 Ru S3 -","- C12 H96 N36 Ru4 S12 -","4","1","CR1174","Reynolds, P. A.; Figgis, B. N.; Schultz, A. J.","[Ru(ND~3~)~6~](SCN)~3~ at 20 K by Time-of-Flight Neutron Diffraction","Acta Crystallographica Section C","1995","51","12","2517","2520","10.1107/S0108270195007153","","neutron","","Pulsed_neutron","","0.133","0.133","","0.11","0.11","","","","0.84","0.84","0.84","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004227","11.357","0.004","11.643","0.004","17.638","0.009","98.49","","96.44","","117.36","0.01","2005.2","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H50 Mo N4 O5 S2 -","- C38 H50 Mo N4 O5 S2 -","- C76 H100 Mo2 N8 O10 S4 -","2","1","CR1181","Li-Kao, J.; González, O.; Mariezcurrena, R.; Baggio, R.; Garland, M. T.; Carrillo, D.","A <i>cis</i>-Oxo[diphenylhydrazido(2‒)]molybdenum Complex: (Et~3~NH)~2~[MoO(NNPh~2~)(SC~6~H~4~CO~2~)~2~]","Acta Crystallographica Section C","1995","51","12","2486","2489","10.1107/S0108270195006007","","","0.71073","MoKα","","0.0344","0.0285","","0.0744","0.0702","","","","1.054","1.065","1.065","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004228","18.171","0.004","7.157","0.001","26.165","0.005","90","","90.2","0.03","90","","3402.7","1.1","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Dimethyl-3,5-dimethoxycarbonyl-4-(2-nitrosophenyl)pyridine","","- C17 H16 N2 O5 -","- C17 H16 N2 O5 -","- C136 H128 N16 O40 -","8","2","CR1185","Rowan, K. R.; Holt, E. M.","3,5-Dimethoxycarbonyl-2,6-dimethyl-4-(2-nitrosophenyl)pyridine and Dichlorobis[3,5-dimethoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)pyridine]copper(II)","Acta Crystallographica Section C","1995","51","12","2554","2559","10.1107/S0108270195005828","","","0.71073","MoKα","","0.2602","0.063","","0.158","0.1","","","","0.694","1.136","1.136","","","","","has coordinates","198484","2020-10-21","18:00:00",""
"2004229","13.184","0.003","7.768","0.002","17.736","0.004","90","","91.5","0.03","90","","1815.8","0.7","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[2,6-dimethyl-3,5-dimethoxycarbonyl-4- (2-nitrophenyl)pyridine]dichlorocopper(II)","","- C34 H32 Cl2 Cu N4 O12 -","- C34 H32 Cl2 Cu N4 O12 -","- C68 H64 Cl4 Cu2 N8 O24 -","2","0.5","CR1185","Rowan, K. R.; Holt, E. M.","3,5-Dimethoxycarbonyl-2,6-dimethyl-4-(2-nitrosophenyl)pyridine and Dichlorobis[3,5-dimethoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)pyridine]copper(II)","Acta Crystallographica Section C","1995","51","12","2554","2559","10.1107/S0108270195005828","","","0.71073","MoKα","","0.122","0.058","","0.1162","0.071","","","","","1.7","1.7","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004230","8.884","0.003","26.179","0.002","7.286","0.002","90","","90","","90","","1694.5","0.7","295","","","","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C19 H20 O6 -","- C19 H20 O6 -","- C76 H80 O24 -","4","1","CR1190","Stomberg, R.; Li, S.; Lundquist, K.","(<i>Z</i>)-2,3-Bis(3,4-dimethoxyphenyl)propenoic Acid","Acta Crystallographica Section C","1995","51","12","2698","2700","10.1107/S0108270195009140","","","0.71073","MoKα","","","0.034","","","0.041","","","","","1.16","1.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004231","11.274","0.002","14.2626","0.0009","12.375","0.001","90","0.006","114.56","0.01","90","0.008","1809.8","0.4","293","","293","","","","","","","","","9","P 1 21/m 1","-P 2yb","11","","fac-tricarbonylrheniumbis[μ-methylaminobis(difluorophosphine)]triphenyl phosphineplatinum(Re-Pt) trifluoromethanesulfonate","","- C24 H21 F11 N2 O6 P5 Pt Re S -","- C24 H21 F11 N2 O6 P5 Pt Re S -","- C48 H42 F22 N4 O12 P10 Pt2 Re2 S2 -","2","0.5","CR1192","Mague, J. T.; Lin, Z.","A Cationic Rhenium‒Platinum Complex: <i>fac</i>-Tricarbonylrhenium-bis[μ-methylaminobis(difluorophosphine)]-triphenylphosphineplatinum Trifluoromethanesulfonate","Acta Crystallographica Section C","1995","51","12","2508","2510","10.1107/S0108270195006470","","","0.71073","Mo-Kα","","0.046","0.028","","","0.039","","","","","1.327","1.327","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2004232","9.715","0.002","5.659","0.002","22.763","0.005","90","","100.1","0.01","90","","1232.1","0.6","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H12 Br N O4 -","- C11 H12 Br N O4 -","- C44 H48 Br4 N4 O16 -","4","1","CR1193","Rath, N. P.; Boehlow, T. R.; Spilling, C. D.","Ethyl 3-(3-Bromo-4-hydroxyphenyl)-2(<i>E</i>)-(hydroxyimino)propanoate","Acta Crystallographica Section C","1995","51","12","2654","2656","10.1107/S0108270195007335","","","0.71073","MoKα","","0.1553","0.0613","","0.1189","0.092","","","","0.97","1.114","1.114","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004233","11.914","0.002","17.96","0.002","11.997","0.002","90","","106.67","0.01","90","","2459.2","0.7","294","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H46 Cu6 N12 O2 S6 -","- C36 H42 Cu6 N12 O2 S6 -","- C72 H84 Cu12 N24 O4 S12 -","2","0.5","DE1000","Seth, S.; Das, A. K.; Mak, T. C. W.","Distant Copper‒Copper Interactions in a Metal-Organic Compound in the Solid State: Hexakis[(μ~3~-4,6-dimethylpyrimidine-2-thiolato-<i>N</i>:<i>S</i>:<i>S</i>)copper(I)] Dihydrate","Acta Crystallographica Section C","1995","51","12","2529","2532","10.1107/S0108270195005737","","","0.71073","MoKα","","","0.041","","","0.037","","","","","1.054","1.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004234","10.613","0.003","14.271","0.002","15.172","0.003","90","0.03","90","0.02","90","0.03","2297.9","0.9","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Anomolin","8,8-dimethyl-9,10-di(2-methylbut-2-enoyloxy)-9,10-dihydropyrano [2,3-h] -[2H]-[1]-benzopyran-2-one","","- C24 H26 O7 -","- C24 H26 O7 -","- C96 H104 O28 -","4","1","DE1002","Padha, N.; Goswami, K. N.; Yadava, V. S.; Nethaji, M.","Anomalin. A Dihydropyranocoumarin Derivative from the Plant <i>Lingusticum elatum</i>","Acta Crystallographica Section C","1995","51","12","2710","2712","10.1107/S0108270195008341","","","0.7107","MoKα","","0.1964","0.0659","","0.2862","0.1638","","","","1.043","1.235","1.235","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004235","9.238","0.001","10.959","0.001","15.168","0.001","90","","90.64","0.01","90","","1535.5","0.2","293","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 O5 -","- C18 H16 O5 -","- C72 H64 O20 -","4","1","DE1003","Magotra, D. K.; Gupta, V. K.; Rajnikant; Goswami, K. N.; Gupta, B. D.","5-Acetoxy-6-(1,1-dimethyl-2-propenyl)-2<i>H</i>-furo[2,3-<i>h</i>][1]benzopyran-2-one","Acta Crystallographica Section C","1995","51","12","2637","2639","10.1107/S0108270195008353","","","0.71073","MoKα","","","0.042","","","0.11","","","","","0.899","0.899","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004236","10.8234","0.0009","10.3459","0.0008","14.381","0.002","90","","63.025","0.009","90","","1435.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dimethylammonium Pentachlorobismuthate(III)","","- C4 H16 Bi Cl5 N2 -","- C4 H16 Bi Cl5 N2 -","- C16 H64 Bi4 Cl20 N8 -","4","1","DU1124","Jarraya, S.; Ben Hassen, R.; Daoud, A.; Jouini, T.","Dimethylammonium Pentachlorobismuthate(III)","Acta Crystallographica Section C","1995","51","12","2537","2538","10.1107/S010827019500758X","","","0.71069","MoKα","","0.0594","0.0382","","0.0706","0.0668","","","","1.306","1.394","1.394","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004237","4.945","0.002","4.945","0.002","36.78","0.01","90","1","90","1","120","1.3","779","10","293","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- Ce2 Ni5 Zn2 -","- Ce2 Ni5 Zn2 -","- Ce12 Ni30 Zn12 -","6","0.166667","DU1126","Pavlyuk, V. V.; Opainych, I. M.; Bodak, O. I.; Černý, R.; Yvon, K.","Rhombohedral Ce~2~Ni~5~Zn~2~ and Hexagonal CeNi~2~Zn: the First Ternary Compounds from the Ce‒Ni‒Zn System","Acta Crystallographica Section C","1995","51","12","2464","2466","10.1107/S010827019500655X","","","0.71073","MoKα","","0.064","0.055","","0.052","0.05","","","","1.684","1.785","1.785","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004238","5.045","0.003","5.045","0.003","16.434","0.007","90","","90","","120","","362.2","0.3","293","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ce Ni2 Zn -","- Ce Ni2 Zn -","- Ce6 Ni12 Zn6 -","6","0.25","DU1126","Pavlyuk, V. V.; Opainych, I. M.; Bodak, O. I.; Černý, R.; Yvon, K.","Rhombohedral Ce~2~Ni~5~Zn~2~ and Hexagonal CeNi~2~Zn: the First Ternary Compounds from the Ce‒Ni‒Zn System","Acta Crystallographica Section C","1995","51","12","2464","2466","10.1107/S010827019500655X","","","0.71073","MoKα","","0.085","0.066","","0.034","0.034","","","","2.711","2.512","2.512","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004239","7.179","0.002","8.354","0.002","14.455","0.004","90","","93.8","0.02","90","","865","0.4","294","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- Al3 Fe2 Si3 -","- Al3 Fe2 Si3 -","- Al24 Fe16 Si24 -","8","2","DU1127","Gueneau, C.; Servant, C.; d'Yvoire, F.; Rodier, N.","Fe~2~Al~3~Si~3~","Acta Crystallographica Section C","1995","51","12","2461","2464","10.1107/S0108270195007864","","","0.71073","MoKα","","","0.017","","","0.0218","","","","","0.64","0.64","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004241","7.9572","0.0016","15.7497","0.0012","8.505","0.0015","90","","110.2","0.02","90","","1000.3","0.3","290","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H12 N4 O -","- C9 H12 N4 O -","- C36 H48 N16 O4 -","4","1","FG1045","Bullerwell, W. L.; MacGillivray, L. R.; Zaworotko, M. J.; Vaughan, K.; Wilman, D. E. V.","1-(<i>p</i>-Carbamoylphenyl)-3,3-dimethyltriazene, an Antitumour Agent","Acta Crystallographica Section C","1995","51","12","2624","2627","10.1107/S0108270195008419","","","0.710939","MoKα","","","0.061","","","0.05","","","","","3.43","3.43","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2004242","6.531","0.006","11.659","0.002","32.198","0.007","90","","90","","90","","2452","2","294","","294","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","η-Cyclopentadienyl-oxoperoxo(trimethylsilylmethyl)tungsten","","- C9 H16 O3 Si W -","- C9 H16 O3 Si W -","- C72 H128 O24 Si8 W8 -","8","1","FG1059","Legzdins, P.; Phillips, E. C.; Trotter, J.; Yee, V. C.","(η^5^-Cyclopentadienyl)oxo(peroxo-<i>O</i>,<i>O</i>')(trimethylsilylmethyl)tungsten and the Related (η^5^-Pentamethylcyclopentadienyl)oxo(peroxo-<i>O</i>,<i>O</i>')(trimethylsilylmethyl)tungsten-Tetracyanoethylene (2/1) Complex","Acta Crystallographica Section C","1995","51","12","2498","2501","10.1107/S0108270195004951","","","0.7093","MolybdenumKα~1~","","","0.084","","","0.114","","","","","4.1","4.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004243","19.326","0.002","9.831","0.001","23.485","0.006","90","","107.25","0.01","90","","4261.3","1.3","294","","294","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","η-Pentamethylcyclopentadienyl-oxoperoxo- (trimethylsilylmethyl)tungsten - tetracyanoethylene","","- C34 H52 N4 O6 Si2 W2 -","- C36 H52 N4 O6 Si2 W2 -","- C144 H208 N16 O24 Si8 W8 -","4","0.5","FG1059","Legzdins, P.; Phillips, E. C.; Trotter, J.; Yee, V. C.","(η^5^-Cyclopentadienyl)oxo(peroxo-<i>O</i>,<i>O</i>')(trimethylsilylmethyl)tungsten and the Related (η^5^-Pentamethylcyclopentadienyl)oxo(peroxo-<i>O</i>,<i>O</i>')(trimethylsilylmethyl)tungsten-Tetracyanoethylene (2/1) Complex","Acta Crystallographica Section C","1995","51","12","2498","2501","10.1107/S0108270195004951","","","0.7093","MolybdenumKα~1~","","","0.04","","","0.051","","","","","1.65","1.65","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004244","5.415","0.002","11.618","0.005","15.558","0.009","90","","90","","90","","978.8","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-Gylcyl-L-Glutamine monohydrate","","- C7 H15 N3 O5 -","- C7 H15 N3 O5 -","- C28 H60 N12 O20 -","4","1","FG1069","Panneerselvam, K.; Soriano-García, M.","<small>L</small>-Glycyl-<small>L</small>-Glutamine Monohydrate","Acta Crystallographica Section C","1995","51","12","2718","2720","10.1107/S0108270195009218","","","1.54178","CuKα","","0.0341","0.034","","0.09","0.0898","","","","1.05","1.052","1.052","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004245","8.106","0.001","14.788","0.001","7.866","0.001","100.93","0.01","103.28","0.01","90.86","0.01","899.35","0.18","294","","294","","","","","","","","","4","P -1","-P 1","2","","Dimethyl 1,8-dichloro-9,10-dihydro-9,10- ethenoanthracene-11,12-dicarboxylate","","- C20 H14 Cl2 O4 -","- C20 H14 Cl2 O4 -","- C40 H28 Cl4 O8 -","2","1","FG1082","Rettig, S. J.; Scheffer, J. R.; Trotter, J.; Yang, J.","Photochemistry of Dimethyl 1,8-Dichloro-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate","Acta Crystallographica Section C","1995","51","12","2685","2687","10.1107/S0108270195007943","","","1.54178","CuKα","","","0.036","","","0.052","","","","","3.96","3.96","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004246","9.756","0.001","10.556","0.001","8.83","0.001","107.22","0.01","105.31","0.01","95.4","0.01","822.99","0.17","294","","294","","","","","","","","","4","P -1","-P 1","2","","Dimethyl 1-chloro-4b,8b,8c,8d-tetrahydrodibenzo[a,f] cyclopropa[cd]pentalene-8c,8d-dicarboxylate","","- C20 H15 Cl O4 -","- C20 H15 Cl O4 -","- C40 H30 Cl2 O8 -","2","1","FG1085","Rettig, S. J.; Scheffer, J. R.; Trotter, J.; Yang, J.","Dimethyl 1-Chloro-4b,8b,8c,8d-tetrahydrodibenzo[<i>a</i>,<i>f</i>]cyclopropa[<i>cd</i>]pentalene-8c,8d-dicarboxylate","Acta Crystallographica Section C","1995","51","12","2690","2691","10.1107/S0108270195008237","","","1.54178","CuKα","","","0.035","","","0.046","","","","","4.2","4.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004247","10.718","0.001","13.05","0.001","5.5074","0.0004","90.27","0.01","104.32","0.01","109.86","0.01","698.66","0.12","294","","294","","","","","","","","","3","P -1","-P 1","2","","3,3,18,18-Tetramethyl-1,5,16,20-tetraoxadispiro[5,8,5,8] octacosane OR 5,5-Dimethyl-1,3-dioxacyclohexan-2-spiro-1'-cyclooctadecan- 10'-spiro-2""-5"",5""-dimethyl-1"",3""-dioxacyclohexane OR Dispiro[5,5-dimethyl-1,3-dioxacyclohexane-2,1'-cyclooctadecan- 10',2""-5"",5""-dimethyl-1"",3""-dioxacyclohexane]","","- C28 H52 O4 -","- C28 H52 O4 -","- C28 H52 O4 -","1","0.5","FG1091","Lewis, T. J.; Rettig, S. J.; Scheffer, J. R.; Trotter, J.","3,3,18,18-Tetramethyl-1,5,16,20-tetraoxadispiro[5.8.5.8]octacosane","Acta Crystallographica Section C","1995","51","12","2688","2690","10.1107/S0108270195008201","","","1.54178","CuKα","","","0.042","","","0.056","","","","","2.9","2.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004248","9.92","0.0007","11.2088","0.0008","11.7547","0.0006","90","","96.931","0.005","90","","1297.47","0.15","294.2","","294","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Tricyclo[22.2.2.2^11,14^]triaconta-11,13,24,26,27,29-hexaene-6,19-dione","","- C30 H40 O2 -","- C30 H40 O2 -","- C60 H80 O4 -","2","0.5","FG1093","Rettig, S. J.; Scheffer, J. R.; Trotter, J.; Yang, J.","Tricyclo[22.2.2.2^11,14^]triaconta-11,13,24,26,27,29-hexaene-6,19-dione","Acta Crystallographica Section C","1995","51","12","2687","2688","10.1107/S0108270195008663","","","1.54178","CuKα","","0.0904","0.0384","","0.0397","0.0366","","","","","2.339","2.339","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004249","12.452","0.002","16.182","0.002","8.118","0.002","90","","90.68","0.02","90","","1635.6","0.5","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl 4b,8b,8c,8d-tetrahydrodibenzo[a,f] cyclopropa[cd]pentalene-8b-carboxylate-8c- thionocarboxylate","","- C20 H16 O3 S -","- C20 H16 O3 S -","- C80 H64 O12 S4 -","4","1","FG1099","Jones, R.; Rattray, A. G. M.; Scheffer, J. R.; Trotter, J.","Dimethyl 4b,8b,8c,8d-Tetrahydrodibenzo[<i>a</i>,<i>f</i>]cyclopropa[<i>cd</i>]pentalene-8b-carboxylate-8c-thionocarboxylate and the Corresponding 8c-Thiolocarboxylate","Acta Crystallographica Section C","1995","51","12","2691","2694","10.1107/S0108270195009012","","","0.71069","MoKα","","","0.048","","","0.055","","","","","3","3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004250","7.911","0.001","14.457","0.001","14.813","0.001","90","","90.9","0.01","90","","1693.9","0.3","294","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dimethyl 4b,8b,8c,8d-tetrahydrodibenzo[a,f] cyclopropa[cd]pentalene-8b-carboxylate-8c- thiolocarboxylate","","- C20 H16 O3 S -","- C20 H16 O3 S -","- C80 H64 O12 S4 -","4","1","FG1099","Jones, R.; Rattray, A. G. M.; Scheffer, J. R.; Trotter, J.","Dimethyl 4b,8b,8c,8d-Tetrahydrodibenzo[<i>a</i>,<i>f</i>]cyclopropa[<i>cd</i>]pentalene-8b-carboxylate-8c-thionocarboxylate and the Corresponding 8c-Thiolocarboxylate","Acta Crystallographica Section C","1995","51","12","2691","2694","10.1107/S0108270195009012","","","1.54178","CuKα","","","0.042","","","0.064","","","","","2.8","2.8","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004251","15.225","0.004","8.652","0.003","9.306","0.002","90","","90","","90","","1225.8","0.6","296.2","","296.2","","","","","","","","","4","P n a 21","P 2c -2n","33","","(2,3-benzobicyclo[2.2.1]hepta-2,5-diene)tricarbonylchromium","","- C14 H10 Cr O3 -","- C14 H10 Cr O3 -","- C56 H40 Cr4 O12 -","4","1","FG1100","Blake, J. L.; Cook, D. J.; Squattrito, P. J.; Howell, B. A.","<i>exo</i>-π-(Benzonorbornadiene)tricarbonylchromium","Acta Crystallographica Section C","1995","51","12","2565","2567","10.1107/S0108270195008432","","","0.7107","MoKα","","0.0755","0.0328","","0.0331","0.0287","","","","","1.579","1.579","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004252","11.13","0.001","13.157","0.007","23.077","0.002","90","","95.68","0.01","90","","3362.7","1.8","239","","","","","","","","","","","5","P 1 2/n 1","-P 2yac","","","","","- C72 H84 Li2 O9 Sn3 -","- C74 H70 Li2 O7 Sn3 -","- C148 H140 Li4 O14 Sn6 -","2","0.5","HU1067","Smith, G. D.; Fanwick, P. E.; Rothwell, I. P.","A Trigonal Prismatic Cluster Compound of Tin and Lithium: Structure of [{Sn(OCMe~2~C~6~H~4~)~2~}~3~Li~2~O].2HOCMe~2~Ph","Acta Crystallographica Section C","1995","51","12","2501","2503","10.1107/S0108270193012302","","","0.71073","MoKα","","","0.033","","","0.042","","","","","1.244","1.244","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004253","6.886","0.003","7.106","0.003","10.591","0.004","75.23","0.04","84.72","0.03","69.46","0.03","469.3","0.4","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H7 N O3 -","- C12 H7 N O3 -","- C24 H14 N2 O6 -","2","1","HU1087","Chaloner, P. A.; Hitchcock, P. B.; Sutton, P. G.","3-Nitrodibenzofuran and 3-Iododibenzofuran","Acta Crystallographica Section C","1995","51","12","2680","2683","10.1107/S0108270194013338","","","0.71069","MoKα","","","0.047","","","0.056","","","","","1.8","1.8","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004254","6.245","0.002","13.399","0.005","11.899","0.003","90","","98.14","0.03","90","","985.6","0.5","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H7 I O -","- C12 H7 I O -","- C48 H28 I4 O4 -","4","1","HU1087","Chaloner, P. A.; Hitchcock, P. B.; Sutton, P. G.","3-Nitrodibenzofuran and 3-Iododibenzofuran","Acta Crystallographica Section C","1995","51","12","2680","2683","10.1107/S0108270194013338","","","0.71069","MoKα","","","0.03","","","0.038","","","","","1.2","1.2","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2004255","15.922","0.006","9.591","0.004","23.019","0.009","90","","102.34","0.03","90","","3434","2","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H46 I O9 P -","- C33 H46 I O9 P -","- C132 H184 I4 O36 P4 -","4","1","HU1104","Chaloner, P. A.; Harrison, R. M.; Hitchcock, P. B.","Hexyltris(2,4,6-trimethoxyphenyl)phosphonium Iodide","Acta Crystallographica Section C","1995","51","12","2683","2685","10.1107/S0108270194013363","","","0.71069","MoKα","","","0.041","","","0.049","","","","","1.6","1.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004256","9.344","0.002","6.509","0.002","12.764","0.003","90","","108.53","0.02","90","","736.1","0.3","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,5-Dichlorocyclotetra(azathiene)","","- Cl2 N4 S4 -","- Cl2 N4 S4 -","- Cl8 N16 S16 -","4","1","HU1126","Žák, Z.; Ružička, A.","Redetermination of 1,5-Dichlorocyclotetra(azathiene) at 120 K","Acta Crystallographica Section C","1995","51","12","2478","2479","10.1107/S010827019500744X","","","0.71073","MoKα","","0.036","0.0253","","0.074","0.0696","","","","1.053","1.105","1.105","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004257","7.813","0.002","12.708","0.003","9.392","0.002","90","","101.14","0.02","90","","914.9","0.4","24","","24","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H6 N2 O6 -","- C8 H6 N2 O6 -","- C32 H24 N8 O24 -","4","1","HU1148","Cristiano, M. L. S.; Johnstone, R. A. W.; Pratt, M. J.","3-Hydroxy-2,6-dinitroacetophenone: an Unusual Substitution Pattern Resulting from Nitration of 3-Hydroxyacetophenone","Acta Crystallographica Section C","1995","51","12","2581","2583","10.1107/S0108270195007451","","","0.7107","MoKα","","","0.0656","","","0.0766","","","","","2.982","2.982","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004258","13.372","0.001","15.427","0.002","16.627","0.006","104.79","0.02","77.32","0.02","104.4","0.01","3167.3","1.3","296","","","","","","","","","","","6","P -1","-P 1","2","","","","- C29 H35 Cu N P S5 -","- C29 H35 Cu N P S5 -","- C116 H140 Cu4 N4 P4 S20 -","4","2","JZ1010","Sheng, T.; Li, H.; Huang, Q.; Wu, X.","Tetraethylammonium (2-Thioxo-1,3-dithiole-4,5-dithiolato-<i>S</i>^4^,<i>S</i>^5^)triphenylphosphinecopper(I)","Acta Crystallographica Section C","1995","51","12","2524","2526","10.1107/S0108270195002885","","","0.71073","MoKα","","","0.069","","","0.089","","","","","1.58","1.58","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2004259","9.313","0.001","19.202","0.003","22.33","0.003","90","","90","","90","","3993.2","0.9","297","2","297","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C23 H24 N2 Ni O2 -","- C23 H23 N2 Ni O2 -","- C184 H184 N16 Ni8 O16 -","8","1","JZ1023","Elmali, A.; Atakol, O.; Svoboda, I.; Fuess, H.","{1-[(2-Hydroxybenzylidene)aminomethyl]-naphthalen-2-olato(2‒)-<i>N</i>,<i>O</i>,<i>O</i>'}(piperidine-<i>N</i>)nickel(II)","Acta Crystallographica Section C","1995","51","12","2520","2522","10.1107/S0108270195007025","","","0.71093","MoKα","","0.1333","0.0377","","0.1202","0.0886","","","","0.998","1.063","1.063","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004260","12.658","0.001","14.186","0.002","9.527","0.001","90","","90","","90","","1710.7","0.3","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","[2(E)-1-amino-3-dimethylamino-3-phenylpropen-1-ylidene]pentacarbonyl","","- C16 H14 Cr N2 O5 -","- C16 H14 Cr N2 O5 -","- C64 H56 Cr4 N8 O20 -","4","1","JZ1049","Pohl, E.; Kneisel, B. O.; Herbst-Irmer, R.; de Meijere, A.; Funke, F.; Stein, F.","Three α,β-Unsaturated (Carbene)pentacarbonylchromium Complexes","Acta Crystallographica Section C","1995","51","12","2503","2508","10.1107/S0108270195006160","","","0.71073","MoKα","","0.0639","0.0405","","0.1055","0.092","","","","1.033","1.044","1.044","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004261","10.834","0.002","11.745","0.002","12.222","0.002","108.09","0.02","98.22","0.02","100.11","0.02","1422.6","0.5","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","[2(E)-3-dibenzylamino-1-ethoxy-6,6-dimethylhept-2-ene-4-in-ylidene]","","- C30 H29 Cr N O6 -","- C30 H29 Cr N O6 -","- C60 H58 Cr2 N2 O12 -","2","1","JZ1049","Pohl, E.; Kneisel, B. O.; Herbst-Irmer, R.; de Meijere, A.; Funke, F.; Stein, F.","Three α,β-Unsaturated (Carbene)pentacarbonylchromium Complexes","Acta Crystallographica Section C","1995","51","12","2503","2508","10.1107/S0108270195006160","","","0.71073","MoKα","","0.0358","0.0319","","0.0853","0.0825","","","","1.042","1.062","1.062","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004262","9.95","0.001","18.856","0.004","12.522","0.002","90","","94.3","0.01","90","","2342.7","0.7","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2-oxa-cyclo-pentenylidene)pentacarbonylchromium","","- C25 H21 Cr N O6 -","- C25 H21 Cr N O6 -","- C100 H84 Cr4 N4 O24 -","4","1","JZ1049","Pohl, E.; Kneisel, B. O.; Herbst-Irmer, R.; de Meijere, A.; Funke, F.; Stein, F.","Three α,β-Unsaturated (Carbene)pentacarbonylchromium Complexes","Acta Crystallographica Section C","1995","51","12","2503","2508","10.1107/S0108270195006160","","","0.71073","MoKα","","0.0705","0.0428","","0.1124","0.0897","","","","1.074","1.024","1.024","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004263","10.6502","0.0009","11.0148","0.0004","12.0539","0.0011","97.511","0.006","112.647","0.007","102.092","0.005","1240.56","0.18","298","2","298","","","","","","","","","5","P -1","-P 1","2","","Bis(β-carboxymethylethyl)bis(quinolin-8-olato)tin","","- C26 H26 N2 O6 Sn -","- C26 H26 N2 O6 Sn -","- C52 H52 N4 O12 Sn2 -","2","1","JZ1055","Ng, S. W.; Kumar Das, V. G.","Bis(2-methoxycarbonylethyl)bis(quinolin-8-olato-<i>N</i>,<i>O</i>)tin","Acta Crystallographica Section C","1995","51","12","2492","2494","10.1107/S0108270195007347","","","0.71073","MoKα","","0.04","0.031","","0.0784","0.074","","","","1.068","1.089","1.089","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004264","13.2","0.003","15.0884","0.0013","16.57","0.005","90","","105.869","0.01","90","","3174.4","1.2","298","2","298","","","","","","","","","6","C 1 c 1","C -2yc","9","","bromotriphenyltin.triphenylphosphine oxide","","- C36 H30 Br O P Sn -","- C36 H30 Br O P Sn -","- C144 H120 Br4 O4 P4 Sn4 -","4","1","JZ1056","Ng, S. W.","Bromotriphenyltin‒Triphenylphosphine Oxide (1/1)","Acta Crystallographica Section C","1995","51","12","2563","2565","10.1107/S0108270195007359","","","0.71073","MoKα","","0.0607","0.044","","0.1139","0.1034","","","","1.055","1.06","1.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004265","17.194","0.008","12.293","0.004","18.938","0.009","90","","138.54","0.03","90","","2650","3","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 Cl2 F6 N4 O6 Pd2 -","- C20 H16 Cl2 F6 N4 O6 Pd2 -","- C80 H64 Cl8 F24 N16 O24 Pd8 -","4","1","JZ1060","Mossi, W.; Klaus, A. J.; Rys, P.; Currao, A.; Nesper, R.","Bis(μ-trifluoroacetato-<i>O</i>,<i>O</i>')bis{[3-chloro-6-methyl-2-(<i>N</i>-methyl-<i>N</i>-nitrosoamino)phenyl-<i>C</i>,<i>N</i>^N=O^]palladium(II)}","Acta Crystallographica Section C","1995","51","12","2549","2551","10.1107/S0108270195008559","","","0.71073","MoKα","","0.1099","0.0593","","0.1541","0.1191","","","","1.129","1.129","1.129","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004266","14.615","0.003","14.625","0.003","10.33","0.002","90","","107.67","0.02","90","","2103.8","0.8","112","2","112","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","The Muscarinic Antagonist, 8,8-Dimethyl-3',3'-Diphenyl-spiro[8- azoniabicyclo[3.2.1]octane-3,2'-[1,3]-dioxolane]-4'-one iodide (BVT44Me).","","- C23 H26 I N O3 -","- C23 H26 I N O3 -","- C92 H104 I4 N4 O12 -","4","1","JZ1064","Frydenvang, K.; Castiglione, M.","Muscarinic Antagonist: 8,8-Dimethyl-3',3'-diphenylspiro(8-azoniabicyclo[3.2.1]octane-3,2'-1',3'-dioxolane)-4'-one Iodide","Acta Crystallographica Section C","1995","51","12","2644","2647","10.1107/S0108270195008973","","","1.5418","CuKα","","0.0369","0.0322","","0.0849","0.0811","","","","1.057","1.067","1.067","","","","","has coordinates,has Fobs","288352","2023-12-15","18:37:27",""
"2004267","6.477","0.001","8.386","0.002","9.448","0.001","82.09","0.02","69.62","0.02","82.36","0.02","474.48","0.16","128","5","128","5","","","","","","","","6","P -1","-P 1","2","","Pentacarbonyl(difluoromethyl isocyanide)chromium","","- C7 H Cr F2 N O5 -","- C7 H Cr F2 N O5 -","- C14 H2 Cr2 F4 N2 O10 -","2","1","KA1080","Lentz, D.; Preugschat, D.","Pentacarbonyl(difluoromethyl isocyanide)chromium at 128 K","Acta Crystallographica Section C","1995","51","12","2482","2484","10.1107/S0108270195006536","","","0.71069","MoKα","","0.036","0.0334","","0.106","0.0971","","","","1.091","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004268","12.017","0.001","12.017","0.001","32.942","0.002","90","","90","","120","","4119.8","0.5","293","2","293","2","","","","","","","","5","P 61","P 61","169","","","","- C24 H40 Co N5 O4 -","- C24 H40 Co N5 O4 -","- C144 H240 Co6 N30 O24 -","6","1","KA1115","Giese, B.; Hartung, J.; Lindner, H.-J.; Svoboda, I.; Paulus, H.","The Helical Packing of a Chiral Alkyl Cobaloxime in the Solid State","Acta Crystallographica Section C","1995","51","12","2522","2524","10.1107/S0108270195007189","","","0.71069","MoKα","","0.0674","0.0471","","0.1665","0.1283","","","","1.093","0.941","0.941","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004269","10.64","0.003","10.618","0.004","5.976","0.002","90","","102.86","0.02","90","","658.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","cis-1,5-diamino-2,4,6,8-tetraazabicyclo[3.3.0]octan3,7-dione","","- C4 H8 N6 O2 -","- C4 H8 N6 O2 -","- C16 H32 N24 O8 -","4","1","KA1136","Modric, N.; Poje, M.; Vickovic, I.","<i>cis</i>-1,5-Diamino-2,4,6,8-tetraazabicyclo[3.3.0]octane-3,7-dione","Acta Crystallographica Section C","1995","51","12","2594","2595","10.1107/S0108270195008122","","","1.54178","CuKα","","0.042","0.042","","0.1207","0.1207","","","","1.289","1.291","1.291","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004270","9.305","0.003","25.934","0.004","9.937","0.001","90","","99.02","0.01","90","","2368.3","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-methyl-1,1,4-triphenyl-1,2-dihydronaphthalene-2,3-dicarboximide","","- C31 H23 N O2 -","- C31 H23 N O2 -","- C124 H92 N4 O8 -","4","1","KA1138","Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I.","<i>N</i>-Methyl-1,1,4-triphenyl-1,2-dihydronaphthalene-2,3-dicarboximide","Acta Crystallographica Section C","1995","51","12","2722","2723","10.1107/S0108270195009292","","","0.7107","MoKα","","0.089","0.059","","0.1784","0.1562","","","","0.985","1.058","1.058","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004271","8.83","0.001","11.658","0.002","11.492","0.002","90","","104.25","0.01","90","","1146.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","xanthyletin","8,8-dimethyl-2H,8H-benzo[1,2-b:5,4-b']dipyran-2-one","","- C14 H12 O3 -","- C14 H12 O3 -","- C56 H48 O12 -","4","1","KA1139","Rudiño-Piñera, E.; Juárez-Martínez, G.; Panneerselvam, K.; Soriano-García, M.; Anaya, A. L.; García-Santana, C.; Mata, R.; Sánchez, P.","Xanthyletin","Acta Crystallographica Section C","1995","51","12","2720","2722","10.1107/S0108270195009309","","","1.54178","CuKα","","0.0501","0.044","","0.1259","0.1199","","","","1.129","1.172","1.172","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004272","8.863","0.001","13.429","0.001","15.791","0.001","90","","90","","90","","1879.5","0.3","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H25 N O4 -","- C19 H25 N O4 -","- C76 H100 N4 O16 -","4","1","KA1140","Bolte, M.","Structural Investigation of Dihydrooxazinones","Acta Crystallographica Section C","1995","51","12","2587","2593","10.1107/S0108270195008961","","","0.71069","MoKα","","","0.041","","","0.045","","","","","1.42","1.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004273","8.363","0.001","10.453","0.001","12.27","0.001","90","","94.91","0.01","90","","1068.69","0.19","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H27 N O4 -","- C24 H27 N O4 -","- C48 H54 N2 O8 -","2","1","KA1140","Bolte, M.","Structural Investigation of Dihydrooxazinones","Acta Crystallographica Section C","1995","51","12","2587","2593","10.1107/S0108270195008961","","","0.71069","MoKα","","","0.034","","","0.037","","","","","1.42","1.42","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004274","8.712","0.001","12.848","0.002","17.971","0.002","90","","90.39","0.01","90","","2011.5","0.4","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H31 N O4 -","- C19 H31 N O4 -","- C76 H124 N4 O16 -","4","2","KA1140","Bolte, M.","Structural Investigation of Dihydrooxazinones","Acta Crystallographica Section C","1995","51","12","2587","2593","10.1107/S0108270195008961","","","0.71069","MoKα","","","0.051","","","0.053","","","","","1.402","1.402","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004275","8.228","0.001","15.31","0.002","17.027","0.001","90","","90","","90","","2144.9","0.4","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H31 Cl N2 O3 -","- C19 H31 Cl N2 O4 -","- C76 H124 Cl4 N8 O16 -","4","1","KA1140","Bolte, M.","Structural Investigation of Dihydrooxazinones","Acta Crystallographica Section C","1995","51","12","2587","2593","10.1107/S0108270195008961","","","0.71069","MoKα","","","0.055","","","0.053","","","","","1.361","1.361","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004276","8.039","0.001","11.097","0.001","8.498","0.001","90","","98.92","0.01","90","","748.93","0.15","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H21 N O4 -","- C16 H21 N O4 -","- C32 H42 N2 O8 -","2","1","KA1140","Bolte, M.","Structural Investigation of Dihydrooxazinones","Acta Crystallographica Section C","1995","51","12","2587","2593","10.1107/S0108270195008961","","","0.71069","MoKα","","","0.027","","","0.033","","","","","1.37","1.37","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004277","8.512","0.001","9.375","0.001","10.607","0.001","90","","105.49","0.01","90","","815.69","0.16","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H21 N O4 -","- C16 H21 N O4 -","- C32 H42 N2 O8 -","2","1","KA1140","Bolte, M.","Structural Investigation of Dihydrooxazinones","Acta Crystallographica Section C","1995","51","12","2587","2593","10.1107/S0108270195008961","","","0.71069","MoKα","","","0.046","","","0.042","","","","","1.37","1.37","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004278","16.578","0.003","10.193","0.008","31.574","0.004","90","","100.92","0.01","90","","5239","4","296","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H66 Cr O6 P3 S6 -","- C36 H66 Cr O6 P3 S6 -","- C144 H264 Cr4 O24 P12 S24 -","4","1","KH1031","Xiong, R.-G.; You, X.-Z.; Huang, X.-Y.","Tris(<i>O</i>,<i>O</i>'-dicyclohexyl dithiophosphato-<i>S</i>,<i>S</i>')chromium(III)","Acta Crystallographica Section C","1995","51","12","2484","2486","10.1107/S0108270195007323","","","0.71069","MoKα","","","0.061","","","0.072","","","","","1.49","1.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004279","20.934","0.004","7.636","0.0004","12.966","0.002","90","","100.25","0.008","90","","2039.6","0.5","293","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H18 N4 O8 -","- C20 H18 N4 O8 -","- C80 H72 N16 O32 -","4","0.5","KH1032","Smith, G.; Lynch, D. E.; Byriel, K. A.; Kennard, C. H. L.","Molecular Co-Crystals of Carboxylic Acids. 22. The Adducts of Pyrazine-2,3-dicarboxylic Acid with 2-Aminobenzoic Acid (1:2) and 3-Aminobenzoic Acid (1:1 Dihydrate)","Acta Crystallographica Section C","1995","51","12","2629","2633","10.1107/S0108270195008092","","","0.71073","MoKα","","","0.033","","","0.097","","","","","0.62","0.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004280","7.892","0.001","9.49","0.002","10.115","0.002","91.83","0.001","91.46","0.001","100.35","0.002","744.5","0.2","298","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H15 N3 O8 -","- C13 H15 N3 O8 -","- C26 H30 N6 O16 -","2","1","KH1032","Smith, G.; Lynch, D. E.; Byriel, K. A.; Kennard, C. H. L.","Molecular Co-Crystals of Carboxylic Acids. 22. The Adducts of Pyrazine-2,3-dicarboxylic Acid with 2-Aminobenzoic Acid (1:2) and 3-Aminobenzoic Acid (1:1 Dihydrate)","Acta Crystallographica Section C","1995","51","12","2629","2633","10.1107/S0108270195008092","","","0.71073","MoKα","","","0.046","","","0.119","","","","","1","1","","","","","has coordinates","191094","2020-10-21","18:00:00",""
"2004281","5.558","0.001","5.7557","0.0008","15.656","0.002","90","","92.61","0.01","90","","500.32","0.13","295","","295","","","","","","","","","4","P 1 c 1","P -2yc","7","","(E)-3-[(Methoxycarbonyl)methylene]-1,6-dimethyl-2,6-diazabicyclo [2.2.0]hexan-5-one","","- C9 H12 N2 O3 -","- C9 H12 N2 O3 -","- C18 H24 N4 O6 -","2","1","KH1034","Kakuda, H.; Takahashi, Y.; Hirokami, S.-i.","(<i>E</i>)- and (<i>Z</i>)-Enamine Dewar Pyrimidinones","Acta Crystallographica Section C","1995","51","12","2647","2650","10.1107/S0108270195005841","","","0.7107","MoKα","","","0.035","","","0.049","","","","","1.2","1.2","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2004282","9.076","0.004","9.925","0.003","11.833","0.003","90","","109.61","0.02","90","","1004.1","0.6","294","","294","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","(Z)-3-[(Methoxycarbonyl)methylene]-1,6-dimethyl-2,6-diazabicyclo [2.2.0]hexan-5-one","","- C9 H12 N2 O3 -","- C9 H12 N2 O3 -","- C36 H48 N8 O12 -","4","1","KH1034","Kakuda, H.; Takahashi, Y.; Hirokami, S.-i.","(<i>E</i>)- and (<i>Z</i>)-Enamine Dewar Pyrimidinones","Acta Crystallographica Section C","1995","51","12","2647","2650","10.1107/S0108270195005841","","","0.7107","MoKα","","","0.037","","","0.057","","","","","1.39","1.39","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2004283","12.16","0.005","12.482","0.005","14.755","0.005","68.172","0.005","80.307","0.005","61.792","0.005","1832","1.2","100","","100","","","","","","","","","4","P 1","P 1","1","","1,1,4,4-Tetraphenyl-1,3-butadiene-lithium-tris(dimethoxyethane)","","- C40 H52 Li O6 -","- C40 H52 Li O6 -","- C80 H104 Li2 O12 -","2","2","KH1040","Näther, C.; Bock, H.; Bolte, M.","Tris(1,2-dimethoxyethane)lithium 1,1,4,4-Tetraphenyl-1,3-butadiene Radical Anion","Acta Crystallographica Section C","1995","51","12","2510","2514","10.1107/S0108270195007396","","","0.7106","MoKα","","0.0623","0.0433","","0.1289","0.1198","","","","1.043","1.088","1.088","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004284","33.131","0.003","7.792","0.001","7.256","0.001","90","","90","","90","","1873.2","0.4","293","","293","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","bis(4-nitroanilinium)tetrachlorocadmate","","- C12 H14 Cd Cl4 N4 O4 -","- C12 H14 Cd Cl4 N4 O4 -","- C48 H56 Cd4 Cl16 N16 O16 -","4","0.5","KH1041","Azumi, R.; Honda, K.; Goto, M.; Akimoto, J.; Oosawa, Y.; Tachibana, H.; Nakamura, T.; Tanaka, M.; Matsumoto, M.","Bis(4-nitroanilinium) Tetrachlorocadmate","Acta Crystallographica Section C","1995","51","12","2534","2537","10.1107/S0108270195007384","","","0.7107","MoKα","","","0.028","","","0.034","","","","","2.17","2.17","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004285","14.002","0.003","9.0989","0.0006","15.413","0.004","90","","114.24","0.01","90","","1790.5","0.6","298","2","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C14 H23 N2 O P S3 -","- C14 H23 N2 O P S3 -","- C56 H92 N8 O4 P4 S12 -","4","1","KH1044","Bottle, S. E.; Bott, R. C.; Smith, G.; Wermuth, U. D.; Kennard, C. H. L.","Novel Six- and Eight-Membered Heterocycles. A Trithiadiazaphosphorinane and a Pentathiadiazaphosphocine","Acta Crystallographica Section C","1995","51","12","2633","2637","10.1107/S0108270195009188","","","0.71073","MoKα","","","0.0367","","0.1133","","","","","0.959","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004286","9.836","0.009","14.01","0.01","15.733","0.008","96.89","0.05","91.95","0.05","107.7","0.04","2045","3","298","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C14 H23 N2 O P S5 -","- C14.5 H23 N2 O P S5 -","- C58 H92 N8 O4 P4 S20 -","4","2","KH1044","Bottle, S. E.; Bott, R. C.; Smith, G.; Wermuth, U. D.; Kennard, C. H. L.","Novel Six- and Eight-Membered Heterocycles. A Trithiadiazaphosphorinane and a Pentathiadiazaphosphocine","Acta Crystallographica Section C","1995","51","12","2633","2637","10.1107/S0108270195009188","","","0.71073","MoKα","","","0.0475","","0.1306","","","","","1.045","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004287","19.34","0.04","19.34","0.04","25.688","0.016","90","","90","","120","","8321","2","120","1","120","1","","","","","","","","5","P 63/m","-P 6c","176","Terbium(III)cerium(IV)hydrogen sulphate hydrate","","","- Ce6 H153.66 O180.45 S27 Tb7 -","- Ce6 O181.72 S27 Tb7 -","- Ce12 O363.44 S54 Tb14 -","2","0.166667","LI1136","Barnes, J. C.","An Acid Terbium(III) Cerium(IV) Sulfate Hydrate, H~9~Tb~7~Ce~6~(SO~4~)~27~.72.2H~2~O","Acta Crystallographica Section C","1995","51","12","2466","2469","10.1107/S0108270195009267","","","0.71069","MoKα","","0.0953","0.0692","","0.1874","0.1631","","","","1.02","1.101","1.101","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004288","23.382","0.006","10.16","0.003","11.265","0.005","90","","92.78","0.03","90","","2673","1.6","296","","296","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[4-chloro-3-(2-nitrophenylthio)butyl]triphenylstannane","","- C28 H26 Cl N O2 S Sn -","- C28 H26 Cl N O2 S Sn -","- C112 H104 Cl4 N4 O8 S4 Sn4 -","4","1","MU1188","Aupers, J. H.; Wardell, J. L.","[4-Chloro-3-(2-nitrophenylthio)butyl]triphenylstannane","Acta Crystallographica Section C","1995","51","12","2559","2561","10.1107/S0108270195008110","","","0.71073","MoKα","","","0.035","","","0.042","","","","","0.934","0.934","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004289","15.401","0.007","18.228","0.011","5.857","0.003","90","","90","","90","","1644.2","1.5","193","2","193","2","","","","","","","","6","P n a 21","P 2c -2n","33","(Theophyllinato-N^7^)(dimethylphenylphosphine)gold(I)","(3,7-Dihydro-1,3-dimethyl-1H-purine-2,6-dionato-N^7^)- (dimethylphenylphosphine)gold(I)","","- C15 H18 Au N4 O2 P -","- C15 H18 Au N4 O2 P -","- C60 H72 Au4 N16 O8 P4 -","4","1","MU1194","Pajunen, A.; Kivekäs, R.; Colacio, E.; Cuesta, R.","(1,3-Dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1<i>H</i>-purin-7-yl)(dimethylphenylphosphine)gold(I)","Acta Crystallographica Section C","1995","51","12","2551","2554","10.1107/S0108270195008109","","","0.71073","MoKα","","0.0375","0.0351","","0.0849","0.0833","","","","1.12","1.131","1.131","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004290","9.561","0.002","16.723","0.004","10.536","0.003","90","","115.87","0.02","90","","1515.8","0.7","178","2","178","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H44 Mo2 N2 O4 -","- C30 H44 Mo2 N2 O4 -","- C60 H88 Mo4 N4 O8 -","2","0.5","NA1159","Stammler, H.-G.; Jutzi, P.; Neumann, B.; Kristen, M. O.","Non-Coordination of the Dimethylamino Group in a Dinuclear Molybdenum Complex with the 1-[2-(Dimethylamino)ethyl]-2,3,4,5-tetramethylcyclopentadienyl Ligand","Acta Crystallographica Section C","1995","51","12","2496","2498","10.1107/S0108270195006822","","","0.71073","MoKα","","0.1282","0.0628","","0.222","0.1482","","","","1.009","1.028","1.028","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004291","9.184","0.002","14.793","0.001","10.495","0.002","90","","97.22","0.01","90","","1414.5","0.4","293","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H26 Cl4 N10 O4 Sn -","- C18 H26 Cl4 N10 O4 Sn -","- C36 H52 Cl8 N20 O8 Sn2 -","2","0.5","NA1160","Casas, J. S.; Castiñeiras, A.; Martínez, G.; Sordo, J.; Varela, J. M.; Couce, M. D.","Bis(1,1'-dimethyl-5-nitro-2,2'-biimidazol-3'-ium) <i>trans</i>-Tetrachlorodimethylstannate","Acta Crystallographica Section C","1995","51","12","2561","2563","10.1107/S0108270195005051","","","0.71073","MoKα","","","0.038","","","0.042","","","","","1.506","1.506","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004292","12.785","0.005","9.265","0.004","12.881","0.004","90","","97.39","0.03","90","","1513.1","1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H22 N O4 Rh -","- C15 H22 N O4 Rh -","- C60 H88 N4 O16 Rh4 -","4","1","NA1162","Stammler, H.-G.; Jutzi, P.; Neumann, B.; Kristen, M. O.; Hölscher, H.","Intramolecular Coordination of the Dimethylamino Group in a Rhodium‒Oxalate Complex with the 1-[2-(Dimethylamino)ethyl]-2,3,4,5-tetramethylcyclopentadienyl Ligand","Acta Crystallographica Section C","1995","51","12","2494","2496","10.1107/S0108270195006871","","","0.71073","MoKα","","0.1236","0.0605","","0.1694","0.1147","","","","1.126","1.181","1.181","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004293","11.772","0.005","9.346","0.003","17.186","0.008","90","0.03","91.7","0.04","90","0.03","1890","1.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N-(2-hydroxyethyl)N-dihydroxyethylammonium 2-(2,6-dichlorophenylamino)phenylacetate","","- C18 H22 Cl2 N2 O4 -","- C18 H22 Cl2 N2 O4 -","- C72 H88 Cl8 N8 O16 -","4","1","NA1170","Castellari, C.; Ottani, S.","Anti-Inflammatory Drugs. II. Salt of 2-(2,6-Dichlorophenylamino)phenylacetic Acid with Diethanolamine","Acta Crystallographica Section C","1995","51","12","2612","2615","10.1107/S010827019500730X","","","0.71069","MoKα","","0.1163","0.0344","","0.0998","0.0773","","","","1.006","1.125","1.125","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004294","44.117","0.009","10.65","0.002","18.898","0.004","90","","92.16","0.03","90","","8873","3","293","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C49.5 H51 Cl3 N P3 Ru -","- C49 H50 Cl3.5 Cs N P3 Ru -","- C392 H400 Cl28 Cs8 N8 P24 Ru8 -","8","1","NA1178","Bianchini, C.; Masi, D.; Peruzzini, M.; Romerosa, A.; Zanobini, F.","<i>mer</i>,<i>trans</i>-[Bis(2-diphenylphosphinoethyl)(<i>n</i>-propyl)amine-<i>N</i>,<i>P</i>,<i>P</i>']dichloro(triphenylphosphine)ruthenium(II) 0.5-Dichloromethane Solvate","Acta Crystallographica Section C","1995","51","12","2514","2517","10.1107/S0108270195007591","","","1.54184","CuKα","","","0.0339","","","0.0999","","","","","1.202","1.202","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004295","15.515","0.001","15.515","0.001","8.851","0.001","90","","90","","90","","2130.6","0.3","298","","","","","","","","","","","3","I -4","I -4","82","","","","- C13 H18 O -","- C13 H18 O -","- C104 H144 O8 -","8","1","NA1181","Bohnen, F. M.; Maier, W. F.; Krüger, C.","Tricyclo[8.2.1.0^2,9^]trideca-5,11-dien-3-ol","Acta Crystallographica Section C","1995","51","12","2639","2641","10.1107/S0108270195009590","","","0.71069","MoKα","","","0.034","","","0.102","","","","","0.82","0.82","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004296","9.597","0.004","11.288","0.004","11.984","0.004","92.28","0.03","109.58","0.03","99.1","0.03","1201.7","0.8","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H54 Cu2 N2 O14 -","- C50 H54 Cu2 N2 O14 -","- C50 H54 Cu2 N2 O14 -","1","0.5","NA1186","Turpeinen, U.; Hämäläinen, R.; Mutikainen, I.","Bis[(2-hydroxyethyl)dimethylammonium] Tetrakis(μ-benzoato-<i>O</i>:<i>O</i>')bis[(benzoato-<i>O</i>)cuprate(II)]","Acta Crystallographica Section C","1995","51","12","2544","2546","10.1107/S0108270195007682","","","0.71069","MoKα","","","0.048","","","0.0552","","","","","1.18","1.18","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004297","30.403","0.001","8.13","0.001","10.354","0.002","90","","101.889","0.001","90","","2504.4","0.6","295","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H11 Cl2 N -","- C14 H11 Cl2 N -","- C112 H88 Cl16 N8 -","8","1","NA1187","Ülkü, D.; Tahir, M. N.; Menzek, A.; Balcı, M.","Unusual Chlorination During an Epoxidation Reaction of an Ethenocyclopropa[<i>b</i>]naphthalene Derivative","Acta Crystallographica Section C","1995","51","12","2714","2715","10.1107/S0108270195009383","","","0.71073","MoKα","","","0.056","","","0.05","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004298","7.213","0.002","9.102","0.003","10.08","0.004","80.49","0.03","86.85","0.03","74.32","0.02","628.4","0.4","150","0.2","150","0.2","","","","","","","","4","P -1","-P 1","2","[15]aneS2O3","1,4,7-trioxa-10,13-dithiacyclopentdecane","","- C10 H20 O3 S2 -","- C10 H20 O3 S2 -","- C20 H40 O6 S4 -","2","1","NA1189","Blake, A. J.; Radek, C.; Schröder, M.","Redetermination of the Structures of 1,4,7-Trioxa-10,13-dithiacyclopentadecane and 1,4,7,10-Tetraoxa-13,16-dithiacyclooctadecane","Acta Crystallographica Section C","1995","51","12","2668","2671","10.1107/S0108270195008079","","","0.71073","MoKα","","0.0284","0.0248","","0.0666","0.0622","","","","1.037","1.032","1.032","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004299","15.9074","0.0012","9.5181","0.0008","12.5255","0.001","90","","124.351","0.004","90","","1565.7","0.2","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","[18]aneS2O4","1,4,7,10-Tetraoxa-13,16-dithiacyclooctadecane","","- C12 H24 O4 S2 -","- C12 H24 O4 S2 -","- C48 H96 O16 S8 -","4","0.5","NA1189","Blake, A. J.; Radek, C.; Schröder, M.","Redetermination of the Structures of 1,4,7-Trioxa-10,13-dithiacyclopentadecane and 1,4,7,10-Tetraoxa-13,16-dithiacyclooctadecane","Acta Crystallographica Section C","1995","51","12","2668","2671","10.1107/S0108270195008079","","","0.71073","MoKα","","0.0535","0.0386","","0.1194","0.1058","","","","1.03","1.06","1.06","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2004300","4.848","0.003","11.79","0.007","12.159","0.005","72.06","0.02","84.77","0.03","84.19","0.04","656.5","0.6","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","4-n-heptylbenzoic acid","","- C14 H20 O2 -","- C14 H20 O2 -","- C28 H40 O4 -","2","1","NA1190","Blake, A. J.; Fallis, I. A.; Parsons, S.; Schröder, M.; Bruce, D. W.","4-<i>n</i>-Heptylbenzoic Acid","Acta Crystallographica Section C","1995","51","12","2666","2668","10.1107/S0108270195007876","","","0.71073","MoKα","","0.2441","0.0672","","0.161","0.1057","","","","0.961","1.245","1.245","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004301","9.292","0.002","10.139","0.002","10.095","0.002","90","","91.59","0.03","90","","950.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Trans-1-cyano-2-phenylcyclopropanecarboxamide","","- C11 H10 N2 O -","- C11 H10 N2 O -","- C44 H40 N8 O4 -","4","1","NA1194","Cativiela, C.; Díaz-de-Villegas, M. D.; Gálvez, J. A.; López, M. P.","<i>trans</i>-1-Cyano-2-phenylcyclopropanecarboxamide","Acta Crystallographica Section C","1995","51","12","2703","2705","10.1107/S010827019500936X","","","0.71073","MoKα","","0.0713","0.0435","","0.1171","0.1005","","","","1.071","1.109","1.109","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004302","9.816","0.001","12.422","0.001","15.234","0.001","90","","90","","90","","1857.5","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","mutilin","[3aS-(3aα,4β,5α,6α,8β,9α,9αβ,10S*]-6-ethenyloctahydro-5,8- dihydroxy- 4,6,9,10-tetramethyl-3a,9-propano-3aH-cyclopentacycloocten-1(4H)-one","","- C20 H32 O3 -","- C20 H32 O3 -","- C80 H128 O12 -","4","1","NA1195","Pilati, T.; Cravotto, G.; Palmisano, G.","Absolute Configuration of Mutilin, 5-Acetylmutilin and 5-Bromoacetylmutilin","Acta Crystallographica Section C","1995","51","12","2676","2680","10.1107/S0108270195008602","","","0.71073","MoKα","","0.0714","0.0463","","0.1166","0.1043","","","","1.032","1.088","1.088","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004303","7.063","0.001","15.863","0.002","18.027","0.003","90","","90","","90","","2019.8","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","5-acetylmutilin","[3aS-(3aα,4β,5α,6α,8β,9α,9αβ,10S*]-5-acetate-6-ethenyloctahydro-5,8- dihydroxy-4,6,9,10-tetramethyl-3a,9-propano-3aH-cyclopentacycloocten-1(4H)-one","","- C22 H34 O4 -","- C22 H34 O4 -","- C88 H136 O16 -","4","1","NA1195","Pilati, T.; Cravotto, G.; Palmisano, G.","Absolute Configuration of Mutilin, 5-Acetylmutilin and 5-Bromoacetylmutilin","Acta Crystallographica Section C","1995","51","12","2676","2680","10.1107/S0108270195008602","","","0.71073","MoKα","","0.0696","0.0448","","0.0994","0.0887","","","","1.067","1.109","1.109","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004304","9.32","0.001","11.251","0.001","10.671","0.001","90","","109.266","0.008","90","","1056.29","0.18","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","5-bromoacetilmutilin","S-(3aα,4β,5α,6α,8β,9α,9αβ,10S*]-5-bromoacetate-6-ethenyloctahydro-5,8- dihydroxy-4,6,9,10-tetramethyl-3a,9-propano-3aH-cyclopentacycloocten-1(4H)-one","","- C22 H33 Br O4 -","- C22 H33 Br O4 -","- C44 H66 Br2 O8 -","2","1","NA1195","Pilati, T.; Cravotto, G.; Palmisano, G.","Absolute Configuration of Mutilin, 5-Acetylmutilin and 5-Bromoacetylmutilin","Acta Crystallographica Section C","1995","51","12","2676","2680","10.1107/S0108270195008602","","","0.71073","MoKα","","","0.0444","","0.0912","0.0776","","","","","1.074","1.074","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004305","16.208","0.002","16.208","0.002","5.8","0.002","90","","90","","90","","1523.7","0.6","292","","292","","","","","","","","","7","P -4 21 m","P -4 2ab","113","","PB(REO4)2.THIOUREA","","- C2 H12 N4 O26 Pb3 Re6 S2 -","- C2 H12 N4 O26 Pb3 Re6 S2 -","- C4 H24 N8 O52 Pb6 Re12 S4 -","2","0.25","NS1002","Macícek, J.; Angelova, O.","Molecular Adducts of Inorganic Salts. III. Non-Centrosymmetric 3Pb(ReO~4~)~2~.2tu.2H~2~O (tu = Thiourea)","Acta Crystallographica Section C","1995","51","12","2539","2542","10.1107/S0108270195004653","","","0.71073","MoKα","","0.073","0.041","","0.132","0.049","","","","1.946","0.736","0.736","","","","","has coordinates","191094","2020-10-21","18:00:00",""
"2004307","7.711","0.002","12.728","0.003","13.728","0.003","90","","90","","90","","1347.3","0.6","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H24 O -","- C15 H24 O -","- C60 H96 O4 -","4","1","PA1169","Benharref, A.; El Jamili, H.; Lassaba, E.; Giorgi, M.; Pierrot, M.","2β,3β-Epoxy-α-<i>trans</i>-himachalene and 2β,3β,11α,15α-Diepoxy-<i>trans</i>-himachalane Derivatives","Acta Crystallographica Section C","1995","51","12","2658","2661","10.1107/S0108270195009024","","","0.71073","MoKα","","","0.05","","","0.073","","","","","2.25","2.25","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004308","7.711","0.001","12.562","0.002","13.989","0.002","90","","90","","90","","1355.1","0.3","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H24 O2 -","- C15 H24 O2 -","- C60 H96 O8 -","4","1","PA1169","Benharref, A.; El Jamili, H.; Lassaba, E.; Giorgi, M.; Pierrot, M.","2β,3β-Epoxy-α-<i>trans</i>-himachalene and 2β,3β,11α,15α-Diepoxy-<i>trans</i>-himachalane Derivatives","Acta Crystallographica Section C","1995","51","12","2658","2661","10.1107/S0108270195009024","","","0.71073","MoKα","","","0.05","","","0.05","","","","","0.712","0.712","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004309","11.933","0.002","7.322","0.001","15.551","0.005","90","","92.01","0.03","90","","1357.9","0.5","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C64 H68 N4 O8 -","4","1","PA1175","Tenon, J. A.; Carles, M.; Aycard, J.-P.","<i>N</i>-(5-Hydroxysalicylidène)-2,4,6-triméthylaniline","Acta Crystallographica Section C","1995","51","12","2603","2606","10.1107/S0108270195007967","","","0.71073","MoKα","","","0.041","","","0.041","","","","","0.73","0.73","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004310","12.582","0.002","12.582","0.002","3.937","0.002","90","","90","","90","","623.3","0.3","293","","","","","","","","","","","5","P 4/m b m","-P 4 2ab","127","","","","- F4 K3 Nb3 O11 Ti2 -","- F K3 O2 Of12 St5 -","- F2 K6 O4 Of24 St10 -","2","0.125","PA1178","Ladjeroud, Z.; Balegroune, F.; Guehria, A.; Benziada, L.; Triki, S.","K~3~Nb~3~Ti~2~O~11~F~4~","Acta Crystallographica Section C","1995","51","12","2459","2461","10.1107/S0108270195007980","","","0.71073","MoKα","","","0.047","","","0.072","","","","","2.136","2.136","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004311","8.79","0.002","8.79","0.002","24.831","0.005","90","","90","","120","","1661.5","0.6","295","","","","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C10 H18 Br4 N8 S2 Zn -","- C10 H18 Br4 N8 S2 Zn -","- C30 H54 Br12 N24 S6 Zn3 -","3","0.5","PA1185","Salas, J. M.; Romero, M. A.; Faure, R.","Bis(4,6-diamino-2-methylthiopyrimidinium) Tetrabromozincate(II)","Acta Crystallographica Section C","1995","51","12","2532","2534","10.1107/S0108270195007992","","","0.7107","MoKα","","","0.075","","","0.088","","","","","4.7","4.7","","","","","has coordinates","199682","2020-10-21","18:00:00",""
"2004312","5.175","0.001","11.172","0.002","14.057","0.002","82.46","0.01","81.7","0.02","77.03","0.02","779.6","0.2","292","","","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H12 Br F N2 O2 -","- C17 H12 Br F N2 O2 -","- C34 H24 Br2 F2 N4 O4 -","2","1","PT1003","De Simone, C. A.; Zukerman-Schpector, J.; Pereira, M. A.; Cuong, L.-D.; Pitta, I. R.; Galdino, S. L.; Cavalcanti De Amorim, E. L.","3-(4-Bromobenzyl)-5-(4-fluorobenzylidene)imidazolidine-2,4-dione","Acta Crystallographica Section C","1995","51","12","2620","2621","10.1107/S0108270195006639","","","0.71073","MoKα","","","0.058","","","0.062","","","","","1.65","1.65","","","","","has coordinates","198483","2020-10-21","18:00:00",""
"2004313","9.625","0.002","5.805","0.001","12.665","0.003","90","","109.63","0.05","90","","666.5","0.3","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H15 N O2 -","- C18 H15 N O2 -","- C36 H30 N2 O4 -","2","1","PT1011","Seetharaman, J.; Rajan, S. S.","8,9-Dimethoxybenzo[<i>b</i>]carbazole","Acta Crystallographica Section C","1995","51","12","2568","2570","10.1107/S0108270195006627","","","1.54184","CuKα","","","0.056","","","0.063","","","","","1.01","1.01","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004314","6.226","0.0016","14.3627","0.0015","14.551","0.002","90","","92.783","0.017","90","","1299.6","0.4","123","","123","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[2-(3,4-dichlorophenyl)vinyl]benzothiazole","","- C15 H9 Cl2 N S -","- C15 H9 Cl2 N S -","- C60 H36 Cl8 N4 S4 -","4","1","PT1025","Yang, J.; Kumar, P.; Dimmock, J. R.; Quail, J. W.","2-[2-(3,4-Dichlorophenyl)vinyl]benzo[<i>d</i>]thiazole","Acta Crystallographica Section C","1995","51","12","2700","2702","10.1107/S0108270195008626","","","0.7093","MolybdenumKα","","0.082","0.049","","0.05","0.049","","","","","1.26","1.26","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004315","10.55","0.001","9.071","0.002","15.146","0.002","90","","103.37","0.01","90","","1410.2","0.4","213","","213","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C13 H15 Cl N2 O2 S -","- C13 H15 Cl N2 O2 S -","- C52 H60 Cl4 N8 O8 S4 -","4","1","PT1026","Chai, C. L. L.; Hockless, D. C. R.","<i>trans</i>-3-(<i>p</i>-Chlorophenylthio)-1,4,6-trimethylpiperazine-2,5-dione","Acta Crystallographica Section C","1995","51","12","2579","2581","10.1107/S0108270195007219","","","1.5418","CuKα","","0.0397","0.036","","0.0417","0.041","","","","","2.99","2.99","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004316","6.574","0.001","16.083","0.003","18.257","0.003","90","","90","","90","","1930.3","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C22 H29 N3 -","- C22 H29 N3 -","- C88 H116 N12 -","4","1","SX1000","Wolska, I.; Borowiak, T.","2-Cyano-2-phenylsparteine","Acta Crystallographica Section C","1995","51","12","2716","2718","10.1107/S0108270195007931","","","1.54178","CuKα","","0.0728","0.047","","0.1229","0.1229","","","","1.056","1.1","1.1","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004317","9.253","0.002","12.558","0.002","15.862","0.008","90","","90","","90","","1843.2","1.1","298","1","298","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Azido-N,N-diphenylcarbamoyl proline methyl ester","","- C19 H19 N5 O3 -","- C19 H19 N5 O3 -","- C76 H76 N20 O12 -","4","1","SZ1008","Lynch, V. M.; Hulme, C.; Magnus, P.; Davis, B. E.","Novel 2- and 5-Azido-<i>N</i>-(diphenylcarbamoyl)proline Methyl Esters. Examples of a Novel Proline Oxidation","Acta Crystallographica Section C","1995","51","12","2598","2601","10.1107/S0108270195010237","","","0.71073","MoKα","","0.151","0.0737","","0.0788","0.0632","","","","","1.508","1.508","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2004318","8.379","0.003","13.183","0.008","16.294","0.007","90","","90","","90","","1799.8","1.5","173","1","173","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","cis-5-Azido-N,N-diphenylcarbamoyl proline methyl ester","","- C19 H19 N5 O3 -","- C19 H19 N5 O3 -","- C76 H76 N20 O12 -","4","1","SZ1008","Lynch, V. M.; Hulme, C.; Magnus, P.; Davis, B. E.","Novel 2- and 5-Azido-<i>N</i>-(diphenylcarbamoyl)proline Methyl Esters. Examples of a Novel Proline Oxidation","Acta Crystallographica Section C","1995","51","12","2598","2601","10.1107/S0108270195010237","","","0.71073","MoKα","","0.0479","0.0385","","0.0433","0.0411","","","","","1.285","1.285","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2004319","10.458","0.002","16.969","0.003","9.739","0.002","90","","104.93","0.03","90","","1670","0.6","298","","298","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","8,16-Methano-16H-dinaphtho[2,1-d:1',2'-g][1,3]dioxocin-2,14-diol","","- C23 H16 O4 -","- C23 H16 O4 -","- C92 H64 O16 -","4","1","SZ1012","Klei, H. E.; Callegari, E.; Edwards, J. M.; Kelly, J. A.","8,16-Methano-16<i>H</i>-dinaphtho[2,1-<i>d</i>:1',2'-<i>g</i>][1,3]dioxocine-2,14-diol","Acta Crystallographica Section C","1995","51","12","2621","2624","10.1107/S0108270195003520","","","1.5418","CuKα","","0.0751","0.0561","","0.0796","0.073","","","","","1.25","1.25","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004320","12.391","0.005","17.316","0.004","21.908","0.007","90","","95.92","0.02","90","","4676","3","300","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 N O2 S2 Sn -","- C24.5 H23 N1.5 O2 S3 Sn -","- C196 H184 N12 O16 S24 Sn8 -","8","2","TA1019","Ng, S. W.; Kumar Das, V. G.","(<i>N</i>,<i>N</i>-Dimethylthiocarbamoylthioacetato)triphenyltin","Acta Crystallographica Section C","1995","51","12","2489","2491","10.1107/S0108270194014575","","","0.71073","MoKα","","","0.05","","","0.055","","","","","0.446","0.446","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004321","5.487","0.003","10.51","0.004","17.796","0.009","100.61","0.04","96.03","0.04","97.23","0.04","992","0.9","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H12 Br2 S5 -","- C17 H12 Br2 S5 -","- C34 H24 Br4 S10 -","2","1","TA1027","Yu, W.-T.; Qi, F.; Hong, L.","4,5-Bis(4-bromobenzylthio)-1,3-dithiole-2-thione","Acta Crystallographica Section C","1995","51","12","2606","2608","10.1107/S0108270195007906","","","0.71073","MoKα","","","0.076","","","0.074","","","","","1.358","1.358","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004322","11.119","0.001","6.368","0.001","5.582","0.001","101.6","0.01","90.43","0.01","102.4","0.01","377.6","0.1","292","1","293","2","","","","","","","","5","P -1","-P 1","2","","Tetrahydro-6-methyl-1H-thieno[3,4-b]pyrrol-2(3H)-one","","- C7 H11 N O S -","- C7 H11 N O S -","- C14 H22 N2 O2 S2 -","2","1","TA1030","Mackay, M. F.; Henderson, S. A.; Savage, G. P.","Tetrahydro-6-methyl-1<i>H</i>,3<i>H</i>-thieno[3,4-<i>b</i>]pyrrol-2-one, an Analogue of Biotin","Acta Crystallographica Section C","1995","51","12","2673","2674","10.1107/S0108270195008912","","","1.5418","CuKα","","","0.047","","","0.066","","","","","3.01","3.01","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004323","19.362","0.016","5.128","0.006","8.159","0.006","90","","100.11","0.06","90","","797.5","1.3","193","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H9 B O2 -","- C8 H9 B O2 -","- C32 H36 B4 O8 -","4","1","TA1036","Gainsford, G. J.; Meinhold, R. H.; Woolhouse, A. D.","Styrylboronic Acid","Acta Crystallographica Section C","1995","51","12","2694","2696","10.1107/S010827019500919X","","","0.71073","MoKα","","","0.055","","","0.055","","","","","1.36","1.36","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004324","8.281","0.002","12.084","0.003","14.491","0.005","90","","90","","90","","1450.1","0.7","130","2","130","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","methyl (S)-2-benzoyloxy-4-bromo-4-methylpentanoate","","- C14 H17 Br O4 -","- C14 H17 Br O4 -","- C56 H68 Br4 O16 -","4","1","TA1037","Shaw, J. P.; Tan, E. W.; Blackman, A. G.","Homochiral Methyl (<i>S</i>)-2-Benzoyloxy-4-bromo-4-methylpentanoate","Acta Crystallographica Section C","1995","51","12","2583","2584","10.1107/S0108270195008444","","","0.71073","MoKα","","0.0569","0.0418","","0.093","0.0874","","","","1.054","1.076","1.076","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004325","10.001","0.001","20.603","0.002","8.601","0.001","90","","90","","90","","1772.2","0.3","298","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H23 N O2 -","- C22 H23 N O2 -","- C88 H92 N4 O8 -","4","1","VJ1020","Thiruvalluvar, A.; Sankar Raja Raj, K.; Krishna Pillay, M.; Venkatasubramanian, K.","<i>N</i>-Benzoyl-2-phenyldecahydroquinolin-4-one, C~22~H~23~NO~2~","Acta Crystallographica Section C","1995","51","12","2641","2643","10.1107/S0108270195003702","","","1.5418","CuKα","","","0.037","","","0.038","","","","","1.18","1.18","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004326","15.185","0.002","9.81","0.001","12.823","0.002","90","","100.89","0.02","90","","1875.8","0.4","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 Cl N3 O3 -","- C18 H24 Cl N3 O3 -","- C72 H96 Cl4 N12 O12 -","4","1","VJ1025","Chandra Mohan, K.; Ravikumar, K.","Ondansetron Hydrochloride: a Competitive Serotonin 5-HT~3~ Receptor Blocker","Acta Crystallographica Section C","1995","51","12","2627","2629","10.1107/S0108270195008043","","","0.71073","MoKα","","","0.051","","","0.062","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004327","7.341","0.001","14.518","0.003","8.01","0.002","90","","94.01","0.03","90","","851.6","0.3","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C6 H12 N2 S2 -","- C6 H12 N2 S2 -","- C24 H48 N8 S8 -","4","0.5","VS1009","Shishkin, O. V.; Kolos, N. N.; Orlov, V. D.; Kuznetsov, V. P.; Lakin, E. E.","<i>o</i>-Phenylenediammonium Bis(hydrogensulfide)","Acta Crystallographica Section C","1995","51","12","2643","2644","10.1107/S0108270195006846","","","0.71073","MoKα","","","0.037","","","0.043","","","","","1.73","1.73","","","","","has coordinates","198476","2020-10-21","18:00:00",""
"2004328","5.558","0.002","8.776","0.003","25.153","0.007","90","","95.46","0.02","90","","1221.3","0.7","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H28 N4 O6 -","- C25 H28 N4 O6 -","- C50 H56 N8 O12 -","2","1","VS1017","Mishnev, A. F.; Kemme, A. A.; Ancans, J. J.","<i>N</i>^{α^}-<i>tert</i>-Butoxycarbonyl-<i>N</i>^{τ^}-benzylhistidine <i>p</i>-Nitrobenzyl Ester","Acta Crystallographica Section C","1995","51","12","2601","2603","10.1107/S0108270195006834","","","0.71073","MoKα","","","0.049","","","0.049","","","","","0.988","0.988","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004329","5.311","0.001","9.495","0.001","11.442","0.002","94.13","0.02","93.79","0.02","93.6","0.02","572.92","0.16","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H10 N2 O3 -","- C13 H10 N2 O3 -","- C26 H20 N4 O6 -","2","1","AB1126","Pomés Hernández, R.; Duque Rodríguez, J.; Novoa de Armas, H.; Toscano, R. A.","2-Cyano-<i>N</i>-furfuryl-3-(2-furyl)acrylamide","Acta Crystallographica Section C","1996","52","1","203","205","10.1107/S0108270195008560","","","0.71069","MoKα","","","0.041","","","0.039","","","","","1.17","1.17","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004330","12.981","0.005","14.021","0.004","12.356","0.006","109.81","0.04","117.51","0.03","90.36","0.04","1840.5","1.6","296","","","","","","","","","","","7","P -1","-P 1","2","","","","- C48 H80 Cr Fe Mo6 Na2 O40 -","- C48 Co2 Mo6 Na2 O40 -","- C48 Co2 Mo6 Na2 O40 -","1","0.5","AB1128","Liu, H.; Xu, L.; Huang, J.; Chen, W.; Zhang, Q.","A Novel Octanuclear Mixed-Metal Cluster: Na~2~[Cr~0.5~Fe~0.5~Mo~3~O~4~(O~2~CEt)~8~]~2~","Acta Crystallographica Section C","1996","52","1","69","72","10.1107/S0108270195002927","","","0.71076","MoKα","","","0.056","","","0.064","","","","","1.09","1.09","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004331","8.653","0.002","20.225","0.004","14.724","0.003","90","","90","","90","","2576.8","0.9","293","2","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C14 H9 Cl2 N O4 -","- C14 H9 Cl2 N O4 -","- C112 H72 Cl16 N8 O32 -","8","1","AB1148","Novoa de Armas, H.; Pomés Hernández, R.; Duque Rodríguez, J.; Toscano, R. A.","4,4'-Dichloro-2,2'-iminodibenzoic Acid","Acta Crystallographica Section C","1996","52","1","166","168","10.1107/S0108270195008572","","","1.54178","CuKα","","","0.056","","","0.0747","","","","","1.68","1.68","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004332","9.929","0.002","8.75","0.002","11.23","0.002","90","","107.21","0.02","90","","932","0.3","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(4'S)-2-(Benzyl-oxazolidine-2'-one-3'carbonyl)-3-phenylacrylic acid methyl ester","","- C21 H19 N O5 -","- C21 H19 N O5 -","- C42 H38 N2 O10 -","2","1","AB1277","Pohl, E.; Schünke, C.; Tietze, L. F.","(2<i>E</i>,4'<i>S</i>)-2-(4'-Benzyl-2'-oxo-3'-oxazolidinylcarbonyl)-3-phenylacrylic Acid Methyl Ester","Acta Crystallographica Section C","1996","52","1","246","248","10.1107/S0108270195010730","","","0.71073","MoKα","","0.0298","0.0287","","0.0704","0.0693","","","","1.058","1.058","1.058","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004333","12.799","0.005","12.969","0.009","7.885","0.004","90","","99.01","0.04","90","","1292.7","1.2","293","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C8 H26 N6 O20 U2 -","- C12 H40 N8 O20 U2 -","- C24 H80 N16 O40 U4 -","2","0.25","AB1283","Hämäläinen, R.; Turpeinen, U.; Mutikainen, I.","Di-μ-aqua-bis[bis(nitrato-<i>O</i>,<i>O</i>')dioxouranium(VI)] Bis(2-dimethylaminoethanol)","Acta Crystallographica Section C","1996","52","1","16","17","10.1107/S0108270195009255","","","0.71069","MoKα","","","0.057","","","0.062","","","","","2.04","2.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004334","12.848","0.004","6.356","0.003","12.391","0.004","90","","113.48","0.05","90","","928.1","0.7","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H13 N S2 -","- C7 H13 N S2 -","- C28 H52 N4 S8 -","4","1","AB1284","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","5-<i>tert</i>-Butylthiazolidine-2-thione and 5-Phenylthiazolidine-2-thione","Acta Crystallographica Section C","1996","52","1","215","218","10.1107/S0108270195010699","","","0.71073","MoKα","","","0.05","","","0.0486","","","","","0.91","0.91","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004335","10.48","0.003","8.926","0.003","19.503","0.006","90","","90","","90","","1824.4","1","293","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C9 H9 N S2 -","- C9 H9 N S2 -","- C72 H72 N8 S16 -","8","1","AB1284","Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.","5-<i>tert</i>-Butylthiazolidine-2-thione and 5-Phenylthiazolidine-2-thione","Acta Crystallographica Section C","1996","52","1","215","218","10.1107/S0108270195010699","","","0.71073","MoKα","","","0.038","","","0.04","","","","","1.223","1.223","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004336","18.028","0.002","18.173","0.003","18.856","0.003","90","","113.985","0.011","90","","5644.2","1.5","294","1","294","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Racemic cis-dichlorobis(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium(IV)","","- C22 H38 Cl2 O4 Ti -","- C22 H38 Cl2 O4 Ti -","- C176 H304 Cl16 O32 Ti8 -","8","2","AB1297","Glidewell, C.; Turner, G. M.; Ferguson, G.","Racemic <i>cis</i>-Dichlorobis(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium(IV)","Acta Crystallographica Section C","1996","52","1","11","14","10.1107/S0108270195012224","","","0.7107","MolybdenumKα","","0.2081","0.065","","0.2157","0.1796","","","","0.884","1.376","1.376","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004337","8.7777","0.0007","16.8264","0.0018","11.3773","0.0009","90","","93.077","0.007","90","","1678","0.3","294","1","294","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Dimethylamino-2-methoxy-3-methyl-6-[1,2-(Z)-dicarbomethoxyvinyl]amino pyrimidin-4-(3H)-one","","- C14 H20 N4 O6 -","- C14 H20 N4 O6 -","- C56 H80 N16 O24 -","4","1","AB1307","Low, J. N.; Ferguson, G.; Cobo, J.; Nogueras, M.; Sánchez, A.","6-[1,2-(<i>Z</i>)-Bis(methoxycarbonyl)vinyl]amino-5-dimethylamino-2-methoxy-3-methyl-4(3<i>H</i>)-pyrimidinone","Acta Crystallographica Section C","1996","52","1","254","256","10.1107/S0108270195012613","","","0.7107","MoKα","","0.0607","0.0386","","0.1169","0.1098","","","","1.058","1.197","1.197","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004338","7.2245","0.0015","8.7974","0.0013","9.181","0.002","81.627","0.013","80.521","0.013","76.58","0.015","556.31","0.19","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","2-amino-4,5-dicarbomethoxy-6-methoxypyridine","","- C10 H12 N2 O5 -","- C10 H12 N2 O5 -","- C20 H24 N4 O10 -","2","1","AB1308","Low, J. N.; Ferguson, G.; Cobo, J.; Melguizo, M.; Nogueras, M.; Sánchez, A.","2-Amino-6-methoxy-4,5-di(methoxycarbonyl)pyridine and 2-Amino-4,5-di(methoxycarbonyl)-6-methylthiopyridine","Acta Crystallographica Section C","1996","52","1","143","145","10.1107/S0108270195012601","","","0.7107","MoKα","","0.0626","0.0468","","0.1408","0.1335","","","","1.127","1.246","1.246","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004339","8.072","0.001","8.6448","0.0014","8.99","0.002","94.35","0.02","111.133","0.013","91.703","0.013","582.35","0.18","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","2-amino-4,5-dicarbomethoxy-6-methylthiopyridine","","- C10 H12 N2 O4 S -","- C10 H12 N2 O4 S -","- C20 H24 N4 O8 S2 -","2","1","AB1308","Low, J. N.; Ferguson, G.; Cobo, J.; Melguizo, M.; Nogueras, M.; Sánchez, A.","2-Amino-6-methoxy-4,5-di(methoxycarbonyl)pyridine and 2-Amino-4,5-di(methoxycarbonyl)-6-methylthiopyridine","Acta Crystallographica Section C","1996","52","1","143","145","10.1107/S0108270195012601","","","0.7107","MoKα","","0.0424","0.0347","","0.0959","0.0922","","","","1.033","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004340","6.9874","0.0004","10.647","0.002","27.0341","0.0016","90","","90","","90","","2011.2","0.4","294","1","294","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-methylthio-5-nitroso-6-N-(2,3,4-tri-O-acetyl-β-D-xylopyranosyl)amino- pyrimidin-4-(3H)-one","","- C16 H20 N4 O9 S -","- C16 H20 N4 O9 S -","- C64 H80 N16 O36 S4 -","4","1","AB1309","Cobo, J.; Melguizo, M.; Sánchez, A.; Nogueras, M.; Low, J. N.; Ferguson, G.","2-Methylthio-5-nitroso-6-<i>N</i>-(2,3,4-tri-<i>O</i>-acetyl-β-<small>D</small>-xylopyranosyl)amino-4(3<i>H</i>)-pyrimidinone","Acta Crystallographica Section C","1996","52","1","148","150","10.1107/S0108270195012595","","","0.7107","MoKα","","0.1538","0.0575","","0.1967","0.1578","","","","0.913","1.198","1.198","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004341","7.8019","0.001","15.889","0.002","10.202","0.002","90","","96.24","0.02","90","","1257.2","0.3","294","1","294","1","","","","","","","","4","P 1 21 1","P 2yb","4","","2-(2,3,4-tri-O-acetyl-β-D-xylopyranosyl)amino-4,5-dicarbomethoxy-6-methoxy- pyridine","","- C21 H26 N2 O12 -","- C21 H26 N2 O12 -","- C42 H52 N4 O24 -","2","1","AB1310","Low, J. N.; Ferguson, G.; Cobo, J.; Melguizo, M.; Nogueras, M.; Sánchez, A.","6-Methoxy-4,5-di(methoxycarbonyl)-2-(2,3,4-tri-<i>O</i>-acetyl-β-<small>D</small>-xylopyranosyl)aminopyridine and 4,5-Di(methoxycarbonyl)-6-methylthio-2-(2,3,4-tri-<i>O</i>-acetyl-β-<small>D</small>-xylopyranosyl)aminopyridine","Acta Crystallographica Section C","1996","52","1","145","148","10.1107/S0108270195012583","","","0.7107","MoKα","","0.0747","0.0417","","0.1028","0.0932","","","","1.009","1.18","1.18","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004342","7.8583","0.0009","15.842","0.002","10.368","0.002","90","","94.047","0.014","90","","1287.5","0.3","294","1","294","1","","","","","","","","5","P 1 21 1","P 2yb","4","","2-(2,3,4-tri-O-acetyl-β-D-xylopyranosyl)amino-4,5-dicarbomethoxy-6- methylthiopyridine","","- C21 H26 N2 O11 S -","- C21 H26 N2 O11 S -","- C42 H52 N4 O22 S2 -","2","1","AB1310","Low, J. N.; Ferguson, G.; Cobo, J.; Melguizo, M.; Nogueras, M.; Sánchez, A.","6-Methoxy-4,5-di(methoxycarbonyl)-2-(2,3,4-tri-<i>O</i>-acetyl-β-<small>D</small>-xylopyranosyl)aminopyridine and 4,5-Di(methoxycarbonyl)-6-methylthio-2-(2,3,4-tri-<i>O</i>-acetyl-β-<small>D</small>-xylopyranosyl)aminopyridine","Acta Crystallographica Section C","1996","52","1","145","148","10.1107/S0108270195012583","","","0.7107","MoKα","","0.0786","0.0459","","0.1131","0.1032","","","","0.993","1.161","1.161","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004343","4.6528","0.0006","8.98","0.0009","20.5944","0.0014","90","","91.752","0.008","90","","860.08","0.15","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-Amino-1-methyl-5-hydroxoiminomethyluracil Hydrate","","- C6 H10 N4 O4 -","- C6 H10 N4 O4 -","- C24 H40 N16 O16 -","4","1","AB1318","Low, J. N.; Whyte, E. R.; Ferguson, G.; Moreno-Carretero, M. N.; Hueso-Ureña, F.","6-Amino-5-hydroxyiminomethyl-1-methyluracil Hydrate","Acta Crystallographica Section C","1996","52","1","170","172","10.1107/S0108270195013229","","","0.7107","MoKα","","0.0977","0.0453","","0.1159","0.102","","","","0.968","1.152","1.152","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004344","10.3023","0.0009","6.6712","0.0007","33.0305","0.0004","90","","95.489","0.008","90","","2259.7","0.3","294","1","294","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1:1 mixture of N,N'-bis(trans-2-phenyl-5-hydroxymethyl-1,3-dioxan-5- yl)ethanediamide and N,N'-bis(cis-2-phenyl-5-hydroxymethyl-1,3-dioxan-5- yl)ethanediamide","","- C24 H28 N2 O8 -","- C24 H28 N2 O8 -","- C96 H112 N8 O32 -","4","1","AB1322","Ross, J.-N.; Wardell, J. L.; Low, J. N.; Ferguson, G.","Co-Crystallization of Stereoisomers of <i>N</i>,<i>N</i>'-Bis(2-phenyl-5-hydroxymethyl-1,3-dioxan-5-yl)ethanediamide","Acta Crystallographica Section C","1996","52","1","228","231","10.1107/S0108270195014478","","","0.7107","MolybdenumKα","","0.1013","0.0423","","0.1075","0.0941","","","","0.933","1.126","1.126","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004345","6.2996","0.0011","31.207","0.0012","6.378","0.003","90","","110.57","0.02","90","","1173.9","0.6","294","1","294","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-bis(trans-2-phenyl-5-hydroxymethyl-1,3-dioxan-5-yl)ethanediamide","","- C24 H28 N2 O8 -","- C24 H28 N2 O8 -","- C48 H56 N4 O16 -","2","0.5","AB1322","Ross, J.-N.; Wardell, J. L.; Low, J. N.; Ferguson, G.","Co-Crystallization of Stereoisomers of <i>N</i>,<i>N</i>'-Bis(2-phenyl-5-hydroxymethyl-1,3-dioxan-5-yl)ethanediamide","Acta Crystallographica Section C","1996","52","1","228","231","10.1107/S0108270195014478","","","0.7107","MolybdenumKα","","0.1309","0.0517","","0.1568","0.1162","","","","0.909","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004346","7.307","0.002","12.327","0.001","12.33","0.003","90","","100.12","0.01","90","","1093.3","0.4","298","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C9 H9 N5 O5 -","- C9 H9 N5 O5 -","- C36 H36 N20 O20 -","4","1","AS1156","Smith, G.; Lynch, D. E.; Byriel, K. A.; Kennard, C. H. L.","Molecular Co-Crystals of Carboxylic Acids. 23. The 1:1 Adducts of 3-Amino-1<i>H</i>-1,2,4-triazole with 5-Nitrosalicylic Acid and 3,5-Dinitrosalicylic Acid","Acta Crystallographica Section C","1996","52","1","231","235","10.1107/S0108270195010602","","","0.71073","MoKα","","","0.035","","","0.091","","","","","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004347","24.07","0.005","4.332","0.003","11.8298","0.0005","90","","90","","90","","1233.5","0.9","298","2","","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C9 H8 N6 O7 -","- C9 H8 N6 O7 -","- C36 H32 N24 O28 -","4","1","AS1156","Smith, G.; Lynch, D. E.; Byriel, K. A.; Kennard, C. H. L.","Molecular Co-Crystals of Carboxylic Acids. 23. The 1:1 Adducts of 3-Amino-1<i>H</i>-1,2,4-triazole with 5-Nitrosalicylic Acid and 3,5-Dinitrosalicylic Acid","Acta Crystallographica Section C","1996","52","1","231","235","10.1107/S0108270195010602","","","0.71073","MoKα","","","0.037","","","0.087","","","","","0.98","0.98","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004348","10.224","0.001","14.7","0.002","13.069","0.003","90","","103.63","0.02","90","","1908.9","0.6","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 Cu2 I2 N6 -","- C14 H16 Cu2 I2 N6 -","- C56 H64 Cu8 I8 N24 -","4","1","AS1186","Sheu, S.-C.; Lee, G.-H.; Ho, T.-I.; Lin, Y.-C.; Peng, S.-M.","A Polymeric Cu^I^ Complex of Bis(1-pyrazolylmethyl)(2-pyridylmethyl)amine (BPPA), [Cu~2~(μ-BPPA)(μ-I)~2~]~<i>n~</i>","Acta Crystallographica Section C","1996","52","1","56","59","10.1107/S0108270195009565","","","0.71073","MoKα","","","0.029","","","0.026","","","","","2.89","2.89","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004349","7.242","0.007","14.634","0.004","13.772","0.005","90","","97.89","0.07","90","","1445.7","1.6","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Al N -","- C16 H18 Al N -","- C64 H72 Al4 N4 -","4","1","AS1192","Wang, X.-M.; Sun, H.-S.; Wang, S.-X.; Huang, X.-Y.; You, X.-Z.","Adduct of AlMe~3~ with Benzo[<i>f</i>]quinoline","Acta Crystallographica Section C","1996","52","1","35","37","10.1107/S0108270195009681","","","0.71069","MoKα","","","0.064","","","0.073","","","","","2.11","2.11","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2004350","9.451","0.003","11.916","0.002","23.938","0.007","90","","90","","90","","2695.9","1.2","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1,3-Bis(orthochlorophenyl) thiourea.","","- C13 H10 Cl2 N2 S -","- C13 H10 Cl2 N2 S -","- C104 H80 Cl16 N16 S8 -","8","2","AS1197","Ramnathan, A.; Sivakumar, K.; Subramanian, K.; Janarthanan, N.; Ramadas, K.; Fun, H.-K.","1,3-Bis(2-chlorophenyl)thiourea","Acta Crystallographica Section C","1996","52","1","134","136","10.1107/S0108270195009693","","","0.71073","MoKα","","0.061","0.0449","","0.1162","0.1092","","","","0.964","1.03","1.03","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004351","16.216","0.003","16.216","0.003","16.216","0.003","90","","90","","90","","4264.1","1.4","170","","","","","","","","","","","4","P a -3","-P 2ac 2ab 3","","","","","- C14 H37 Co P4 -","- C14 H37 Co P4 -","- C112 H296 Co8 P32 -","8","0.333333","BK1075","Stringer, G.; Taylor, N. J.; Marder, T. B.","Ethynyltetrakis(trimethylphosphine)cobalt(I), [Co(CCH){P(CH~3~)~3~}~4~]","Acta Crystallographica Section C","1996","52","1","80","82","10.1107/S0108270195010304","","","0.71073","MoKα","","","0.0349","","","0.0331","","","","","1.41","1.41","","","","","has coordinates","281832","2023-03-13","07:41:56",""
"2004352","6.132","0.005","13.956","0.018","5.507","0.009","90","","103.2","0.1","90","","458.8","1","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 N2 O6 V2 -","- C4 H12 N2 O6 V2 -","- C8 H24 N4 O12 V4 -","2","0.5","BK1134","Tyrselová, J.; Kuchta, L.; Pavelcík, F.","Piperazine Metavanadate","Acta Crystallographica Section C","1996","52","1","17","19","10.1107/S010827019500850X","","","0.71069","MoKα","","","0.034","","","0.0861","","","","","1.17","1.17","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004353","18.148","0.002","10.424","0.002","12.115","0.002","90","","90.15","0.02","90","","2291.8","0.6","223","5","223","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","3,3-dimethylglutaronitrile","1,5-dicyano-3,3-dimethylpentane","","- C7 H10 N2 -","- C7 H10 N2 -","- C84 H120 N24 -","12","1.5","BK1139","Héroux, A.; Brisse, F.","3,3-Dimethylglutaronitrile","Acta Crystallographica Section C","1996","52","1","224","226","10.1107/S0108270195011814","","","1.5418","CuKα","","0.0517","0.043","","0.1215","0.1168","","","","1.065","1.136","1.136","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004354","6.5104","0.0018","12.812","0.003","13.48","0.002","90","","98.09","0.02","90","","1113.2","0.4","295","","295","","","","","","","","","3","P 1 21 1","P 2yb","4","4-acetoxy-3(2'3'-epoxy-2'-methylbutyroyloxy)cuauhtemone","Rel-1S,2R,4aS,2'S,3'S-1-acetoxy-2-(2',3'-epoxy-2'- methylbutyroyloxy)-7-isopropylidene-1,4a-dimethyl-6-decalone","","- C22 H32 O6 -","- C22 H32 O6 -","- C44 H64 O12 -","2","1","BK1143","Ahmed, A. A.; Ali, B. A.; Krawiec, M.; Watson, W. H.","5-<i>O</i>-Acetylcuauhtemonyl 6-<i>O</i>-2',3'-Epoxy-2'-methylbutyrate","Acta Crystallographica Section C","1996","52","1","235","237","10.1107/S0108270195013424","","","1.54178","CuKα","","","0.0666","","","0.0631","","","","","3.21","3.21","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004355","29.321","0.023","18.671","0.017","4.693","0.003","90","","90","","90","","2569","3","220","2","220","2","","","","","","","","5","P n a 21","P 2c -2n","33","","6-(3-methoxyphenyl)-4-methylthio-2-oxo-2H-1-pyran-3-carbonitrile","","- C14 H11 N O3 S -","- C14 H11 N O3 S -","- C112 H88 N8 O24 S8 -","8","2","BM1028","Kumar, A.; Kumar, N.; Parmar, V. S.; Errington, W.","3-Cyano-6-(3-methoxyphenyl)-4-methylthio-2-pyranone","Acta Crystallographica Section C","1996","52","1","127","129","10.1107/S010827019500967X","","","0.71073","MoKα","","0.0831","0.0513","","0.1666","0.118","","","","1.105","1.105","1.105","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004356","6.16","0.004","16.172","0.006","17.307","0.007","90","","90","","90","","1724.1","1.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N,N'-bis(2-hydroxybenzylidene)-2,2-dimethyl-1,3-propandiamine","","- C19 H22 N2 O2 -","- C19 H22 N2 O2 -","- C76 H88 N8 O8 -","4","1","BM1029","Corden, J. P.; Errington, W.; Moore, P.; Wallbridge, M. G. H.","<i>N</i>,<i>N</i>'-Bis(2-hydroxybenzylidene)-2,2-dimethyl-1,3-propanediamine","Acta Crystallographica Section C","1996","52","1","125","127","10.1107/S0108270195009917","","","0.71073","MoKα","","0.1045","0.0378","","0.0773","0.064","","","","0.657","0.895","0.895","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004357","5.392","0.002","67.18","0.08","5.374","0.003","90","","90","","90","","1947","3","288","","","","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C36 H76 Br N -","- C36 H76 Br N -","- C72 H152 Br2 N2 -","2","0.5","BM1031","Nyburg, S. C.","Di-<i>n</i>-octadecylammonium Bromide","Acta Crystallographica Section C","1996","52","1","192","194","10.1107/S0108270195012777","","","1.54184","CuKα","","","0.109","","","0.114","","","","","8.22","8.22","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2004358","13.801","0.001","10.491","0.001","11.795","0.001","90","","105.03","0.01","90","","1649.3","0.3","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","Phenyl-(2-trimethylsilylethynyl)phenylmethanone","","- C18 H18 O Si -","- C18 H18 O Si -","- C72 H72 O4 Si4 -","4","1","BM1032","Garcia, J. G.; Ramos, B.; Rodriguez, A.; Fronczek, F. R.","Phenyl 2-(Trimethylsilylethynyl)phenyl Ketone and 2-(Trimethylsilylethynyl)benzaldehyde","Acta Crystallographica Section C","1996","52","1","259","262","10.1107/S0108270195011243","","","0.71073","MoKα","","","0.056","","","0.046","","","","","1.628","1.628","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004359","7.1006","0.0005","16.88","0.002","10.1754","0.0005","90","","90","","90","","1219.6","0.18","297","","","","","","","","","","","4","I m a 2","","","","(2-trimethylsilylethynyl)-benzaldehyde","","- C12 H14 O Si -","- C12 H14 O Si -","- C48 H56 O4 Si4 -","4","0.5","BM1032","Garcia, J. G.; Ramos, B.; Rodriguez, A.; Fronczek, F. R.","Phenyl 2-(Trimethylsilylethynyl)phenyl Ketone and 2-(Trimethylsilylethynyl)benzaldehyde","Acta Crystallographica Section C","1996","52","1","259","262","10.1107/S0108270195011243","","","1.54184","CuKα","","","0.032","","","0.043","","","","","2.289","2.289","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004360","9.006","0.002","9.655","0.003","12.468","0.003","97.16","0.02","97.22","0.02","97.22","0.02","1056.1","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-(Benzo[a]phenazin-5-yl)-2-acetyloxynaphthalene","","- C28 H18 N2 O2 -","- C28 H18 N2 O2 -","- C56 H36 N4 O4 -","2","1","BM1035","McKee, V.; McCann, M.; Connaughton, N. C.; Kennedy, M. G.","1-(Benzo[<i>a</i>]phenazin-5-yl)-2-acetyloxy-naphthalene, C~28~H~18~N~2~O~2~","Acta Crystallographica Section C","1996","52","1","222","224","10.1107/S0108270195014028","","","0.71073","MoKα","","0.1268","0.0599","","0.1633","0.1273","","","","1.044","1.164","1.164","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004361","11.7739","0.0013","11.7739","0.0013","11.7739","0.0013","90","","90","","90","","1632.2","0.3","293","","293","","","","","","","","","5","F -4 3 m","F -4 2 3","216","","","","- C8 H12 Li N5 Zn -","- C8 H12 Li N5 Zn -","- C32 H48 Li4 N20 Zn4 -","4","0.0416667","BR1114","Bu, X.; Gier, T. E.; Stucky, G. D.","Tetramethylammonium Lithium Zinc Cyanide, [N(CH~3~)~4~]LiZn(CN)~4~","Acta Crystallographica Section C","1996","52","1","14","16","10.1107/S0108270195009176","","","0.7093","MolybdenumKα","","0.031","0.031","","0.033","0.033","","","","","3.05","3.05","","","","","has coordinates","198643","2020-10-21","18:00:00",""
"2004362","7.4251","0.0008","12.79","0.003","13.723","0.002","90","","90","","90","","1303.2","0.4","292","","292","","","","","","","","","6","C m c m","-C 2c 2","63","Neodymium cobalt hexacyanide tetrahydrate","Neodymium hexacyanocobaltate (III) tetrahydrate","","- C6 H8 Co N6 Nd O4 -","- C6 Co N6 Nd O4 -","- C24 Co4 N24 Nd4 O16 -","4","0.25","BR1115","Mullica, D. F.; Hayward, P. K.; Sappenfield, E. L.","Neodymium Hexacyanocobaltate(III) Tetrahydrate","Acta Crystallographica Section C","1996","52","1","61","63","10.1107/S0108270195010316","","","0.71073","MoKα","","0.024","0.022","","0.214","0.038","","","","","1.301","1.301","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004363","13.184","0.002","9.077","0.002","17.75","0.004","90","","91.98","0.01","90","","2122.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-Hexyl-N-phenyl-2-(5-ethylthioindole)carboxamide","","- C23 H28 N2 O S -","- C23 H28 N2 O S -","- C92 H112 N8 O4 S4 -","4","1","CF1000","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Caubère, C.; Caubère, P.","<i>N</i>-Hexyl-<i>N</i>-phenyl-5-ethylthioindole-2-carboxamide","Acta Crystallographica Section C","1996","52","1","197","199","10.1107/S0108270195007414","","","1.54178","CuKα","","0.1866","0.0636","","0.2605","0.1629","","","","1.004","1.258","1.258","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2004364","12.0031","0.001","19.527","0.003","13.953","0.002","90","","102.3","0.009","90","","3195.3","0.7","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,2-Bis[penta(phenylthio)phenyl]ethane","","- C74 H54 S10 -","- C74 H54 S10 -","- C148 H108 S20 -","2","0.5","CF1010","Henderson, R. K.; MacNicol, D. D.; Rowan, S. J.","1,2-Bis[2,3,4,5,6-pentakis(phenylthio)phenyl]ethane","Acta Crystallographica Section C","1996","52","1","210","212","10.1107/S0108270195012716","","","0.71073","MoKα","","0.2186","0.0609","","0.1877","0.1296","","","","0.998","1.136","1.136","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004365","10.6896","0.0009","11.9963","0.0009","18.399","0.002","90","","98.748","0.008","90","","2332","0.4","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cyclopentadienyl(phenylthiolato)bis(t-butylisocyanide)carbonylmolybdenum(II)","","- C22 H28 Mo N2 O S -","- C22 H28 Mo N2 O S -","- C88 H112 Mo4 N8 O4 S4 -","4","1","CF1015","McDermott, L. C.; Muir, K. W.; Pétillon, F. Y.; Poder-Guillou, S.; Schollhammer, P.","<i>cis</i>-(Benzenethiolato)bis(<i>tert</i>-butyl isocyanide)carbonyl(cyclopentadienyl)molybdenum(II), [Mo(C~6~H~5~S)(C~5~H~9~N)~2~(C~5~H~5~)(CO)]","Acta Crystallographica Section C","1996","52","1","74","77","10.1107/S0108270195009486","","","0.71073","MoKα","","0.1061","0.0522","","0.1117","0.092","","","","1.009","1.064","1.064","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004366","25.4909","0.0004","14.586","0.0012","7.4","0.002","90","","90","","90","","2751.4","0.8","150","","150","","","","","","","","","2","P n a 21","P 2c -2n","33","triphenylmethane","","","- C19 H16 -","- C19 H16 -","- C152 H128 -","8","2","CF1020","Veldman, N.; Spek, A. L.; Schlotter, J. J. H.; Zwikker, J. W.; Jenneskens, L. W.","Low-Temperature Triphenylmethane","Acta Crystallographica Section C","1996","52","1","174","177","10.1107/S0108270195011164","","","0.71073","MoKα","","0.129","0.054","","","0.129","","","","0.971","0.971","0.971","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004367","9.2634","0.001","13.9834","0.0014","14.2332","0.0012","90","","90.701","0.011","90","","1843.5","0.3","294","1","294","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Tetracarbonylbis(tri-t-butyl phosphite)molybdenum(0)","","- C28 H54 Mo O10 P2 -","- C28 H54 Mo O10 P2 -","- C56 H108 Mo2 O20 P4 -","2","0.5","CF1022","Alyea, E. C.; Ferguson, G.; Song, S.-Q.","<i>trans</i>-Tetracarbonylbis(tri-<i>tert</i>-butyl phosphite)molybdenum(0)","Acta Crystallographica Section C","1996","52","1","66","69","10.1107/S0108270195007803","","","0.7107","MoKα","","0.0607","0.0388","","0.1059","0.0992","","","","1.034","1.141","1.141","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004368","9.8502","0.0011","20.462","0.002","9.2056","0.0012","90","","90","","90","","1855.4","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Cyano-2-methylsparteine perchlorate","","- C17 H28 Cl N3 O4 -","- C17 H28 Cl N3 O4 -","- C68 H112 Cl4 N12 O16 -","4","1","CF1028","Kubicki, M.; Borowiak, T.; Boczoń, Wł.","2-Cyano-2-methylsparteine Perchlorate","Acta Crystallographica Section C","1996","52","1","226","228","10.1107/S0108270195011231","","","1.54178","CuKα","","0.055","0.055","","0.148","0.148","","","","1.055","1.055","1.055","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2004369","22.162","0.017","5.565","0.004","10.57","0.011","90","","109.33","0.07","90","","1230.1","1.9","220","2","220","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-nitro-2-furan carboxylic acid","","- C5 H3 N O5 -","- C5 H3 N O5 -","- C40 H24 N8 O40 -","8","1","CF1029","Alcock, N. W.; Errington, W.; Kemp, T. J.; Leciejewicz, J.","5-Nitro-2-furancarboxylic Acid","Acta Crystallographica Section C","1996","52","1","188","189","10.1107/S0108270195012789","","","0.71073","MoKα","","0.0429","0.0355","","0.0958","0.0897","","","","1.05","1.071","1.071","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2004370","14.341","0.005","12.451","0.007","23.866","0.013","90","","90","","90","","4262","4","293","","","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C29 H72 Cl2 Cu3 N8 O5 -","- C30 H76 Cl2 Cu3 N8 O6 -","- C120 H304 Cl8 Cu12 N32 O24 -","4","0.5","CF1030","Wang, S.","Cu~3~(bdmap)~4~Cl~2~(CH~3~OH), bdmap = 1,3-Bis(dimethylamino)-2-propanolato. A Clamp-Shaped Molecule","Acta Crystallographica Section C","1996","52","1","41","43","10.1107/S0108270195009462","","","0.71073","MoKα","","","0.068","","","0.052","","","","","2.42","2.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004371","8.269","0.004","11.31","0.005","12.332","0.005","92.45","0.03","95.02","0.03","105.78","0.04","1102.9","0.9","150","0.2","150","0.2","","","","","","","","6","P -1","-P 1","2","","catena-{1,4,7,10-tetraoxa-13,16-dithiacyclooctadecane-S,S'-mercury(II)- bis(μ-chloro)-mercury(II)dichloride}","","- C12 H24 Cl4 Hg2 O4 S2 -","- C12 H24 Cl4 Hg2 O4 S2 -","- C24 H48 Cl8 Hg4 O8 S4 -","2","1","CF1033","Blake, A. J.; Parsons, S.; Radek, C.; Schröder, M.","<i>catena</i>-{[HgCl~2~([18]aneS~2~O~4~)]HgCl~2~} at 150K: a Redetermination and Reinterpretation","Acta Crystallographica Section C","1996","52","1","21","24","10.1107/S0108270195008717","","","0.71073","MoKα","","0.0375","0.0342","","0.0933","0.0871","","","","1.109","1.119","1.119","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004372","12.525","0.003","8.49","0.002","15.697","0.006","90","","104.19","0.03","90","","1618.2","0.9","299","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C18 H24 O3 -","- C18 H24 O3 -","- C72 H96 O12 -","4","1","CR1175","Gi, H.-J.; Wang, T.; Zhao, K.","1β-(4-Methoxybenzyl)-8α-vinyl-7-oxabicyclo[4.3.0]nonan-6β-ol","Acta Crystallographica Section C","1996","52","1","186","187","10.1107/S0108270195008225","","","0.71073","MoKα","","","0.057","","","0.061","","","","","5.7","5.7","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004373","7.0549","0.001","12.4741","0.001","14.1928","0.001","90","","90","","90","","1249","0.2","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H11 N3 O5 -","- C12 H11 N3 O5 -","- C48 H44 N12 O20 -","4","1","CR1177","Moreno Fuquen, R.; De Almeida Santos, R. H.; Lechat, J. R.","The 1:1 Complex Formed by 4-Nitropyridine <i>N</i>-Oxide and 4-Aminobenzoic Acid","Acta Crystallographica Section C","1996","52","1","220","222","10.1107/S0108270195010262","","","0.71073","MoKα","","0.0665","0.0448","","0.131","0.1134","","","","1.83","1.796","1.796","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004374","9.302","0.0008","14.08","0.001","14.1587","0.0012","90","","90","","90","","1854.4","0.3","296","1","296","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-O-Acetyl-7,8-dihydromorphine-6-O-sulfate","","- C19 H23 N O7 S -","- C19 H23 N O7 S -","- C76 H92 N4 O28 S4 -","4","1","CR1191","Brock, C. P.; Kottayil, S.; Butterfield, D. A.; Crooks, P. A.","A Dihydromorphine-6-<i>O</i>-sulfate","Acta Crystallographica Section C","1996","52","1","122","125","10.1107/S0108270195010250","","","0.71073","MoKα","","0.1287","0.0419","","0.1224","0.0994","","","","1.007","1.163","1.163","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004375","7.179","0.0004","7.819","0.0004","17.987","0.002","90","","92.44","0.01","90","","1008.74","0.14","295","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","1-Bromo-2,7-dimethylnaphthalene","","- C12 H11 Br -","- C12 H11 Br -","- C48 H44 Br4 -","4","1","CR1195","Brown, L. A.; Laxman, R. K.; Maverick, A. W.; Fronczek, F. R.","1-Bromo-2,7-dimethylnaphthalene","Acta Crystallographica Section C","1996","52","1","95","97","10.1107/S0108270195010274","","","0.71073","MoKα","","","0.058","","","0.042","","","","","1.657","1.657","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004376","17.649","0.003","16.428","0.001","18.743","0.003","90","","106.636","0.007","90","","5206.8","1.3","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dicyclohexylammonium bis(dimethyldithiocarbamyl)acetate","","- C20 H37 N3 O2 S4 -","- C20 H37 N3 O2 S4 -","- C160 H296 N24 O16 S32 -","8","2","DE1009","Ng, S. W.","Dicyclohexylammonium Bis(dimethyldithiocarbamyl)acetate","Acta Crystallographica Section C","1996","52","1","181","183","10.1107/S0108270195011279","","","0.71073","MoKα","","0.0764","0.0462","","0.1225","0.1055","","","","1.015","1.059","1.059","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004379","8.641","0.004","21.921","0.004","16.298","0.004","90","","97.67","0.03","90","","3059.5","1.7","296","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C12 H36 Ag2 N4 O S8 W2 -","- C12 H36 Ag2 N4 O S8 W2 -","- C48 H144 Ag8 N16 O4 S32 W8 -","4","0.5","FG1066","Huang, Q.; Wu, X.; Sheng, T.; Wang, Q.","The Polymeric Cluster Compound [(tmenH~2~).(W~2~Ag~2~S~8~).(tmen).(H~2~O)]~<i>n~</i> (tmen = <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylethylenediamine)","Acta Crystallographica Section C","1996","52","1","29","31","10.1107/S0108270195009000","","","0.71073","MoKα","","","0.053","","","0.054","","","","","1.44","1.44","","","","","has coordinates","176342","2020-10-21","18:00:00",""
"2004380","8.848","0.004","10.77","0.005","11.335","0.006","100.27","0.02","101.96","0.02","113.93","0.02","923.4","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Dicarbonyl(1,10-phenanthroline)[(1,2,3-η)-2-propenyl]molybdenum Trifluoroacetate","","- C19 H13 F3 Mo N2 O4 -","- C19 H13 F3 Mo N2 O4 -","- C38 H26 F6 Mo2 N4 O8 -","2","1","FG1067","Eriksson, L.; Sjögren, M. P. T.; Åkermark, B.","(η^3^-Allyl)dicarbonyl(1,10-phenanthroline)(trifluoroacetato)molybdenum, (I), and [<i>syn</i>(1,2,3-η)-2-Butenyl]dicarbonyl(1,10-phenanthroline)(trifluoroacetato)molybdenum, (II)","Acta Crystallographica Section C","1996","52","1","77","80","10.1107/S0108270195009425","","","0.7106","MoKα","","0.0366","0.0302","","0.0744","0.0715","","","","1.042","1.072","1.072","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004381","20.191","0.009","7.009","0.003","28.944","0.017","90","","109.4","0.02","90","","3864","3","293","2","293","2","","","","","","","","6","A 1 2/n 1","-A 2yab","15","","Dicarbonyl(1,10-phenantroline)[syn-(1,2,3-η)-2-butenyl]molybdenum Trifluoroacetate","","- C20 H15 F3 Mo N2 O4 -","- C20 H15 F3 Mo N2 O4 -","- C160 H120 F24 Mo8 N16 O32 -","8","1","FG1067","Eriksson, L.; Sjögren, M. P. T.; Åkermark, B.","(η^3^-Allyl)dicarbonyl(1,10-phenanthroline)(trifluoroacetato)molybdenum, (I), and [<i>syn</i>(1,2,3-η)-2-Butenyl]dicarbonyl(1,10-phenanthroline)(trifluoroacetato)molybdenum, (II)","Acta Crystallographica Section C","1996","52","1","77","80","10.1107/S0108270195009425","","","0.7106","MoKα","","0.1339","0.0697","","0.0905","0.0791","","","","1.034","1.191","1.191","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004382","20.275","0.006","17.006","0.004","11.038","0.004","90","","90","","90","","3806","2","150","","150","","","","","","","","","4","P b c a","-P 2ac 2ab","61","(dl)-Pheniramine hydrogen maleate","","","- C20 H2 N O4 -","- C20 H24 N2 O4 -","- C160 H192 N16 O32 -","8","1","FG1077","Parvez, M.; Rusiewicz, M.","<small>DL</small>-Pheniramine Hydrogen Maleate","Acta Crystallographica Section C","1996","52","1","83","85","10.1107/S010827019501047X","","","0.71069","MoKα","","","0.069","","","0.069","","","","","2.64","2.64","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004383","15.915","0.002","10.777","0.002","14.387","0.002","90","","92.681","0.012","90","","2464.9","0.7","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(acetato)bis(pyridine-2-amidoxime-N,N')nickel(II) - Ethanol (1/2)","","- C20 H32 N6 Ni O8 -","- C20 H32 N6 Ni O8 -","- C80 H128 N24 Ni4 O32 -","4","0.5","FG1090","Werner, M.; Berner, J.; Jones, P. G.","Bis(acetato)bis(pyridine-2-amidoxime-<i>N</i>,<i>N</i>')nickel(II)‒Ethanol (1/2)","Acta Crystallographica Section C","1996","52","1","72","74","10.1107/S0108270195009413","","","0.71073","MoKα","","0.0686","0.0454","","0.1002","0.0899","","","","1.042","1.071","1.071","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004384","8.016","0.001","11.552","0.001","14.409","0.002","90","","90","","90","","1334.3","0.3","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H20 N2 O3 -","- C12 H20 N2 O3 -","- C48 H80 N8 O12 -","4","1","HA1110","Charalambous, J.; Thomas, T. A.; Carugo, O.; Castellani, C. B.","5-Hexylamino-1,2-benzoquinone 2-Oxime Monohydrate","Acta Crystallographica Section C","1996","52","1","150","152","10.1107/S0108270195003696","","","1.54184","CuKα","","","0.046","","","0.023","","","","","1.12","1.12","","","","","has coordinates","190596","2020-10-21","18:00:00",""
"2004385","9.7749","0.0014","16.821","0.003","15.293","0.002","90","","99.501","0.014","90","","2480","0.7","150","0.2","150","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Potassium-dibenzo[18]crown-6 triiodide","[(dibenzo[b,k][1,4,7,10,13,16]hexaoxa-cyclooctadeca-2,11-diene)potassium] triiodide","","- C20 H24 I3 K O6 -","- C20 H24 I3 K O6 -","- C80 H96 I12 K4 O24 -","4","1","HA1143","Blake, A. J.; Gould, R. O.; Parsons, S.; Radek, C.; Schröder, M.","Potassium Dibenzo-18-crown-6 Triiodide","Acta Crystallographica Section C","1996","52","1","24","27","10.1107/S0108270195010626","","","0.71073","MoKα","","0.0543","0.0419","","0.1159","0.1056","","","","1.046","1.084","1.084","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2004386","8.446","0.003","23.76","0.08","10.454","0.002","90","","90","","90","","2098","7","293","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C11 H10 N2 O S -","- C11 H10 N2 O S -","- C88 H80 N16 O8 S8 -","8","1","HA1147","Hansell, D. P.; Robinson, K. J.; Wallis, J. D.; Povey, D. C.","<i>N</i>-[3-Methyl-2(3<i>H</i>)-thiazolylidene]benzamide Containing a Short Intramolecular S···O Contact","Acta Crystallographica Section C","1996","52","1","136","139","10.1107/S0108270195011577","","","0.71069","MoKα","","","0.041","","","0.045","","","","","1.42","1.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004387","6.814","0.002","12.083","0.006","13.762","0.007","90","","96.15","0.03","90","","1126.6","0.9","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[triaqua(2-aminopyrimidine)μu-sulphato-o,o^,^-cobalt(II)] dihydrate","","- C8 H26 Co2 N6 O16 S2 -","- C8 H26 Co2 N6 O16 S2 -","- C16 H52 Co4 N12 O32 S4 -","2","0.5","HR1034","Lumme, P. O.; Knuuttila, H.; Lindell, E.","Di-μ-sulfato-<i>O</i>:<i>O</i>'-bis[(2-aminopyrimidine-<i>N</i>^1^)triaquacobalt(II)] Dihydrate (1), <i>catena</i>-Poly[bis(2-aminopyrimidine-<i>N</i>^1^)diaquanickel(II)-μ-sulfato-<i>O</i>:<i>O</i>' 2-Aminopyrimidine] (2), (2-Aminopyrimidine-<i>N</i>^1^)pentaaquanickel(II) Sulfate 2-Aminopyrimidine (3) and <i>catena</i>-Poly[bis(2-aminopyrimidine-<i>N</i>^1^)aquacopper(ii)-μ-sulfato-<i>O</i>:<i>O</i>' Dihydrate] (4)","Acta Crystallographica Section C","1996","52","1","51","56","10.1107/S0108270195001338","","","0.71069","MoKα","","0.118","0.061","","0.128","0.055","","","","4.477","2.44","2.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004388","6.426","0.003","11.027","0.006","13.68","0.01","93.11","0.06","90.64","0.06","95.06","0.04","964","1","295","1","295","1","","","","","","","","6","P -1","-P 1","2","","catena-[Diaqua2(2-aminopyrimidine)-μ-sulphato-o,o^,^-nickel(II)] 2-aminopyrimidine","","- C12 H19 N9 Ni O6 S -","- C12 H19 N9 Ni O6 S -","- C24 H38 N18 Ni2 O12 S2 -","2","1","HR1034","Lumme, P. O.; Knuuttila, H.; Lindell, E.","Di-μ-sulfato-<i>O</i>:<i>O</i>'-bis[(2-aminopyrimidine-<i>N</i>^1^)triaquacobalt(II)] Dihydrate (1), <i>catena</i>-Poly[bis(2-aminopyrimidine-<i>N</i>^1^)diaquanickel(II)-μ-sulfato-<i>O</i>:<i>O</i>' 2-Aminopyrimidine] (2), (2-Aminopyrimidine-<i>N</i>^1^)pentaaquanickel(II) Sulfate 2-Aminopyrimidine (3) and <i>catena</i>-Poly[bis(2-aminopyrimidine-<i>N</i>^1^)aquacopper(ii)-μ-sulfato-<i>O</i>:<i>O</i>' Dihydrate] (4)","Acta Crystallographica Section C","1996","52","1","51","56","10.1107/S0108270195001338","","","0.71069","MoKα","","0.193","0.092","","0.105","0.069","","","","3.113","3.02","3.02","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004389","7.28","0.002","10.391","0.003","22.329","0.007","90","","90","","90","","1689.1","0.9","295","1","295","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","[Pentaaqua(2-aminopyrimidine)nickel(II)]2-aminopyrimidine","","- C8 H20 N6 Ni O9 S -","- C8 H20 N6 Ni O9 S -","- C32 H80 N24 Ni4 O36 S4 -","4","1","HR1034","Lumme, P. O.; Knuuttila, H.; Lindell, E.","Di-μ-sulfato-<i>O</i>:<i>O</i>'-bis[(2-aminopyrimidine-<i>N</i>^1^)triaquacobalt(II)] Dihydrate (1), <i>catena</i>-Poly[bis(2-aminopyrimidine-<i>N</i>^1^)diaquanickel(II)-μ-sulfato-<i>O</i>:<i>O</i>' 2-Aminopyrimidine] (2), (2-Aminopyrimidine-<i>N</i>^1^)pentaaquanickel(II) Sulfate 2-Aminopyrimidine (3) and <i>catena</i>-Poly[bis(2-aminopyrimidine-<i>N</i>^1^)aquacopper(ii)-μ-sulfato-<i>O</i>:<i>O</i>' Dihydrate] (4)","Acta Crystallographica Section C","1996","52","1","51","56","10.1107/S0108270195001338","","","0.71069","MoKα","","0.052","0.034","","0.049","0.036","","","","3.275","2.48","2.48","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004390","4.927","0.002","19.119","0.009","7.93","0.004","90","","94.77","0.03","90","","744.4","0.6","295","1","295","1","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","catena-[Aqua2(2-aminopyrimidine)-μ-o,o~,~ -copper(II)] dihydrate","","- C8 H16 Cu N6 O7 S -","- C8 H16 Cu N6 O7 S -","- C16 H32 Cu2 N12 O14 S2 -","2","0.5","HR1034","Lumme, P. O.; Knuuttila, H.; Lindell, E.","Di-μ-sulfato-<i>O</i>:<i>O</i>'-bis[(2-aminopyrimidine-<i>N</i>^1^)triaquacobalt(II)] Dihydrate (1), <i>catena</i>-Poly[bis(2-aminopyrimidine-<i>N</i>^1^)diaquanickel(II)-μ-sulfato-<i>O</i>:<i>O</i>' 2-Aminopyrimidine] (2), (2-Aminopyrimidine-<i>N</i>^1^)pentaaquanickel(II) Sulfate 2-Aminopyrimidine (3) and <i>catena</i>-Poly[bis(2-aminopyrimidine-<i>N</i>^1^)aquacopper(ii)-μ-sulfato-<i>O</i>:<i>O</i>' Dihydrate] (4)","Acta Crystallographica Section C","1996","52","1","51","56","10.1107/S0108270195001338","","","0.71069","MoKα","","0.065","0.039","","0.042","0.035","","","","1.742","2.06","2.06","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004391","7.5415","0.001","18.3253","0.0024","13.382","0.003","90","","90","","90","","1849.4","0.5","298","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H24 Ge O8 -","- C16 H24 Ge O8 -","- C64 H96 Ge4 O32 -","4","0.5","HU1094","Chiang, H.-C.; Hwang, S.-F.; Ueng, C.-H.","Bis(1,2-benzenediolato)dimethanolgermanium(IV)","Acta Crystallographica Section C","1996","52","1","31","33","10.1107/S0108270195007463","","","0.7107","MoKα","","","0.035","","","0.039","","","","","2.36","2.36","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004392","9.84","0.002","10.379","0.004","13.804","0.003","111.5","0.02","105.4","0.02","102.12","0.02","1188.1","0.7","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H23 As O2 Se -","- C27 H23 As O2 Se -","- C54 H46 As2 O4 Se2 -","2","1","JZ1054","Lu, W.-M.; Huang, Z.-Z.; Huang, X.","α-Phenylselenomethoxycarbonylmethyl(triphenyl)arsorane","Acta Crystallographica Section C","1996","52","1","89","91","10.1107/S0108270195007815","","","0.71073","MoKα","","","0.048","","","0.054","","","","","1.973","1.973","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004393","8.988","0.006","16.861","0.004","17.737","0.002","90","","96.48","0.03","90","","2670.8","1.9","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,8-Dichloro-1,1,2,2-tetraphenylnaphthocyclobutene","","- C36 H24 Cl2 -","- C36 H24 Cl2 -","- C144 H96 Cl8 -","4","1","JZ1061","Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I.","Extremely Long C—C Bonds in Strained 1,1,2,2-Tetraphenylcyclobutaarenes: 3,8-Dichloro-1,1,2,2-tetraphenylcyclobuta[<i>b</i>]naphthalene, C~36~H~24~Cl~2~, and 3,6,9,10-Tetrachloro-4,5-dimethyl-1,1,2,2,7,7,8,8-octaphenyldicyclobuta[<i>b</i>,<i>h</i>]phenanthrene Toluene Solvate, C~68~H~46~Cl~4~.1.5C~7~H~8~","Acta Crystallographica Section C","1996","52","1","177","180","10.1107/S0108270195011097","","","0.7107","MoKα","","0.0696","0.048","","0.156","0.1391","","","","0.924","0.965","0.965","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004394","11.415","0.004","14.316","0.002","18.785","0.004","85.29","0.02","79.11","0.03","82.63","0.03","2984.3","1.3","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","4,5,8,11-tetrachloro-9,10-dimethyl-1,1,2,2,6,6,7,7-octaphenyl- phenanthrodicyclobutene toluene solvate","","- C78.5 H58 Cl4 -","- C78.5 H54 Cl4 -","- C157 H108 Cl8 -","2","1","JZ1061","Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I.","Extremely Long C—C Bonds in Strained 1,1,2,2-Tetraphenylcyclobutaarenes: 3,8-Dichloro-1,1,2,2-tetraphenylcyclobuta[<i>b</i>]naphthalene, C~36~H~24~Cl~2~, and 3,6,9,10-Tetrachloro-4,5-dimethyl-1,1,2,2,7,7,8,8-octaphenyldicyclobuta[<i>b</i>,<i>h</i>]phenanthrene Toluene Solvate, C~68~H~46~Cl~4~.1.5C~7~H~8~","Acta Crystallographica Section C","1996","52","1","177","180","10.1107/S0108270195011097","","","0.7107","MoKα","","0.0733","0.061","","0.1953","0.1863","","","","1.317","1.397","1.397","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004395","6.522","0.003","6.852","0.001","10.539","0.001","71.24","0.01","78.88","0.03","63.29","0.03","397.7","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","2,8-Dithia-1-phospha-5-arsabicyclo[3.3.0]octan-1-oxide","","- C4 H8 As O P S2 -","- C4 H8 As O P S2 -","- C8 H16 As2 O2 P2 S4 -","2","1","JZ1062","Jurkschat, K.; Schollmeyer, D.","2,8-Dithia-1-phospha-5-arsabicyclo[3.3.0]octane 1-Oxide","Acta Crystallographica Section C","1996","52","1","250","252","10.1107/S0108270195011449","","","0.7107","MoKα","","0.036","0.0297","","0.0826","0.0797","","","","1.12","1.146","1.146","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004396","10.26","0.007","10.819","0.005","16.266","0.009","90","","106.07","0.07","90","","1735","1.8","295","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H22 N2 O5 -","- C17 H22 N2 O5 -","- C68 H88 N8 O20 -","4","2","KA1119","Tomas, A.; Lemoine, P.; Viossat, B.; Robin, S.; Zhu, J.; Galons, H.","(<i>S</i>)-3-(1,1-Dimethyloxycarbonylamino)-1-phenylmethyloxypiperidine-2,6-dione, C~17~H~22~N~2~O~5~","Acta Crystallographica Section C","1996","52","1","199","201","10.1107/S010827019500905X","","","0.71069","MoKα","","","0.058","","","0.06","","","","","1.01","1.01","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004397","10.262","0.003","10.595","0.003","11.95","0.004","88.36","0.02","84.28","0.02","83.07","0.02","1283.2","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(1,10-phenanthroline)cyanocopper(II) Tricyanomethanide Dihydrate.","","- C29 H20 Cu N8 O2 -","- C29 H20 Cu N8 O2 -","- C58 H40 Cu2 N16 O4 -","2","1","KA1132","Potočňák, I.; Dunaj-Jurčo, M.; Mikloš, D.; Jäger, L.","Cyanobis(1,10-phenanthroline)copper(II) Tricyanomethanide Dihydrate","Acta Crystallographica Section C","1996","52","1","48","50","10.1107/S0108270195008638","","","0.71069","MoKα","","0.0975","0.0438","","0.1196","0.1084","","","","0.913","1.094","1.094","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2004398","16.451","0.001","9.481","0.001","16.577","0.001","90","","102.34","0.01","90","","2525.8","0.4","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","dimethyl 2,3-bis(diphenylmethylene)-1,4-butanedicarboxylate or 2,3-di(methyl carboxylate)-1,1,4,4-tetraphenyl-1,3-butadiene","","- C32 H26 O4 -","- C32 H26 O4 -","- C128 H104 O16 -","4","0.5","KA1141","Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I.","Conformation of Acyclic Derivatives of 1,1,4,4-Tetraphenyl-1,3-butadiene","Acta Crystallographica Section C","1996","52","1","118","122","10.1107/S0108270195011358","","","0.71073","MoKα","","0.0616","0.0497","","0.1551","0.1436","","","","1.021","1.061","1.061","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004399","10.3","0.008","16.004","0.002","17.788","0.003","90","","92.06","0.03","90","","2930","2","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,3-bis(diphenylmethylene)-1,4-butanedioic acid diethanol solvate or 2,3-dicarboxylic acid-1,1,4,4-tetraphenyl-1,3-butadiene diethanol solvate","","- C34 H34 O6 -","- C34 H34 O6 -","- C136 H136 O24 -","4","1","KA1141","Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I.","Conformation of Acyclic Derivatives of 1,1,4,4-Tetraphenyl-1,3-butadiene","Acta Crystallographica Section C","1996","52","1","118","122","10.1107/S0108270195011358","","","0.71073","MoKα","","0.1192","0.0832","","0.2542","0.2181","","","","1.341","1.51","1.51","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004400","14.643","0.004","8.889","0.001","19.682","0.004","90","","105.22","0.02","90","","2472","0.9","295","2","295","2","","","","","","","","3","P 1 2/n 1","-P 2yac","13","","2,3-dimethylbromide-1,1,4,4-tetraphenyl-1,3-butadiene","","- C30 H24 Br2 -","- C30 H24 Br2 -","- C120 H96 Br8 -","4","1","KA1141","Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I.","Conformation of Acyclic Derivatives of 1,1,4,4-Tetraphenyl-1,3-butadiene","Acta Crystallographica Section C","1996","52","1","118","122","10.1107/S0108270195011358","","","0.71073","MoKα","","0.1347","0.1013","","0.2372","0.2224","","","","1.316","1.522","1.522","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004401","9.267","0.002","10.344","0.003","12.149","0.002","97.29","0.02","104.51","0.02","105.49","0.02","1062.8","0.5","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H54 N2 O14 S2 -","- C46 H46 N2 O16 S2 -","- C46 H46 N2 O16 S2 -","1","0.5","KA1145","Bien, J. T.; Shang, M.; Smith, B. D.","7,7'-Bis[(aza-18-crown-6)carbonyl]thioindigo","Acta Crystallographica Section C","1996","52","1","183","186","10.1107/S0108270195012455","","","0.71073","MoKα","","","0.05085","","","0.06747","","","","","2.256","2.256","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004402","32.549","0.008","6.604","0.001","14.933","0.005","90","","95.21","0.02","90","","3196.6","1.4","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H50 Cl2 Zr -","- C32 H50 Cl2 Zr -","- C128 H200 Cl8 Zr4 -","4","0.5","KH1008","Tian, J.; Li, H.; Hu, N.-H.; Huang, B.-T.","A New Zirconocene Complex, [{η^5^-C~5~H~4~-C(CH~2~)~5~(CH~2~)~2~CH(CH~3~)~2~}~2~ZrCl~2~]","Acta Crystallographica Section C","1996","52","1","19","21","10.1107/S0108270195005543","","","0.71073","MoKα","","","0.035","","","0.044","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004403","10.38","0.007","4.65","0.004","16.04","0.01","90","","92.25","0.07","90","","773.6","1","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H14 N2 O2 -","- C20 H14 N2 O2 -","- C40 H28 N4 O4 -","2","0.5","KH1043","Yoneda, A.; Hakushi, T.; Newkome, G. R.; Matsushita, T.","<i>trans</i>-1,2-Bis(8-hydroxy-2-quinolinyl)ethene: Comparison with <i>trans</i>-Stilbene","Acta Crystallographica Section C","1996","52","1","172","174","10.1107/S0108270195011450","","","0.71069","MoKα","","","0.036","","","0.032","","","","","2.45","2.45","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004404","13.527","0.004","15.592","0.005","12.429","0.006","104.91","0.03","94.72","0.03","101.19","0.02","2460.7","1.7","296","","","","","","","","","","","9","P -1","-P 1","2","","","","- C44 H50 Ag Br2 Fe N P2 S4 W -","- C44 H50 Ag Br2 Fe N P2 S4 W -","- C88 H100 Ag2 Br4 Fe2 N2 P4 S8 W2 -","2","1","KH1045","Lin, P.; Huang, Q.; Sheng, T.; Wu, X.","The Heterotrimetallic Linear Complex Tetraethylammonium Dibromo-2κ^2^<i>Br</i>-tetra-μ-sulfido-1:2κ^4^<i>S</i>;1:3κ^4^<i>S</i>-bis(triphenylphosphine-3κ<i>P</i>)-2-iron-3-silver-1-tungsten, [Et~4~N][Br~2~FeS~2~WS~2~Ag(PPh~3~)~2~]","Acta Crystallographica Section C","1996","52","1","27","29","10.1107/S0108270195009723","","","0.71073","MoKα","","","0.044","","","0.053","","","","","1.44","1.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004405","9.019","0.002","9.986","0.001","11.599","0.002","65.32","0.01","71.77","0.01","71.57","0.01","880.5","0.3","300","2","300","2","","","","","","","","5","P -1","-P 1","2","bis[aqua-3,3'-iminobispropylamine)copper(II)] pyromellitate octahydrate","mu-(1,2,4,5-benzenetetracarboxylato)bis[aqua(1,7-diamino-4-aza- heptane)copper(II)] octahydrate","","- C22 H56 Cu2 N6 O18 -","- C22 H56 Cu2 N6 O18 -","- C22 H56 Cu2 N6 O18 -","1","0.5","KH1050","Chen, W.; Tioh, N. H.; Zou, J.-Z.; Xu, Z.; You, X.-Z.","A Tetracarboxylatobenzene-Bridged Binuclear Copper(II) Complex","Acta Crystallographica Section C","1996","52","1","43","45","10.1107/S0108270195010444","","","0.71073","MoKα","","0.0366","0.0323","","0.0856","0.0836","","","","1.115","1.154","1.154","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004406","6.903","0.001","22.275","0.002","14.6622","0.0009","90","","95.722","0.011","90","","2243.3","0.4","150","1","150","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2,3,4,6,7,8,9,11,12,13,14-dodecahydro-1,6,14-trioxo- benzo[b]benzo[4,5]furo[3,2-d]oxoninium hydroxide","","- C24 H31.5 O5.43 -","- C24 H31.41 O5.41 -","- C96 H125.64 O21.64 -","4","1","LI1137","Barnes, J. C.","A Trimer from 5,5-Dimethylcyclohexan-1,3-dione Containing an O-Protonated Furan Ring","Acta Crystallographica Section C","1996","52","1","262","264","10.1107/S0108270195009279","","","0.71069","MoKα","","0.0847","0.056","","0.157","0.1328","","","","0.85","1.006","1.006","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004407","7.336","0.001","7.401","0.002","10.408","0.004","90","","93.34","0.02","90","","564.1","0.3","296","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C6 H10 Cd Cl4 N2 -","- C6 H10 Cd Cl4 N2 -","- C12 H20 Cd2 Cl8 N4 -","2","0.5","MU1132","Ye, Q.; Meng, Q.-J.; You, X.-Z.; Huang, X.-Y.","The Intercalation Compound 1,4-Benzenediammonium Tetrachlorocadmate(II)","Acta Crystallographica Section C","1996","52","1","33","35","10.1107/S0108270195007797","","","0.71069","MoKα","","","0.055","","","0.064","","","","","2.45","2.45","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004408","9.461","0.004","12.298","0.006","12.603","0.006","90","","98.6","0.03","90","","1449.9","1.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(phosphonomethyl)acrylic acid hemihydrate","2-(phosphonomethyl)acrylic acid hemihydrate","","- C4 H8 O0.5 P -","- C4 H8 O5.5 P -","- C32 H64 O44 P8 -","8","2","MU1185","Weichsel, A.; Lis, T.","2-(Phosphonomethyl)acrylic Acid Hemihydrate and Ammonium 2-(Phosphonomethyl)acrylate: Analogues of Phosphoenolpyruvate (PEP)","Acta Crystallographica Section C","1996","52","1","97","101","10.1107/S0108270195009802","","","0.71069","MoKα","","0.0386","0.0377","","0.1053","0.1041","","","","1.087","1.09","1.09","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004409","6.324","0.003","7.71","0.003","16.444","0.006","90","","91.52","0.03","90","","801.5","0.6","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","ammonium 2-(phosphonomethyl)acrylate","ammonium 2-(phosphonomethyl)acrylate","","- C4 H10 N O5 P -","- C4 H10 N O5 P -","- C16 H40 N4 O20 P4 -","4","1","MU1185","Weichsel, A.; Lis, T.","2-(Phosphonomethyl)acrylic Acid Hemihydrate and Ammonium 2-(Phosphonomethyl)acrylate: Analogues of Phosphoenolpyruvate (PEP)","Acta Crystallographica Section C","1996","52","1","97","101","10.1107/S0108270195009802","","","0.71069","MoKα","","0.0696","0.038","","0.1186","0.1017","","","","1.051","1.092","1.092","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004410","15.275","0.002","9.588","0.004","17.717","0.002","90","","106.78","0.01","90","","2484.3","1.1","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 N Ni S8 -","- C20 H22 N Ni S8 -","- C80 H88 N4 Ni4 S32 -","4","1","MU1192","Zuo, J.-L.; Xiong, R.-G.; You, X.-Z.; Huang, X.-Y.","<i>N</i>-Methylquinolinium Bis(6,7-dihydro-5<i>H</i>-1,4-dithiepine-2,3-dithiolato)nickelate(III)","Acta Crystallographica Section C","1996","52","1","46","48","10.1107/S0108270195009838","","","0.71069","MoKα","","","0.056","","","0.068","","","","","1.78","1.78","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004411","20.96","0.013","13.809","0.013","14.503","0.008","90","","94.151","0.014","90","","4187","5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","mer-Bis[2,6-bis(1-phenyliminoethylpyridine)-N,N',N""]copper(II) diperchlorate","","- C42 H38 Cl2 Cu N6 O8 -","- C42 H38 Cl2 Cu N6 O8 -","- C168 H152 Cl8 Cu4 N24 O32 -","4","1","MU1197","Blake, A. J.; Lavery, A. J.; Schröder, M.","<i>mer</i>-Bis[2,6-bis(1-phenyliminoethyl)pyridine-<i>N</i>,<i>N</i>',<i>N</i>'']copper(II) Diperchlorate","Acta Crystallographica Section C","1996","52","1","37","39","10.1107/S0108270195009851","","","0.71073","MoKα","","0.219","0.0943","","0.2258","0.171","","","","0.894","1.288","1.288","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2004412","4.5834","0.0005","11.6598","0.0008","12.0208","0.0009","65.239","0.006","84.621","0.008","89.296","0.008","580.52","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","S-methyl β-N-(4-methoxyphenyl)methylendithiocarbazate","","- C10 H12 N2 O S2 -","- C10 H12 N2 O S2 -","- C20 H24 N4 O2 S4 -","2","1","MU1198","Fun, H.-K.; Yip, B.-C.; Tian, Y.-P.; Duan, C.-Y.; Lu, Z.-L.; You, X.-Z.","Methyl 3-(4-Methoxyphenylmethylene)dithiocarbazate","Acta Crystallographica Section C","1996","52","1","87","89","10.1107/S0108270195009899","","","0.71073","MoKα","","0.0494","0.0326","","0.0869","0.0817","","","","0.925","1.037","1.037","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004413","10.888","0.001","9.381","0.001","26.597","0.003","90","","90","","90","","2716.6","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,3-dibenzylthiourea.","","- C15 H16 N2 S -","- C15 H16 N2 S -","- C120 H128 N16 S8 -","8","1","MU1200","Ramnathan, A.; Sivakumar, K.; Subramanian, K.; Meerarani, D.; Ramadas, K.; Fun, H.-K.","1,3-Dibenzylthiourea and 1,3-Dicyclohexylthiourea","Acta Crystallographica Section C","1996","52","1","139","142","10.1107/S0108270195009875","","","0.71073","MoKα","","0.0537","0.0395","","0.114","0.1064","","","","1.032","1.117","1.117","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004414","12.611","0.002","11.224","0.001","10.435","0.001","90","","110.7","0.01","90","","1381.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-dicyclohexyl thiourea.","","- C13 H24 N2 S -","- C13 H24 N2 S -","- C52 H96 N8 S4 -","4","1","MU1200","Ramnathan, A.; Sivakumar, K.; Subramanian, K.; Meerarani, D.; Ramadas, K.; Fun, H.-K.","1,3-Dibenzylthiourea and 1,3-Dicyclohexylthiourea","Acta Crystallographica Section C","1996","52","1","139","142","10.1107/S0108270195009875","","","0.71073","MoKα","","0.0613","0.0367","","0.0919","0.0853","","","","0.897","1.039","1.039","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004415","31.26","0.03","7.5","0.011","15.79","0.014","90","","99.78","0.07","90","","3648","7","150","0.2","150","0.2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-(4-n-heptylbenzoyloxy)benzoic acid","","- C21 H24 O4 -","- C21 H23 O4 -","- C168 H184 O32 -","8","2","MU1202","Blake, A. J.; Fallis, I. A.; Parsons, S.; Schröder, M.; Bruce, D. W.","4-(4-<i>n</i>-Heptylbenzoyloxy)benzoic Acid","Acta Crystallographica Section C","1996","52","1","194","197","10.1107/S0108270195009863","","","0.71073","MoKα","","0.2666","0.1078","","0.35","0.2345","","","","1.051","1.422","1.422","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2004416","9.812","0.009","5.038","0.003","7.778","0.007","90","","111.95","0.09","90","","356.6","0.6","80","2","80","2","","","","","","","","5","P 1 21 1","P 2yb","4","","disodium D-3-phosphoglycerate","","- C3 H5 Na2 O7 P -","- C3 H5 Na2 O7 P -","- C6 H10 Na4 O14 P2 -","2","1","MU1203","Lis, T.; Jerzykiewicz, L. B.","Disodium <small>D</small>-3-Phosphoglycerate (a Reinvestigation at 80 K) and Bis(cyclohexylammonium) <small>D</small>-3-Phosphoglycerate Dihydrate at 85 K","Acta Crystallographica Section C","1996","52","1","129","134","10.1107/S0108270195009905","","","0.71069","MoKα","","0.0235","0.0205","","0.0569","0.055","","","","1.077","1.067","1.067","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004417","12.427","0.005","6.556","0.003","13.085","0.005","90","","94.64","0.06","90","","1062.6","0.8","85","2","85","2","","","","","","","","5","P 1 21 1","P 2yb","4","","bis(cyclohexylammonium) D-3-phosphoglycerate dihydrate","","- C15 H37 N2 O9 P -","- C15 H37 N2 O9 P -","- C30 H74 N4 O18 P2 -","2","1","MU1203","Lis, T.; Jerzykiewicz, L. B.","Disodium <small>D</small>-3-Phosphoglycerate (a Reinvestigation at 80 K) and Bis(cyclohexylammonium) <small>D</small>-3-Phosphoglycerate Dihydrate at 85 K","Acta Crystallographica Section C","1996","52","1","129","134","10.1107/S0108270195009905","","","0.71069","MoKα","","0.0494","0.0295","","0.0764","0.0699","","","","","1.094","1.094","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004418","34.138","0.013","7.3857","0.0011","6.072","0.007","90","","123.04","0.03","90","","1283.4","1.6","295","","295","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-Didecyloxybenzene","","- C26 H46 O2 -","- C26 H46 O2 -","- C52 H92 O4 -","2","0.5","MU1205","Kooijman, H.; Spek, A. L.; Keegstra, E. M. D.; Zwikker, J. W.; Jenneskens, L. W.","Attractive Edge‒Face Arene‒Arene Interactions in Combination with Close Packing of Alkoxy Chains for 1,4-Didecyloxybenzene","Acta Crystallographica Section C","1996","52","1","85","87","10.1107/S0108270195010766","","","1.54184","CuKα","","","0.0681","","0.136","0.136","","","","1.823","1.823","1.823","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004419","13.224","0.002","10.058","0.001","17.423","0.002","90","","90","","90","","2317.4","0.5","293","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C26 H16 Cu N6 S2 -","- C26 H16 Cu N6 S2 -","- C104 H64 Cu4 N24 S8 -","4","0.5","MU1208","Parker, O. J.; Aubol, S. L.; Breneman, G. L.","<i>cis</i>-Diisothiocyanatobis(1,10-phenanthroline)copper(II), [Cu(NCS)~2~(C~12~H~8~N~2~)~2~]","Acta Crystallographica Section C","1996","52","1","39","41","10.1107/S0108270195009887","","","0.71073","MoKα","","","0.04","","","0.07","","","","","2.48","2.48","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004420","19.929","0.004","10.855","0.003","18.334","0.004","90","","117.28","0.03","90","","3525.1","1.7","293","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H21 Cl Co N5 O4 -","- C14 H19 Cl Co N5 O4 -","- C112 H152 Cl8 Co8 N40 O32 -","8","2","NA1144","Solans, X.; Font-Bardia, M.; López, C.; Alvarez, S.","Anhydrous <i>trans</i>-(Aniline)chlorobis(dimethylglyoximato)cobalt(III)","Acta Crystallographica Section C","1996","52","1","63","66","10.1107/S0108270195009644","","","0.71069","MoKα","","","0.041","","","0.095","","","","","0.936","0.936","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2004421","15.51","0.01","15.178","0.005","25.66","0.03","90","","106.9","0.1","90","","5780","9","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-(tris{μ-2,5-bis[2-(2'-pyridyl)- ethynyl]thiophene-N,N'-dinitratocobalt(II)})","","- C54 H30 Co3 N12 O18 S3 -","- C54 H30 Co3 N12 O18 S3 -","- C216 H120 Co12 N48 O72 S12 -","4","1","NA1163","Driessen, W. L.; Neenan, T. X.","<i>catena</i>-Poly[dinitratocobalt(II)-μ-2,5-bis{2-(2-pyridyl)ethynyl}thiophene-<i>N</i>:<i>N</i>'], [Co(NO~3~)~2~(C~18~H~10~N~2~S)]~3~","Acta Crystallographica Section C","1996","52","1","59","61","10.1107/S0108270195008535","","","0.71073","MoKα","","0.165","0.06","","0.064","0.056","","","","1.617","2.271","2.271","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004422","3.979","0.001","10.8","0.002","18.713","0.005","90","","90.71","0.03","90","","804.1","0.3","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H9 N O3 -","- C8 H9 N O3 -","- C32 H36 N4 O12 -","4","1","NA1176","Carugo, O.; Charalambous, J.; Raghvani, D. V.; Sardone, N.","5-Ethoxy-1,2-benzoquinone 2-Oxime","Acta Crystallographica Section C","1996","52","1","153","155","10.1107/S0108270195007141","","","1.54184","CuKα","","","0.066","","","0.057","","","","","0.981","0.981","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004423","7.524","0.002","14.819","0.003","11.763","0.002","90","","107.26","0.03","90","","1252.5","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Methyl 21-acetoxy-11β-hydroxy-1,4-pregnadiene-(22S)-16α,17α-orthoacetate","","- C26 H34 O8 -","- C26 H34 O8 -","- C52 H68 O16 -","2","1","NA1177","Pniewska, B.; Anulewicz, R.; Uszycka-Horawa, T.","(22<i>S</i>)-21-Acetoxy-11β-hydroxy-16α,17α-methylorthoacetoxypregna-1,4-diene-3,20-dione","Acta Crystallographica Section C","1996","52","1","212","215","10.1107/S0108270195009589","","","1.54178","CuKα","","0.0514","0.0475","","0.1355","0.132","","","","1.052","1.067","1.067","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004424","5.916","0.001","13.112","0.003","20.253","0.004","90","","90","","90","","1571","0.5","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(Z)-N-[(2S)-2-(tert-butoxycarbonylamino)propylidene]benzylamine N-oxide","","- C15 H22 N2 O3 -","- C15 H22 N2 O3 -","- C60 H88 N8 O12 -","4","1","NA1197","Merino, P.; Merchan, F. L.; Tejero, T.; Lanaspa, A.","Structures of Chiral Nitrones. II. (<i>Z</i>)-<i>N</i>-[(2<i>S</i>)-2-(<i>tert</i>-Butoxycarbonylamino)propylidene]benzylamine <i>N</i>-Oxide","Acta Crystallographica Section C","1996","52","1","218","219","10.1107/S0108270195009358","","","0.71073","MoKα","","0.0524","0.0416","","0.1078","0.0999","","","","1.07","1.078","1.078","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004425","6.199","0.003","6.199","0.003","19.859","0.006","90","","90","","120","","660.9","0.5","293","","","","","","","","","","","3","P -6 c 2","P -6c 2","188","","","","- Dy O19 Ta7 -","- Dy0.1667 O14.8332 Ta6.1667 -","- Dy0.3334 O29.6664 Ta12.3334 -","2","0.166667","OH1087","Guo, G.-C.; Zhuang, J.-N.; Wang, Y.-G.; Chen, J.-T.; Zhuang, H.-H.; Huang, J.-S.; Zhang, Q.-E.","Dysprosium Tantalum Oxide, DyTa~7~O~19~","Acta Crystallographica Section C","1996","52","1","5","7","10.1107/S0108270195010353","","","0.71069","MoKα","","","0.0471","","","0.0548","","","","","1.23","1.23","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004426","6.798","0.004","13.675","0.008","9.722","0.007","90","","99.72","0.04","90","","890.8","1","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H19 N O -","- C22 H19 N O -","- C44 H38 N2 O2 -","2","1","PA1165","Mousser, A.; Badeche, S.; Merazig, H.; Benhaoua, H.; Ait Sidhoum, D.","<i>N</i>-Benzyl-3,4-diphenyl-2-azetidinone","Acta Crystallographica Section C","1996","52","1","201","203","10.1107/S0108270195004598","","","1.54184","CuKα","","","0.068","","","0.078","","","","","1.448","1.448","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004427","8.818","0.002","10.875","0.001","12.023","0.002","110.45","0.01","92.53","0.02","107.3","0.01","1017.2","0.3","293","","293","","","","","","","","","5","P 1","P 1","1","","7,10,19,22-Tetraoxa-4,13-diaza[16.8^4,13^](9,10) anthracenophane, (HClO~4~)~2~,C~6~H~5~CH~3~","","- C39 H54 Cl2 N2 O12 -","- C39 H52 Cl2 N2 O12 -","- C39 H52 Cl2 N2 O12 -","1","1","PA1177","Lahrahar, N.; Marsau, P.; Bouas-Laurent, H.; Desvergne, J.-P.; Fages, F.","Molecular, Crystal Structure and Fluorescence Emission Properties of Diprotonated 7,10,19,22-Tetraoxa-4,13-diaza[16.8^4,13^](9,10)anthracenophane (<i>A</i>~33~.2H^+^)","Acta Crystallographica Section C","1996","52","1","113","116","10.1107/S0108270195007979","","","1.54178","CuKα","","","0.06","","","0.048","","","","","1.47","1.47","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004428","23.093","0.009","25.688","0.01","6.05","0.002","90","","97.16","0.04","90","","3561","2","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","1-{[4-(4-bromophényl)]-3-butène-2-one-1-yl}-2-{[3-(2,6,6-triméthyl-1- cyclohexène-1-yl)]-2-propène-1-one-1-yl}-3-[(4-bromophényl)-1-yl]- 1,2,3,4,5,6,7,8-octahydro-8,8-diméthyl-naphtalène","","- C40 H46 Br2 O2 -","- C40 H46 Br2 O2 -","- C160 H184 Br8 O8 -","4","1","PA1183","Ginderow, D.","3-(4-Bromophényl)-1-[4-(4-bromophényl)-3-butène-2-one-1-yl]-2-[3-(2,6,6-triméthyl-1-cyclohexène-1-yl)-2-propène-1-one-1-yl]-1,2,3,4,5,6,7,8-octahydro-8,8-diméthylnaphtalène","Acta Crystallographica Section C","1996","52","1","256","259","10.1107/S0108270195008985","","","1.5418","CuKα","","0.0704","0.0517","","0.1694","0.1452","","","","1.083","1.083","1.083","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004429","12.661","0.003","16.54","0.005","9.677","0.002","90","","101.57","0.02","90","","1985.3","0.9","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H29 N O -","- C24 H29 N O -","- C96 H116 N4 O4 -","4","1","PA1188","Nogue, D.; Paugam, R.; Wartski, L.; Nierlich, M.; Vigner, D.; Lance, M.","Two <i>cis</i> Ring-Fused <i>exo</i> <i>N</i>-Aryl Heterocycles: 1-Phenyl-2-(2,4,6-trimethylphenyl)decahydroquinolin-4-one and 1-(4-Trifluoromethylphenyl)-2-phenyldecahydroquinolin-4-one","Acta Crystallographica Section C","1996","52","1","207","210","10.1107/S0108270195009036","","","0.71073","MoKα","","","0.057","","","0.056","","","","","1.34","1.34","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004430","7.15","0.001","12.214","0.002","10.944","0.001","90","","101.2","0.01","90","","937.5","0.2","294","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H22 F3 N O -","- C22 H22 F3 N O -","- C44 H44 F6 N2 O2 -","2","1","PA1188","Nogue, D.; Paugam, R.; Wartski, L.; Nierlich, M.; Vigner, D.; Lance, M.","Two <i>cis</i> Ring-Fused <i>exo</i> <i>N</i>-Aryl Heterocycles: 1-Phenyl-2-(2,4,6-trimethylphenyl)decahydroquinolin-4-one and 1-(4-Trifluoromethylphenyl)-2-phenyldecahydroquinolin-4-one","Acta Crystallographica Section C","1996","52","1","207","210","10.1107/S0108270195009036","","","0.71073","MoKα","","","0.059","","","0.061","","","","","0.87","0.87","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004431","6.547","0.002","7.057","0.003","9.687","0.004","107.48","0.03","102.07","0.03","102.23","0.03","398.9","0.3","155","","","","","","","","","","","3","P -1","-P 1","2","","","","- C10 H6 O3 -","- C10 H6 O3 -","- C20 H12 O6 -","2","1","PT1002","Thomson, M. A.; Kar, M.; Anderson, O. P.; Lenz, T. G.; Vaughan, J. D.","2-Phenylmaleic Anhydride","Acta Crystallographica Section C","1996","52","1","168","169","10.1107/S0108270195009620","","","0.71073","MoKα","","","0.049","","","0.074","","","","","1.207","1.207","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004432","5.774","0.001","40.748","0.006","10.648","0.001","90","","99.053","0.009","90","","2474","0.6","297","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 O3 -","- C14 H16 O3 -","- C112 H128 O24 -","8","2","PT1013","Lalancette, R. A.; Coté, M. L.; Thompson, H. W.","(±)-<i>trans</i>-2-Benzoylcyclohexanecarboxylic Acid. Structure and Hydrogen-Bonding Pattern of a γ-Keto Acid","Acta Crystallographica Section C","1996","52","1","244","246","10.1107/S0108270195010407","","","0.71073","MoKα","","","0.0531","","","0.063","","","","","1.56","1.56","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004433","20.48","0.004","10.952","0.002","12.931","0.003","90","","117.58","0.03","90","","2570.8","1.2","293","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H32 Br4 N6 O -","- C18 H32 Br4 N6 O -","- C72 H128 Br16 N24 O4 -","4","0.5","PT1017","Nieslanik, B.; Duesler, E. N.; Miao, L.; Jackels, S. C.; Paine, R. T.","Pyo~2~[18]diene-N~6~.4HBr.H~2~O","Acta Crystallographica Section C","1996","52","1","205","207","10.1107/S0108270195009632","","","0.71073","MoKα","","","0.0596","","","0.0582","","","","","0.99","0.99","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004434","9.375","0.005","20.676","0.005","8.866","0.005","90","","90","","90","","1718.6","1.4","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,2:3,4-Di-O-isopropylidene-6-O-methacryloyl-a-D-galactopyranose","","- C16 H24 O7 -","- C16 H24 O7 -","- C64 H96 O28 -","4","1","SX1002","Ojala, W. H.; Gleason, W. B.; Connelly, M. P. E.; Wallis, R. R.; Kremer, J. J.","Polymerizable Methacrylate Carbohydrate Derivatives: 1,2:3,4-Di-<i>O</i>-isopropylidene-6-<i>O</i>-methacryloyl-α-<small>D</small>-galactopyranose and 1,2:5,6-Di-<i>O</i>-isopropylidene-3-<i>O</i>-methacryloyl-α-<small>D</small>-glucofuranose","Acta Crystallographica Section C","1996","52","1","155","158","10.1107/S0108270195009991","","","1.54178","CuKα","","0.0868","0.0406","","0.1239","0.1032","","","","1.026","1.079","1.079","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004435","7.275","0.002","8.945","0.002","13.486","0.002","90","","97.148","0.015","90","","870.8","0.3","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","1,2:5,6-di-O-isopropylidene-3-O-methacryloyl-a-D-glucofuranose","","- C16 H24 O7 -","- C16 H24 O7 -","- C32 H48 O14 -","2","1","SX1002","Ojala, W. H.; Gleason, W. B.; Connelly, M. P. E.; Wallis, R. R.; Kremer, J. J.","Polymerizable Methacrylate Carbohydrate Derivatives: 1,2:3,4-Di-<i>O</i>-isopropylidene-6-<i>O</i>-methacryloyl-α-<small>D</small>-galactopyranose and 1,2:5,6-Di-<i>O</i>-isopropylidene-3-<i>O</i>-methacryloyl-α-<small>D</small>-glucofuranose","Acta Crystallographica Section C","1996","52","1","155","158","10.1107/S0108270195009991","","","1.54178","CuKα","","0.0414","0.0364","","0.1043","0.0949","","","","1.071","1.022","1.022","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004436","7.121","0.004","35.583","0.007","5.238","0.004","90","","90","","90","","1327.2","1.3","296","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H19 N O5 -","- C13 H14 N O5 -","- C52 H56 N4 O20 -","4","1","SZ1005","Gomez de Anderez, D.; Gil, H.; Helliwell, M.; Mata Segreda, J.","<i>N</i>-(<i>p</i>-Tolyl)-amine-1-<small>D</small>-fructose from a Small Crystal","Acta Crystallographica Section C","1996","52","1","252","254","10.1107/S0108270195011255","","","1.54178","CuKα","","","0.091","","","0.095","","","","","2.44","2.44","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004437","9.851","0.001","10.563","0.002","12.933","0.003","90","","90","","90","","1345.8","0.4","292","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H20 O4 -","- C15 H20 O4 -","- C60 H80 O16 -","4","1","SZ1016","De Simone, C. A.; Goulart, M. O. F.; Pereira, M. A.; Zukerman-Schpector, J.","Emmotin 2: (2<i>R</i>,3<i>S</i>)-2,6-Dihydroxy-3-(1-hydroxy-1-methylethyl)-8-methyl-1,2,3,4-tetrahydronaphthalene-5-carbaldehyde","Acta Crystallographica Section C","1996","52","1","117","118","10.1107/S0108270195010158","","","0.71073","MoKα","","","0.0452","","","0.0493","","","","","1.41","1.41","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004438","9.411","0.002","14.457","0.003","7.853","0.002","90","","105.95","0.03","90","","1027.3","0.4","297","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H13 N O5 -","- C8 H13 N O5 -","- C32 H52 N4 O20 -","4","1","SZ1021","Prayzner, P.; Ojadi, E. C. A.; Golen, J. A.; Williard, P. G.","<i>N</i>-Acetyliminodiacetate Dimethyl Ester","Acta Crystallographica Section C","1996","52","1","112","113","10.1107/S0108270195010225","","","0.71073","MoKα","","","0.0536","","","0.0603","","","","","1.51","1.51","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004439","9.83","0.002","9.239","0.002","19.654","0.002","90","0.01","96.11","0.01","90","0.01","1774.8","0.6","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","1-trityl-4-nitroimidazole","","- C22 H17 N3 O2 -","- C22 H17 N3 O2 -","- C88 H68 N12 O8 -","4","1","SZ1038","Skrzypczak-Jankun, E.; Kurumbail, R. G.","1-Trityl-4-nitroimidazole","Acta Crystallographica Section C","1996","52","1","189","191","10.1107/S0108270195010183","","","0.71073","MoKα","","0.065","0.039","","","0.054","","","","","1.8","1.8","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2004440","7.3972","0.0003","9.7969","0.0006","13.3883","0.0008","95.405","0.005","96.186","0.004","91.666","0.004","959.55","0.09","293","","293","","","","","","","","","3","P -1","-P 1","2","","Methyl(10E)-trans-bicyclo[12.3.0]heptadeca-7-ylidene-10-methyl- 10-ene-4,17-dione-1-carboxylate","","- C21 H30 O4 -","- C21 H30 O4 -","- C42 H60 O8 -","2","1","SZ1039","Drouin, M.; Berthiaume, G.; Deslongchamps, P.","14-Membered Macrocycles: Methyl <i>trans</i>-(10<i>E</i>)-5-Methyl-8-methylene-11,15-dioxobicyclo[12.3.0]heptadec-4-ene-14-carboxylate, (I), and Methyl <i>trans</i>-(2<i>E</i>,10<i>E</i>)-10-Methyl-7-methylene-4,17-dioxobicyclo[12.3.0]heptadeca-2,10-diene-1-carboxylate, (II)","Acta Crystallographica Section C","1996","52","1","107","110","10.1107/S0108270195010092","","","0.7093","MolybdenumKα~1~","","0.047","0.037","","0.062","0.06","","","","","1.68","1.68","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004441","9.5791","0.0013","9.883","0.003","12.2588","0.0012","73.344","0.017","68.083","0.017","64.29","0.018","959.2","0.4","293","","293","","","","","","","","","3","P -1","-P 1","2","","Methyl(2E,10E)-trans-bicyclo[12.3.0]heptadeca-7-ylidene-10-methyl-2,10-diene- 4,17-dione-1-carboxylate.","","- C21 H28 O4 -","- C21 H28 O4 -","- C42 H56 O8 -","2","1","SZ1039","Drouin, M.; Berthiaume, G.; Deslongchamps, P.","14-Membered Macrocycles: Methyl <i>trans</i>-(10<i>E</i>)-5-Methyl-8-methylene-11,15-dioxobicyclo[12.3.0]heptadec-4-ene-14-carboxylate, (I), and Methyl <i>trans</i>-(2<i>E</i>,10<i>E</i>)-10-Methyl-7-methylene-4,17-dioxobicyclo[12.3.0]heptadeca-2,10-diene-1-carboxylate, (II)","Acta Crystallographica Section C","1996","52","1","107","110","10.1107/S0108270195010092","","","0.7093","MolybdenumKα~1~","","0.091","0.073","","0.084","0.083","","","","","4.83","4.83","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004442","20.155","0.006","12.151","0.002","22.026","0.004","90","","99.81","0.02","90","","5315","2","298","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H21 Cl3 I4 N6 S18 Tl -","- C34 Cl4 I4 N6 S18 Tl -","- C136 Cl16 I16 N24 S72 Tl4 -","4","1","SZ1040","Geiser, U.; Schlueter, J. A.; Kini, A. M.; Achenbach, C. A.; Komosa, A. S.; Williams, J. M.","3,4-Pyrazino-3',4'-ethylenedithio-2,2',5,5'-tetrathiafulvalenium Tetraiodothallate(III) Solvate (3:1) with 1,1,2-Trichloroethane, (PEDT‒TTF)~3~TlI~4~.TCE","Acta Crystallographica Section C","1996","52","1","159","162","10.1107/S0108270195010079","","","0.7107","MoKα","","","0.07","","","0.051","","","","","1.77","1.77","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004443","11.996","0.003","13.048","0.003","25.017","0.008","98.93","0.02","90.46","0.02","114","0.02","3522.9","1.8","230","2","230","2","","","","","","","","8","P -1","-P 1","2","Holmium carbons apart carborane cluster","","","- C44 H100 B8 Cl4 Ho2 Li2 N6 Si4 -","- C44 H100 B8 Cl4 Ho2 Li2 N6 Si4 -","- C88 H200 B16 Cl8 Ho4 Li4 N12 Si8 -","2","1","SZ1042","Zhang, H.; Wang, Y.; Maguire, J. A.; Hosmane, N. S.","A Dinuclear Holmium(III) `Carbons Apart' Carborane Cluster, [C~34~H~92~B~8~Cl~4~Ho~2~Li~2~N~6~Si~4~].C~10~H~8~","Acta Crystallographica Section C","1996","52","1","8","11","10.1107/S0108270195010110","","","0.71073","MoKα","","0.0592","0.0419","","0.1254","0.1042","","","","1.044","1.066","1.066","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004444","9.89","0.005","9.258","0.004","8.878","0.005","108.26","0.04","78.48","0.04","67.38","0.04","663.3","0.7","293","","","","","","","","","","","3","P -1","-P 1","2","","","","- C17 H14 O2 -","- C17 H14 O2 -","- C34 H28 O4 -","2","1","SZ1043","Selladurai, S.; Subramanian, K.; Lakshmi, S.; Chen, Y.-S.; Holt, E. J.; Narasinga Rao, S.","5-Methyl-3-(1-phenylethylidene)-2,3-dihydrobenzo[<i>b</i>]furan-2-one","Acta Crystallographica Section C","1996","52","1","94","95","10.1107/S0108270195010122","","","0.71073","MoKα","","","0.063","","","0.083","","","","","1.271","1.271","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004445","16.305","0.007","10.366","0.004","6.9","0.004","90","","90","","90","","1166.2","1","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(6SR,7RS,8SR)-7-methyl-8-phenyl-3-oxabicyclo[4.2.0]oct-1-en-8-ol","","- C14 H16 O2 -","- C14 H16 O2 -","- C56 H64 O8 -","4","1","SZ1044","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mercier-Girardot, S.; Caubère, P.","Structural Aspects of the Nucleophilic Attack of Ketone Enolate on Dehydrodihydropyran","Acta Crystallographica Section C","1996","52","1","237","244","10.1107/S0108270195010134","","","1.54056","CuKα","","0.064","0.0429","","0.134","0.0975","","","","1.28","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004446","11.031","0.002","8.3","0.001","6.625","0.001","102.37","0.01","93.66","0.01","98.31","0.01","583.44","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(1SR,2RS,8RS)8-methylthio-3-oxatricyclo[6.4.0.0^2,7^]dodec-6-en-1-ol","","- C12 H18 O2 S -","- C12 H18 O2 S -","- C24 H36 O4 S2 -","2","1","SZ1044","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mercier-Girardot, S.; Caubère, P.","Structural Aspects of the Nucleophilic Attack of Ketone Enolate on Dehydrodihydropyran","Acta Crystallographica Section C","1996","52","1","237","244","10.1107/S0108270195010134","","","1.54178","CuKα","","0.0375","0.0322","","0.1007","0.0899","","","","1.027","1.091","1.091","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004447","18.992","0.007","10.595","0.003","11.875","0.005","90","","90","","90","","2389.5","1.5","293","2","293","2","","","","","","","","3","P c a b","-P 2bc 2ac","61","","(1RS,2RS,6SR,7SR,8RS)8-methyl-3-oxatricyclo[6.4.0.0^2,7^]dodeca-1,6,7-triol","","- C12 H20 O4 -","- C12 H20 O4 -","- C96 H160 O32 -","8","1","SZ1044","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mercier-Girardot, S.; Caubère, P.","Structural Aspects of the Nucleophilic Attack of Ketone Enolate on Dehydrodihydropyran","Acta Crystallographica Section C","1996","52","1","237","244","10.1107/S0108270195010134","","","1.54178","CuKα","","0.1213","0.1071","","0.2212","0.21","","","","1.244","1.265","1.265","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004448","10.798","0.003","12.1","0.003","12.359","0.003","106.24","0.02","104.27","0.03","103.54","0.02","1420.6","0.7","294","","","","","","","","","","","3","P -1","-P 1","2","","","","- C18 H18 O2 -","- C18 H18 O2 -","- C72 H72 O8 -","4","2","SZ1046","Schaefer, W. P.; Henling, L. M.; McBay, H. C.; Abulū, J.","A Pinacol Precursor to a Chiral Spiro Compound","Acta Crystallographica Section C","1996","52","1","104","107","10.1107/S0108270195010213","","","0.71073","MoKα","","","","","","","","","","","1.38","1.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004449","6.982","0.001","8.106","0.006","8.389","0.001","106.75","0.04","108.51","0.04","97.3","0.03","418.4","0.4","133","2","133","2","","","","","","","","5","P -1","-P 1","2","3-Map","2-amino-3-methylpyridinium bromide monohydrate","","- C6 H11 Br N2 O -","- C6 H11 Br N2 O -","- C12 H22 Br2 N4 O2 -","2","1","TA1032","Coffey, T.; Robinson, W. T.; Turnbull, M. M.","2-Amino-3-methylpyridinium Bromide Monohydrate","Acta Crystallographica Section C","1996","52","1","248","250","10.1107/S0108270195011139","","","0.71073","MoKα","","0.0528","0.0428","","0.1279","0.1079","","","","0.998","1.013","1.013","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004450","6.042","0.002","13.688","0.003","10.904","0.003","90","0.02","99.13","0.03","90","0.02","890.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,4-dihydro-3-methyl-6-nitro-2H-1,3-benzoxazin-2-one","","- C9 H8 N2 O4 -","- C9 H8 N2 O4 -","- C36 H32 N8 O16 -","4","1","TA1035","Waters, J. M.; Kitson, T. M.","3,4-Dihydro-3-methyl-6-nitro-2<i>H</i>-1,3-benzoxazin-2-one and <i>p</i>-Nitrophenyl Dimethylcarbamate","Acta Crystallographica Section C","1996","52","1","101","104","10.1107/S0108270195010894","","","0.71073","MoKα","","0.1068","0.0421","","0.1683","0.1395","","","","1.08","1.227","1.227","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004451","11.207","0.002","12.195","0.001","7.3631","0.0009","90","0.01","90","0.01","90","0.01","1006.3","0.2","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","p-nitrophenyl dimethylcarbamate","","- C9 H10 N2 O4 -","- C9 H10 N2 O4 -","- C36 H40 N8 O16 -","4","1","TA1035","Waters, J. M.; Kitson, T. M.","3,4-Dihydro-3-methyl-6-nitro-2<i>H</i>-1,3-benzoxazin-2-one and <i>p</i>-Nitrophenyl Dimethylcarbamate","Acta Crystallographica Section C","1996","52","1","101","104","10.1107/S0108270195010894","","","0.71073","MoKα","","0.0865","0.0465","","0.165","0.1433","","","","1.106","1.24","1.24","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004452","22.939","0.001","6.574","0.002","16.481","0.002","90","","114.67","0.01","90","","2258.5","0.8","293","","","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C25 H26 O7 -","- C25 H26 O7 -","- C100 H104 O28 -","4","1","VJ1017","Sekar, K.; Parthasarathy, S.; Schenk, H.; Epe, B.; Mondon, A.","Tricoccin R2","Acta Crystallographica Section C","1996","52","1","92","94","10.1107/S0108270195007037","","","1.5418","CuKα","","","0.049","","","0.058","","","","","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004453","10.181","0.002","14.635","0.002","16.076","0.002","90","","90","","90","","2395.3","0.6","292","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C27 H34 O5 -","- C27 H34 O5 -","- C108 H136 O20 -","4","1","VJ1018","Sekar, K.; Parthasarathy, S.; Schenk, H.; Mondon, A.; Epe, B.","Tricoccin S~43~","Acta Crystallographica Section C","1996","52","1","110","112","10.1107/S0108270195001533","","","1.5418","CuKα","","","0.064","","","0.078","","","","","1.442","1.442","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004454","9.968","0.002","11.207","0.004","13.394","0.001","100.86","0.01","104.42","0.02","101.63","0.01","1373.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Terbutaline hemisulfate","5-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]-1,3-benzenediol hemisulfate.","","- C12 H20 N O5 S0.5 -","- C12 H20 N O5 S0.5 -","- C48 H80 N4 O20 S2 -","4","2","VJ1027","Sengupta, R.; Dattagupta, J. K.","A β-Adrenergic Agonist: Protonated Terbutaline Hemisulfate","Acta Crystallographica Section C","1996","52","1","162","164","10.1107/S0108270195011395","","","1.54178","CuKα","","0.0868","0.0623","","0.2858","0.2326","","","","0.856","0.863","0.863","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004455","9.708","0.002","14.039","0.001","26.302","0.002","90","","90","","90","","3584.7","0.8","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Oxymetazoline hydrochloride monohydrate","3-[(4,5-dihydro-1H-imidazole-2-yl)methyl]-6-(1,1-dimethylethyl) -2,4-dimethylphenol Hydrochloride monohydrate.","","- C16 H27 Cl N2 O2 -","- C16 H27 Cl N2 O2 -","- C128 H216 Cl8 N16 O16 -","8","1","VJ1028","Sengupta, R.; Dattagupta, J. K.","An α-Adrenergic Agonist: Protonated Oxymetazoline Hydrochloride Monohydrate","Acta Crystallographica Section C","1996","52","1","164","166","10.1107/S0108270195011401","","","1.54178","CuKα","","0.0828","0.0793","","0.223","0.2193","","","","1.105","1.131","1.131","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004456","14.452","0.003","13.089","0.003","17.558","0.003","90","","96.01","0.03","90","","3303.1","1.2","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H18 N4 O3 -","- C17 H18 N4 O3 -","- C136 H144 N32 O24 -","8","4","AB1224","Kelderman, E.; Verboom, W.; Engbersen, J. F. J.; Reinhoudt, D. N.; Harkema, S.","<i>trans</i>-(3a<i>R</i>)-1,2,3,3a-Tetrahydro-3a-(methoxymethyl)-5-methyl-7-nitropyrrolo[1,2-<i>a</i>]quinoline-4,4(5<i>H</i>)-dicarbonitrile: Four Independent Molecules in the Unit Cell","Acta Crystallographica Section C","1996","52","2","458","460","10.1107/S0108270195011863","","","0.71073","MoKα","","","0.052","","","0.061","","","","","2.14","2.14","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004457","10.22","0.001","10.22","","20.973","0.002","90","","90","","90","","2190.6","0.3","294.2","","294.2","","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C10 H28 Cl2 N2 O14 Pt -","- C10 H28 Cl2 N2 O14 Pt -","- C40 H112 Cl8 N8 O56 Pt4 -","4","0.5","AB1271","Whalen, J. T.; Chang, S.-C.; Norman, R. E.","Dichloro(ethylenediaminetetraacetic acid-<i>N</i>,<i>N</i>')platinum(II)‒Water (1/6)","Acta Crystallographica Section C","1996","52","2","297","300","10.1107/S0108270195009243","","","0.7107","MoKα","","","0.0416","","","0.0527","","","","","1.989","1.989","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2004458","13.847","0.002","12.2","0.001","15.981","0.002","90","","105.72","0.01","90","","2598.7","0.6","298","2","298","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","Mn(ω-nap)~2~ dipyridine adduct","bis(ω-nitroacetophenonato)Mn(II) cis-dipyridine adduct","","- C26 H22 Mn N4 O6 -","- C26 H22 Mn N4 O6 -","- C104 H88 Mn4 N16 O24 -","4","0.5","AB1273","Hicke, S.; Mueller, T. E.; Falvello, L. R.","<i>cis</i>-Dipyridine Complex of Bis(ω-nitroacetophenonato)manganese(II)","Acta Crystallographica Section C","1996","52","2","307","309","10.1107/S0108270195008304","","","0.71073","MoKα","","0.1301","0.0582","","0.1185","0.104","","","","1.054","1.202","1.202","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004459","6.795","0.005","6.929","0.005","7.457","0.004","91.96","0.05","102.13","0.05","118.82","0.06","297","0.4","300","","","","","","","","","","","5","P -1","-P 1","2","","","","- Cl4 H4 O4 Rb2 U -","- Cl4 H4 O4 Rb2 U -","- Cl4 H4 O4 Rb2 U -","1","0.5","AB1276","Anson, C. E.; Al-Jowder, O.; Jayasooriya, U. A.; Powell, A. K.","Dirubidium Tetrachlorodioxouranium(VI)‒Water (1:2)","Acta Crystallographica Section C","1996","52","2","279","281","10.1107/S0108270195011723","","","0.71069","MoKα","","","0.051","","","0.0507","","","","","2.79","2.79","","","","","has coordinates","189249","2020-10-21","18:00:00",""
"2004460","4.944","0.002","13.005","0.002","20.234","0.003","85.07","0.01","89.71","0.02","79.45","0.02","1274.2","0.6","122","2","122","2","","","","","","","","4","P -1","-P 1","2","N-acetyl-N,O-di(propylcarbamoyl)hydroxylamine","N-[(propylamino)carbonyl]-N-{[(propylamino)carbonyl]oxy}-acetamide.","","- C10 H19 N3 O4 -","- C10 H19 N3 O4 -","- C40 H76 N12 O16 -","4","2","AB1290","B. B. Nielsen; K. Frydenvang; I. K. Larsen","The Ribonucleotide Reductase R1 Inhibitor <i>N</i>-Acetyl-<i>N</i>,<i>O</i>-di(propylcarbamoyl)hydroxylamine, an Analogue of Caracemide","Acta Crystallographica Section C","1996","52","2","387","390","10.1107/S0108270195012236","","","0.71073","MoKα","","0.0826","0.0698","","0.1958","0.1755","","","","1.046","1.017","1.017","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004461","7.519","0.004","14.202","0.003","7.885","0.003","90","","109.26","0.04","90","","794.9","0.6","294","1","294","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-amino-4-methoxy-2-methylthiopyrimidine","","- C6 H9 N3 O S -","- C6 H9 N3 O S -","- C24 H36 N12 O4 S4 -","4","1","AB1323","Low, J. N.; Ferguson, G.; Godino, M. L.; Cobo, J.; Lopez, R.; Melguizo, M.; Nogueras, M.; Sanchez, A.","6-Amino-4-methoxy-2-methylthiopyrimidine","Acta Crystallographica Section C","1996","52","2","418","420","10.1107/S010827019501448X","","","0.7107","MolybdenumKα","","0.0872","0.0636","","0.1636","0.1533","","","","1.003","1.13","1.13","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004462","12.748","0.002","20.265","0.003","8.562","0.002","90","","90.38","0.01","90","","2211.8","0.7","293","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H48 N10 Na4 O31 P4 -","- C20 H48 N10 Na4 O31 P4 -","- C40 H96 N20 Na8 O62 P8 -","2","1","AS1187","Watanabe, D.; Ishikawa, M.; Yamasaki, M.; Ozaki, M.; Katayama, T.; Nakajima, H.","Tetrasodium <i>P</i>^1^,<i>P</i>^4^-Bis(5'-adenosyl)tetraphosphate Dodecahydrate","Acta Crystallographica Section C","1996","52","2","338","340","10.1107/S0108270195010419","","","1.54184","CuKα","","","0.036","","","0.054","","","","","1.28","1.28","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004463","7.679","0.002","5.891","0.001","14.8","0.003","90","","91.28","0.03","90","","669.3","0.2","298","","","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 -","- C18 H18 -","- C36 H36 -","2","0.5","AS1191","Lam, Y.-L.; Koh, L.-L.; Huang, H.-H.","1,1'-Diphenyl-1,1'-bicyclopropyl and 1,1'-Diphenyl-1,1'-bicyclobutyl","Acta Crystallographica Section C","1996","52","2","397","400","10.1107/S0108270195011929","","","0.71073","MoKα","","","0.0397","","","0.0473","","","","","1.24","1.24","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004464","11.2","0.01","7.627","0.007","17.56","0.01","90","","90","","90","","1500","2","298","","","","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- C20 H22 -","- C20 H22 -","- C80 H88 -","4","0.5","AS1191","Lam, Y.-L.; Koh, L.-L.; Huang, H.-H.","1,1'-Diphenyl-1,1'-bicyclopropyl and 1,1'-Diphenyl-1,1'-bicyclobutyl","Acta Crystallographica Section C","1996","52","2","397","400","10.1107/S0108270195011929","","","0.71073","MoKα","","","0.0354","","","0.0437","","","","","1.37","1.37","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004465","10.322","0.003","14.909","0.001","9.8059","0.0008","90","","109.48","0.01","90","","1422.7","0.4","293","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C18 H19 N O2 -","- C19 H20 N O2 -","- C76 H80 N4 O8 -","4","1","AS1204","Honda, T.; Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A.","Coumarin 106, C~18~H~19~NO~2~","Acta Crystallographica Section C","1996","52","2","364","365","10.1107/S0108270195010845","","","1.54184","CuKα","","","0.051","","","0.066","","","","","2.85","2.85","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004466","7.686","0.003","7.242","0.001","9.924","0.001","90","","98.31","0.02","90","","546.6","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2-bromo-5-(α-D-2-deoxyribofuranosyl)pyridine","","- C10 H12 Br N O3 -","- C10 H12 Br N O3 -","- C20 H24 Br2 N2 O6 -","2","1","AS1213","Neidle, S.; Capaldi, D. C.; Bernadette, J. V.; Reese, C. B.","The α-Pyridyl Nucleoside Analogue 2-Bromo-5-(2-deoxy-α-<small>D</small>-ribofuranosyl)pyridine","Acta Crystallographica Section C","1996","52","2","407","409","10.1107/S0108270195013060","","","0.7107","MoKα","","0.0446","0.0434","","0.1139","0.1132","","","","0.909","0.932","0.932","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004467","12.266","0.001","11.879","0.001","10.412","0.002","90","","93.76","0.01","90","","1513.8","0.3","297","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 N O4 -","- C19 H20 N O4 -","- C76 H80 N4 O16 -","4","1","AS1214","Honda, T.; Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A.","An Orange Form of Coumarin 314","Acta Crystallographica Section C","1996","52","2","395","397","10.1107/S010827019501239X","","","1.54184","CuKα","","","0.055","","","0.089","","","","","4.29","4.29","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004468","10.04","0.01","9.572","0.004","10.68","0.005","90","","98.16","0.06","90","","1016","1.2","296","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H11 N3 S -","- C11 H11 N3 S -","- C44 H44 N12 S4 -","4","1","AS1216","Kingsford-Adaboh, R.; Kashino, S.; Sasaki, K.; Rouf, A. S. S.; Hirota, T.","5-Amino-8-methyl-1,2-dihydrothieno(and furo)[2,3-<i>h</i>][1,6]naphthyridines","Acta Crystallographica Section C","1996","52","2","372","375","10.1107/S0108270195013035","","","0.71073","MoKα","","","0.038","","","0.031","","","","","1.49","1.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004469","9.975","0.005","9.695","0.005","10.145","0.009","90","","97.92","0.06","90","","971.7","1.1","297","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H11 N3 O -","- C11 H11 N3 O -","- C44 H44 N12 O4 -","4","1","AS1216","Kingsford-Adaboh, R.; Kashino, S.; Sasaki, K.; Rouf, A. S. S.; Hirota, T.","5-Amino-8-methyl-1,2-dihydrothieno(and furo)[2,3-<i>h</i>][1,6]naphthyridines","Acta Crystallographica Section C","1996","52","2","372","375","10.1107/S0108270195013035","","","0.71073","MoKα","","","0.038","","","0.036","","","","","1.87","1.87","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004470","10.631","0.002","10.84","0.002","11.08","0.002","90","","92.31","0.02","90","","1275.8","0.4","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 Ir N O S -","- C13 H12 Ir N O S -","- C52 H48 Ir4 N4 O4 S4 -","4","1","BK1135","Theron, M.; Purcell, W.; Basson, S. S.","(η^4^-Cycloocta-1,5-diene)(2-pyridinethiolato <i>N</i>-oxide-κ<i>O</i>,κ<i>S</i>)iridium(I)","Acta Crystallographica Section C","1996","52","2","336","338","10.1107/S0108270195008729","","","0.71073","MoKα","","","0.038","","","0.038","","","","","0.77","0.77","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004471","13.463","0.003","13.463","0.003","9.864","0.004","90","","90","","90","","1787.9","0.9","293","2","293","2","","","","","","","","5","I 4/m","-I 4","87","","Chloro-(5,10,15,20-Tetraphenylporphinato)manganese(III)","","- C44 H28 Cl Mn N4 -","- C44 H28 Cl Mn N4 -","- C88 H56 Cl2 Mn2 N8 -","2","0.125","BK1136","Cheng, B.; Scheidt, W. R.","Chloro(5,10,15,20-tetraphenylporphyrinato)manganese(III) with 4/<i>m</i> Symmetry","Acta Crystallographica Section C","1996","52","2","361","363","10.1107/S0108270195009371","","","0.71073","MoKα","","0.0713","0.0546","","0.1466","0.1293","","","","1.101","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004472","13.59","0.002","5.003","0.002","17.627","0.002","90","","108.26","0.01","90","","1138.1","0.5","173","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 F N O3 -","- C14 H10 F N O3 -","- C56 H40 F4 N4 O12 -","4","1","BK1161","Ojala, W. H.; Clemons, J. E.; Ojala, C. R.","2-(2-Fluorobenzoylamino)benzoic Acid","Acta Crystallographica Section C","1996","52","2","484","485","10.1107/S0108270195010560","","","1.54178","CuKα","","","0.034","","","0.037","","","","","2.12","2.12","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004473","15.379","0.001","19.324","0.001","3.915","0.001","90","","90","","90","","1163.5","0.3","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2-phenylquinoline-4-carboxylic acid","","","- C16 H11 N O2 -","- C16 H11 N O2 -","- C64 H44 N4 O8 -","4","1","BK1182","Blackburn, A. C.; Dobson, A. J.; Gerkin, R. E.","2-Phenylquinoline-4-carboxylic Acid","Acta Crystallographica Section C","1996","52","2","409","411","10.1107/S0108270195013217","","","0.71073","MoKα","","","0.034","","","0.04","","","","","1.42","1.42","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004474","40.302","0.004","40.302","0.004","40.302","0.004","90","","90","","90","","65461","11","130","2","130","2","","","","","","","","7","F d -3 :2","-F 2uv 2vw 3","203","none","[{μu~3~-gold(triphenylphosphine)}tris{μu-bis(diphenylphosphino)methane}- triplatinum] hexafluorphosphate/tetrafluroborate (0.75:0.25)","","- C93 H81 Au B0.25 F5.5 P7.75 Pt3 -","- C93 H81 Au B0.25 F5.51 P7.75 Pt3 -","- C2976 H2592 Au32 B8 F176.32 P248 Pt96 -","32","0.333333","BM1016","Muir, K. W.; Manojlovic-Muir, L.; Fullard, J.","The PF~6~^{-^}/BF~4~^{-^} Mixed Salt of the Cluster Cation [Pt~3~(μ~3~-AuPPh~3~)(μ-dppm)~3~]^+^, dppm = Ph~2~PCH~2~PPh~2~","Acta Crystallographica Section C","1996","52","2","295","297","10.1107/S0108270195007852","","","0.71073","MoKα","","0","0.0499","","0","0.1256","","","","0","1.086","1.086","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004475","9.53","0.01","8.31","0.01","12.39","0.01","90","","90","","90","","981.2","1.8","286","","288","","","","","","","","","5","C m c 21","C 2c -2","36","","trimethylammonium trichlorostannate(IV)","","- C3 H10 Cl3 N Sn -","- C3 H10 Cl3 N Sn -","- C12 H40 Cl12 N4 Sn4 -","4","0.5","BM1018","Halfpenny, J.","Trimethylammonium Trichlorostannate(II)","Acta Crystallographica Section C","1996","52","2","340","342","10.1107/S0108270195009668","","","0.71073","MoKα","","","0.031","","","0.031","","","","","0.906","0.906","","","","","has coordinates","198514","2020-10-21","18:00:00",""
"2004476","10.55","0.02","12.26","0.02","9.76","0.02","113.1","0.1","99.1","0.2","99","0.2","1113","4","295","1","295","1","","","","","","","","4","P -1","-P 1","2","","","","- C11 H11 N4 O2.5 -","- C11 H11 N4 O2.5 -","- C44 H44 N16 O10 -","4","2","BM1021","Capparelli, M. V.; Charris, J. E.; Domínguez, J. N.","5-(<i>p</i>-Anisidino)-4-cyano-2,3-dihydro-3-pyrazolone Hemihydrate, C~11~H~10~N~4~O~2~.0.5H~2~O","Acta Crystallographica Section C","1996","52","2","447","449","10.1107/S0108270195009206","","","0.71069","MoKα","","","0.0388","","","0.0389","","","","","1.574","1.574","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004477","8.433","0.002","12.987","0.006","7.743","0.003","98.92","0.04","98.9","0.03","105.53","0.03","789.8","0.6","296","","296","","","","","","","","","3","P -1","-P 1","2","C1TET-TTF","bis(methylthio)ethylenedithiotetrathiafulvalene","","- C10 H10 S8 -","- C10 H10 S8 -","- C20 H20 S16 -","2","1","BM1022","Zhang, B.; Li, Y.-L.; Han, H.-X.; Yang, J.-K.; Zhu, D.-B.; Maruyama, Y.-S.","Bis(methylthio)ethylenedithiotetrathiafulvalene","Acta Crystallographica Section C","1996","52","2","400","403","10.1107/S0108270195012832","","","0.71069","MolybdenumKα","","","0.06","","","0.081","","","","","2.06","2.06","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004478","15.273","0.005","9.931","0.007","19.1975","0.0015","90","","97.933","0.012","90","","2884","2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetraethylammonium Bis(isothiocyanato)triphenylstannate","","- C28 H35 N3 S2 Sn -","- C28 H35 N3 S2 Sn -","- C112 H140 N12 S8 Sn4 -","4","0.5","BM1025","Cox, P. J.; Wardell, J. L.","Tetraethylammonium Bis(isothiocyanato)triphenylstannate","Acta Crystallographica Section C","1996","52","2","317","319","10.1107/S0108270195009437","","","0.71069","MoKα","","0.0521","0.0466","","0.1109","0.1093","","","","1.032","1.081","1.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004479","10.269","0.004","19.958","0.003","15.066","0.003","90","","103.8","0.02","90","","2998.6","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N,N'-methylenedipyridinium cis-difluorotetrachloroosmate(IV)","","- C22 H24 Cl8 F4 N4 Os2 -","- C11 H12 Cl4 F2 N2 Os -","- C88 H96 Cl32 F16 N16 Os8 -","8","2","BM1027","Bruhn, C.; Preetz, W.","Dipyridiniomethane <i>cis</i>- and <i>trans</i>-Difluorotetrachloroosmate(IV), <i>cis</i>- and <i>trans</i>-[(C~5~H~5~N)~2~CH~2~][OsCl~4~F~2~]","Acta Crystallographica Section C","1996","52","2","321","325","10.1107/S0108270195010717","","","0.71069","MoKα","","0.0467","0.029","","0.0756","0.0642","","","","1.182","1.14","1.14","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004480","7.7562","0.0005","10.0127","0.0008","11.0057","0.0009","89.649","0.007","70.346","0.006","75.112","0.006","774.86","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","N,N'-methylenedipyridinium trans-difluorotetrachloroosmate(IV)","","- C11 H12 Cl4 F2 N2 Os -","- C11 H12 Cl4 F2 N2 Os -","- C22 H24 Cl8 F4 N4 Os2 -","2","1","BM1027","Bruhn, C.; Preetz, W.","Dipyridiniomethane <i>cis</i>- and <i>trans</i>-Difluorotetrachloroosmate(IV), <i>cis</i>- and <i>trans</i>-[(C~5~H~5~N)~2~CH~2~][OsCl~4~F~2~]","Acta Crystallographica Section C","1996","52","2","321","325","10.1107/S0108270195010717","","","0.71069","MoKα","","0.0231","0.0148","","0.0389","0.0343","","","","1.132","1.096","1.096","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004481","28.103","0.004","18.37","0.003","23.755","0.006","90","","123.58","0.01","90","","10217","4","293","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- C63 H56 Cl3 O4.5 S -","- C63 H55 Cl3 O4.5 S -","- C504 H440 Cl24 O36 S8 -","8","1","BR1035","Parvez, M.","A 5,18:9,14-Di-<i>o</i>-benzeno-6,17:7,16:8,15-trimethanobenzo[1'',2'':3,4;4'',5'':3',4']dicyclobuta[1,2-<i>b</i>:1',2'-<i>b</i>']dianthracene Derivative","Acta Crystallographica Section C","1996","52","2","444","447","10.1107/S0108270195009607","","","0.71069","MoKα","","","0.098","","","0.112","","","","","3.42","3.42","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004482","7.9268","0.0004","7.9268","0.0004","9.1025","0.0005","90","","90","","90","","571.95","0.05","298","","","","","","","","","","Synthetic","3","P -4 21 c","P -4 2n","114","","","Hydroromarchite","- H4 O8 Sn6 -","- O8 Sn6 -","- O16 Sn12 -","2","0.25","BR1120","Abrahams, I.; Grimes, S. M.; Johnston, S. R.; Knowles, J. C.","Tin(II) Oxyhydroxide by X-ray Powder Diffraction","Acta Crystallographica Section C","1996","52","2","286","288","10.1107/S0108270195012625","","","1.54184","CuKα","","","0.0332","","","0.0436","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:03",""
"2004483","9.004","0.001","9","0.001","12.963","0.002","85.25","0.01","85.55","0.01","82.45","0.01","1035.4","0.2","113","2","","","","","","","","","","3","P -1","-P 1","2","","","","- Cl10 Re6 Te4 -","- Cl10 Re6 Te4 -","- Cl20 Re12 Te8 -","2","1","BR1121","Mironov, Y. V.; Cody, J. A.; Ibers, J. A.","Hexachlorotetra-μ~3~-chloro-tetra-μ~3~-telluro-octohexarhenium(III)","Acta Crystallographica Section C","1996","52","2","281","283","10.1107/S0108270195013205","","","1.54056","CuKα~1~","","","0.0479","","","0.112","","","","","1.4","1.4","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004484","16.373","0.004","10.4066","0.0006","17.629","0.005","90","","90.101","0.014","90","","3003.8","1.1","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aquachlorotriphenyltin.3,4,7,8-tetramethyl-1,10-phenanthroline","","- C34 H33 Cl N2 O Sn -","- C34 H33 Cl N2 O Sn -","- C136 H132 Cl4 N8 O4 Sn4 -","4","1","CF1017","Ng, S. W.","A 1:1 Adduct of Aquachlorotriphenyltin with 3,4,7,8-Tetramethyl-1,10-phenanthroline","Acta Crystallographica Section C","1996","52","2","354","356","10.1107/S0108270195009498","","","0.71073","MoKα","","0.048","0.0319","","0.0814","0.073","","","","1.002","1.025","1.025","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004485","10.2784","0.0014","10.5411","0.0014","17.794","0.003","90","","101.332","0.011","90","","1890.3","0.5","294","1","294","1","","","","","","","","3","P 1 21 1","P 2yb","4","","Tris(4-methoxyphenyl)methanol","","- C22 H22 O4 -","- C22 H22 O4 -","- C88 H88 O16 -","4","2","CF1052","Ferguson, G.; Glidewell, C.; Patterson, I. L. J.","Tris(4-methoxyphenyl)methanol","Acta Crystallographica Section C","1996","52","2","420","423","10.1107/S0108270195013990","","","0.7107","MoKα","","0.0869","0.0407","","0.0979","0.0872","","","","0.927","1.141","1.141","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004486","7.7383","0.0017","15.098","0.002","22.515","0.005","90","","90","","90","","2630.5","0.9","295","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H45 Na O6 -","- C27 H46 Na O6 -","- C108 H184 Na4 O24 -","4","1","CR1178","Wahle, M. C.; Stowell, J. G.; Byrn, S. R.","Sodium 3α,7α,12α-Trihydroxy-5β-cholan-24-oate Ethanolate (Sodium Cholate Ethanolate)","Acta Crystallographica Section C","1996","52","2","325","328","10.1107/S0108270195009152","","","1.54184","CuKα","","","0.047","","","0.109","","","","","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004487","22.076","0.003","8.722","0.001","6.552","0.001","90","","90","","90","","1261.6","0.3","293","2","293","","","","","","","","","6","P c a 21","P 2c -2ac","29","C12 H7 Br Cl2 N2 O1","N-(4-bromophenyl)-5,6-dichloronicotinamide","","- C12 H7 Br Cl2 N2 O -","- C12 H7 Br Cl2 N2 O -","- C48 H28 Br4 Cl8 N8 O4 -","4","1","CR1196","Jethmalani, J. M.; Camp, A. G.; Soman, N. G.; Hawley, J. W.; Setliff, F. L.; Holt, E. M.","<i>N</i>-(4-Bromophenyl)-5,6-dichloronicotinamide and 6-Chloro-5-fluoro-<i>N</i>-(3-pyridyl)nicotinamide","Acta Crystallographica Section C","1996","52","2","438","441","10.1107/S0108270195012078","","","0.71073","MoKα","","0.157","0.049","","0.176","0.112","","","","0.731","0.951","0.951","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004488","7.995","0.002","12.483","0.002","11.32","0.002","90","","108.37","0.01","90","","1072.2","0.4","298","","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N-(3-pyridyl)-6-chloro-5-fluoronicotinamide","","- C11 H7 Cl F N3 O -","- C11 H7 Cl F N3 O -","- C44 H28 Cl4 F4 N12 O4 -","4","1","CR1196","Jethmalani, J. M.; Camp, A. G.; Soman, N. G.; Hawley, J. W.; Setliff, F. L.; Holt, E. M.","<i>N</i>-(4-Bromophenyl)-5,6-dichloronicotinamide and 6-Chloro-5-fluoro-<i>N</i>-(3-pyridyl)nicotinamide","Acta Crystallographica Section C","1996","52","2","438","441","10.1107/S0108270195012078","","","0.71073","MoKα","","0.0512","0.0398","","0.0671","0.0588","","","","","1.57","1.57","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004489","8.052","0.002","9.627","0.003","10.017","0.003","72.38","0.02","73.2","0.02","88.54","0.02","706.8","0.4","301","","301","","","","","","","","","3","P -1","-P 1","2","","dimethyl 2,2,6,6-tetramethyl-4-oxa-3,5-dioxoheptanedioate","","- C12 H18 O7 -","- C12 H18 O7 -","- C24 H36 O14 -","2","1","CR1201","Graham, J. E.; Bunce, R. A.; Holt, E. M.","Dimethyl 2,2,6,6-Tetramethyl-3,5-dioxo-4-oxaheptanedioate","Acta Crystallographica Section C","1996","52","2","436","438","10.1107/S0108270195012066","","","0.71073","MoKα","","0.0579","0.0406","","0.0602","0.0516","","","","","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004490","23.593","0.001","7.0418","0.0004","14.8968","0.0006","90","","117.422","0.004","90","","2196.8","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(o-phénylènediammonium) cyclo-Tétraphosphate Dihydrate","","- C12 H24 N4 O14 P4 -","- C12 H24 N4 O14 P4 -","- C48 H96 N16 O56 P16 -","4","0.5","DU1114","Soumhi, E. H.; Jouini, T.","Bis(<i>o</i>-phénylènediammonium) <i>cyclo</i>-Tétraphosphate Dihydrate","Acta Crystallographica Section C","1996","52","2","432","433","10.1107/S010827019500309X","","","0.71069","MoKα","","0.0477","0.0404","","0.1072","0.1027","","","","1.134","1.171","1.171","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2004491","15.204","0.002","6.1593","0.0005","5.3998","0.0004","90","","105.401","0.009","90","","487.51","0.09","293","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","potassium manganese(II) hydroxy-vanadate","","- H2 K2 Mn3 O10 V2 -","- H2 K2 Mn3 O10 V2 -","- H4 K4 Mn6 O20 V4 -","2","0.25","DU1128","Liao, J.-H.; Guyomard, D.; Piffard, Y.; Tournoux, M.","K~2~Mn~3~(OH)~2~(VO~4~)~2~, a New Two-Dimensional Potassium Manganese(II) Hydroxyvanadate","Acta Crystallographica Section C","1996","52","2","284","286","10.1107/S0108270195010559","","","0.71073","MoKα","","0.052","0.04","","0.048","0.046","","","","1.82","1.93","1.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004492","8.1678","0.0009","9.226","0.001","8.6395","0.0008","90","","109.678","0.008","90","","613.02","0.11","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","potassium manganese(II) polyvanadate","","- K2 Mn O12 V4 -","- K2 Mn O12 V4 -","- K4 Mn2 O24 V8 -","2","0.5","DU1131","Liao, J.-H.; Sigala, C.; Guyomard, D.; Piffard, Y.","K~2~Mn(VO~3~)~4~, a New Three-Dimensional Potassium Manganese(II) Polyvanadate","Acta Crystallographica Section C","1996","52","2","283","284","10.1107/S0108270195012509","","","0.71073","MoKα","","0.054","0.037","","0.039","0.034","","","","1.13","1.24","1.24","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004493","4.461","0.001","7.044","0.001","7.346","0.001","80.75","0.01","73.85","0.01","81.78","0.01","217.66","0.07","120","2","120","2","","","","","","","","2","P -1","-P 1","2","","Diphosphorus Tetraiodide","","- I4 P2 -","- I4 P2 -","- I4 P2 -","1","0.5","DU1134","Žák, Z.; Černík, M.","Diphosphorus Tetraiodide at 120K","Acta Crystallographica Section C","1996","52","2","290","291","10.1107/S0108270195012510","","","0.71073","MoKα","","0.0348","0.0316","","0.1045","0.0915","","","","1.212","1.234","1.234","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004494","14.13","0.003","13.071","0.006","14.831","0.003","90","","90.33","0.02","90","","2739.1","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexa(paraphénolammonium) cyclo-Hexaphosphate Octahydrate","","- C36 H64 N6 O32 P6 -","- C36 H64 N6 O32 P6 -","- C72 H128 N12 O64 P12 -","2","0.5","DU1139","Soumhi, E. H.; Jouini, T.","Hexa(<i>para</i>-phénolammonium) <i>cyclo</i>-Hexaphosphate Octahydrate","Acta Crystallographica Section C","1996","52","2","434","436","10.1107/S0108270195011528","","","0.71069","MoKα","","0.0593","0.0358","","0.1114","0.0808","","","","1.231","1.006","1.006","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004495","5.992","0.001","23.577","0.009","6.563","0.002","90","","104.35","0.02","90","","898.2","0.5","293","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Au Cl N6 P2 -","- C12 H24 Au Cl2 N6 P2 -","- C24 H48 Au2 Cl4 N12 P4 -","2","0.5","FG1043","Assefa, Z.; Staples, R. J.; Fackler, Jnr, J. P.","Bis(1,3,5-triaza-7-phosphaadamantane-<i>P</i>)gold(I) Chloride","Acta Crystallographica Section C","1996","52","2","305","307","10.1107/S0108270195008183","","","0.71073","MoKα","","","0.0585","","","0.1103","","","","","1.48","1.48","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004496","8.027","0.001","12.368","0.001","12.017","0.001","90","","102.55","0.01","90","","1164.5","0.2","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H36 Cd N6 S2 -","- C16 H36 Cd N6 S2 -","- C32 H72 Cd2 N12 S4 -","2","0.5","FG1048","Pariya, C.; Chaudhuri, N. R.; Seth, S.; Das, A.","Bis(<i>N</i>^1^-isopropyl-2-methylpropane-1,2-diamine)diisothiocyanatocadmium(II)","Acta Crystallographica Section C","1996","52","2","358","360","10.1107/S0108270195008195","","","1.5418","CuKα","","","0.05","","","0.059","","","","","1.086","1.086","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004497","10.856","0.003","15.051","0.002","10.407","0.002","97.3","0.02","103.21","0.02","96.04","0.02","1626.1","0.6","220","","220","","","","","","","","","7","P -1","-P 1","2","(±)-cis-dichloro{(isopropylamino)([1,1'-binaphthyl]-2,2'-dioxy)-phosphane} (triethylphosphine)platinum (II)","","","- C30 H37 Cl4 N O2 P2 Pt -","- C30 H37 Cl4 N O2 P2 Pt -","- C60 H74 Cl8 N2 O4 P4 Pt2 -","2","1","FG1071","Parvez, M.; Babu, R. P. K.; Krishnamurthy, S. S.","(±)-<i>cis</i>-Dichloro[<i>P</i>-(isopropylamino)dinaphtho[2,1-<i>d</i>:1',2'-<i>f</i>][1,3,2]dioxaphosphepine](triethylphosphine)platinum(II) Dichloromethane Solvate","Acta Crystallographica Section C","1996","52","2","333","336","10.1107/S010827019500922X","","","0.71069","MoKα","","","0.039","","","0.037","","","","","1.47","1.47","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004498","10.332","0.002","7.69","0.003","15.406","0.002","90","","92.77","0.01","90","","1222.6","0.6","295","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","Tetraphenylphosphonium tri-iodide","","","- C24 H20 I3 P -","- C24 H20 I3 P -","- C48 H40 I6 P2 -","2","0.5","FG1087","Parvez, M.; Wang, M.; Boorman, P. M.","Tetraphenylphosphonium Triiodide","Acta Crystallographica Section C","1996","52","2","377","378","10.1107/S0108270195010456","","","0.71069","MoKα","","","0.023","","","0.022","","","","","1.4","1.4","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004499","9.506","0.001","4.725","0.001","19.166","0.008","90","","91.79","0.01","90","","860.4","0.4","296","2","296","","","","","","","","","5","P 1 21 1","P 2yb","4","iodoindomethacin","1-(4-iodobenzoyl)-5-methoxy-2-methylindole-3-acetic acid","","- C19 H16 I N O4 -","- C19 H16 I N O4 -","- C38 H32 I2 N2 O8 -","2","1","FG1089","Loll, P. J.; Garavito, R. M.; Carrell, C. J.; Carrell, H. L.","1-(4-Iodobenzoyl)-5-methoxy-2-methyl-3-indoleacetic Acid, an Iodinated Indomethacin Analog","Acta Crystallographica Section C","1996","52","2","455","457","10.1107/S0108270195010468","","","0.71073","MoKα","","0.0482","0.0335","","0.0813","0.0786","","","","1.003","1.11","1.11","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004500","6.855","0.002","7.606","0.002","13.587","0.003","75.01","0.02","87.88","0.02","70.56","0.02","644.4","0.3","295","1.5","","","","","","","","","","4","P -1","-P 1","2","","","","- C10 H4 N2 S6 -","- C10 H4 N2 S6 -","- C20 H8 N4 S12 -","2","1","HU1079","Zhong, Z. J.; You, X.-Z.; Yu, K.","4,5-Dicyano-4',5'-ethylenedithiotetrathiafulvalene (CNET): a New Unsymmetrical TTF Derivative","Acta Crystallographica Section C","1996","52","2","449","451","10.1107/S0108270195009942","","","0.71073","MoKα","","","0.0367","","","0.035","","","","","1.433","1.433","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2004501","5.189","0.001","5.886","0.001","16.223","0.003","90","","91.06","0.03","90","","495.41","0.16","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-furancarboxylic acid","","- C5 H4 O3 -","- C5 H4 O3 -","- C20 H16 O12 -","4","1","JZ1035","Paluchowska, B.; Maurin, J. K.; Leciejewicz, J.","The Role of C—H···O Bonds in Stabilizing 3-Furancarboxylic Acid and its Complexes with Calcium and Strontium","Acta Crystallographica Section C","1996","52","2","342","347","10.1107/S0108270195003246","","","1.54178","CuKα","","0.0342","0.0342","","0.092","0.092","","","","1.118","1.118","1.118","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004502","7.108","0.001","29.295","0.006","6.565","0.001","90","","91.88","0.03","90","","1366.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-(Triaqua-(3-furancarboxylato)calcium 3-furancarboxylate)","","- C10 H12 Ca O9 -","- C10 H12 Ca O9 -","- C40 H48 Ca4 O36 -","4","1","JZ1035","Paluchowska, B.; Maurin, J. K.; Leciejewicz, J.","The Role of C—H···O Bonds in Stabilizing 3-Furancarboxylic Acid and its Complexes with Calcium and Strontium","Acta Crystallographica Section C","1996","52","2","342","347","10.1107/S0108270195003246","","","1.54178","CuKα","","0.0458","0.0454","","0.1316","0.1243","","","","1.063","1.023","1.023","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004503","7.286","0.0001","28.853","0.006","6.797","0.0001","90","","91.82","0.03","90","","1428.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-(Triaqua-(3-furancarboxylato)strontium 3-furancarboxylate)","","- C10 H12 O9 Sr -","- C10 H12 O10 Sr -","- C40 H48 O40 Sr4 -","4","1","JZ1035","Paluchowska, B.; Maurin, J. K.; Leciejewicz, J.","The Role of C—H···O Bonds in Stabilizing 3-Furancarboxylic Acid and its Complexes with Calcium and Strontium","Acta Crystallographica Section C","1996","52","2","342","347","10.1107/S0108270195003246","","","1.54178","CuKα","","0.0559","0.0544","","0.1416","0.1366","","","","0.992","0.994","0.994","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004504","21.604","0.008","8.788","0.004","22.082","0.01","90","","91.45","0.03","90","","4191","3","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(bismethanol)(2,3,7,8,12,13,17,18-octaethylporphyrinato)iron(III) perchlorate","","- C40 H60 Cl Fe N4 O8 -","- C40 H56 Cl Fe N4 O8 -","- C160 H224 Cl4 Fe4 N16 O32 -","4","0.5","JZ1038","Senge, M. O.","Bis(methanol-<i>O</i>)(2,3,7,8,12,13,17,18-octaethylporphyrinato-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')iron(III) Perchlorate Bis(methanol) Solvate, [Fe^III^(oep)(HOCH~3~)~2~](ClO~4~).2CH~3~OH","Acta Crystallographica Section C","1996","52","2","302","305","10.1107/S0108270195006068","","","0.71073","MoKα","","0.1118","0.0672","","0.1798","0.1501","","","","1.035","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004505","18.262","0.004","12.956","0.007","26.52","0.02","90","","90.4","0.03","90","","6275","6","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C10 H6 Ca O6 -","- C10 H6 Ca O6 -","- C240 H144 Ca24 O144 -","24","6","JZ1058","Paluchowska, B.; Maurin, J. K.; Leciejewicz, J.","Carboxylate and Furan-Ring Oxygen Bonded to Calcium in Polymeric Calcium Furoate","Acta Crystallographica Section C","1996","52","2","347","351","10.1107/S0108270195009553","","","1.54183","CuKα","","0.2021","0.0548","","0.1483","0.1156","","","","0.93","1.175","1.175","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004506","13.113","0.003","13.315","0.003","7.405","0.002","90","","90","","91.39","0.03","1292.5","0.5","299","2","299","2","","","","","","","","5","P 1 1 2/n","-P 2ab","13","","Tetraphenylphosphonium-pentachlorostannat","","- C24 H20 Cl5 P Sn -","- C24 H20 Cl5 P Sn -","- C48 H40 Cl10 P2 Sn2 -","2","0.5","JZ1063","Müller, U.; Siekmann, J. Frenzen","Tetraphenylphosphonium Pentachlorostannat, PPh~4~[SnCl~5~], und Tetraphenylphosphonium Pentachlorostannat Monohydrat, PPh~4~[SnCl~5~.H~2~O]","Acta Crystallographica Section C","1996","52","2","330","333","10.1107/S0108270195011073","","","0.71073","MoKα","","0.0753","0.0496","","0.1905","0.1437","","","","0.141","0.123","0.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004507","13.173","0.001","13.173","0.001","7.59","0.001","90","","90","","90","","1317.1","0.2","299","2","299","2","","","","","","","","6","P 4/n","-P 4a","","","Tetraphenylphosphonium-pentachlorostannat-monohydrat","","- C24 H22 Cl5 O P Sn -","- C24 H22 Cl5 O P Sn -","- C48 H44 Cl10 O2 P2 Sn2 -","2","","JZ1063","Müller, U.; Siekmann, J. Frenzen","Tetraphenylphosphonium Pentachlorostannat, PPh~4~[SnCl~5~], und Tetraphenylphosphonium Pentachlorostannat Monohydrat, PPh~4~[SnCl~5~.H~2~O]","Acta Crystallographica Section C","1996","52","2","330","333","10.1107/S0108270195011073","","","0.71073","MoKα","","0.0928","0.0405","","0.1504","0.1201","","","","0.993","0.98","0.98","","","","","has coordinates","194546","2020-10-21","18:00:00",""
"2004508","9.502","0.002","11.252","0.002","11.602","0.002","102.98","0.02","113.68","0.02","106.92","0.02","1000.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","trans-dichlorobis(tris(pentafluorophenyl)phosphane)palladium(II)","","- C36 Cl2 F30 P2 Pd -","- C36 Cl2 F30 P2 Pd -","- C36 Cl2 F30 P2 Pd -","1","0.5","JZ1069","Bertsch-Frank, B.; Frank, W.","<i>trans</i>-Dichlorobis[tris(pentafluorophenyl)phosphane]palladium(II)","Acta Crystallographica Section C","1996","52","2","328","330","10.1107/S0108270195011061","","","0.71069","MoKα","","0.0961","0.0516","","0.0727","0.0656","","","","1.239","1.402","1.402","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004509","8.708","0.002","9.047","0.002","12.961","0.003","72.4","0.03","84.61","0.03","77.36","0.03","949.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 Mo O7 W -","- C18 H16 Mo O7 W -","- C36 H32 Mo2 O14 W2 -","2","1","JZ1070","Frank, W.; Kreiter, C. G.; Reiß, G. J.","Hexacarbonyl(η^5:1^-2-cyclopentadienediylethyl)(μ-η^1:3^-1-ethoxy-2-propenylidene)molybdenumtungsten","Acta Crystallographica Section C","1996","52","2","356","358","10.1107/S0108270195009577","","","0.71069","MoKα","","0.0322","0.024","","0.0495","0.0483","","","","1.625","1.678","1.678","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004510","10.134","0.001","18.154","0.001","8.518","0.001","90","","103.44","0.01","90","","1524.2","0.3","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H23 N O2 -","- C17 H23 N O2 -","- C68 H92 N4 O8 -","4","1","JZ1075","Pietz, S.; Haufe, G.; Fröhlich, R.; Grehl, M.","<i>syn</i>-1,5-Dimethylbicyclo[3.2.1]oct-8-yl <i>N</i>-Phenylcarbamate","Acta Crystallographica Section C","1996","52","2","469","470","10.1107/S0108270195011796","","","1.54178","CuKα","","0.045","0.038","","0.103","0.096","","","","","1.004","1.004","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004511","11.314","0.0006","10.872","0.001","14.74","0.002","90","0.009","90.369","0.007","90","0.006","1813.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-Methylenedipyridinium 1-Iodo-nonahydro-closo-decaborate","","- C11 H21 B10 I N2 -","- C11 H21 B10 I N2 -","- C44 H84 B40 I4 N8 -","4","1","JZ1085","Nachtigal, C.; Preetz, W.","Dipyridiniomethane 1-Iodo-<i>closo</i>-decaborate, [(C~5~H~5~N)~2~CH~2~][1-IB~10~H~9~]","Acta Crystallographica Section C","1996","52","2","453","455","10.1107/S0108270195012340","","","0.71069","MoKα","","0.0805","0.035","","0.0992","0.0736","","","","1.189","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004512","8.815","0.002","10.154","0.002","17.277","0.004","76.49","0.02","87.98","0.02","74.55","0.02","1448.7","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(dimethylglyoximato-N,N')(triphenylphosphine)(isopropyl)rhodium(III)","","- C29 H35 N4 O4 P Rh -","- C29 H29 N4 O4 P Rh -","- C58 H58 N8 O8 P2 Rh2 -","2","1","KA1124","Dunaj-Jurčo, M.; Mikloš, D.; Potočňák, I.; Ludwig, M.; Steinborn, D.","Bis(dimethylglyoximato-<i>N</i>,<i>N</i>')(isopropyl)(triphenylphosphine)rhodium(III)","Acta Crystallographica Section C","1996","52","2","315","317","10.1107/S0108270195007475","","","0.71069","MoKα","","0.0582","0.0469","","0.1322","0.1256","","","","1.023","1.073","1.073","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004513","9.463","0.005","42.025","0.004","9.089","0.004","90","","90","","90","","3615","3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H23 N O7 -","- C17 H23 N O7 -","- C136 H184 N8 O56 -","8","2","KA1127","Böcskei, Z.; Keserü, G. M.; Menyhárd, D.; Huszthy, P.; Bradshaw, J. S.; Izatt, R. M.","Conformational Analysis of (<i>S</i>,<i>S</i>)-Dimethyldiketopyridino-18-crown-6","Acta Crystallographica Section C","1996","52","2","463","466","10.1107/S0108270195011346","","","1.5418","CuKα","","0.1589","0.0574","","0.3983","0.1682","","","","1.155","1.282","1.282","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004514","27.7","0.003","7.63","0.004","12.382","0.001","90","","90","","90","","2616.9","1.4","293","2","","","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C15 H20 O2 -","- C15 H20 O2 -","- C120 H160 O16 -","8","2","KA1129","Lakshmi, S.; Subramanian, K.; Koellner, G.; Steiner, Th.; Rajagopalan, K.","7β-Hydroxy-7α-(3-propargyl)-3-methylspiro[5.5]undec-2-en-1-one","Acta Crystallographica Section C","1996","52","2","405","407","10.1107/S0108270195011334","","","1.54184","CuKα","","","0.047","","","0.1182","","","","","1.126","1.126","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004515","12.068","0.001","13.137","0.001","15.374","0.001","66.76","0.01","89.16","0.01","68.82","0.01","2064.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2,3,5,6-1H,4H-Tetrahydro-8-trifluoromethylquinolizino[9,9a,1-gh]coumarin","","- C16 H14 F3 N O2 -","- C16 H14 F3 N O2 -","- C96 H84 F18 N6 O12 -","6","3","KH1030","Yip, B.-C.; Moo, F.-M.; Lok, K.-S.; Fun, H.-K.; Sivakumar, K.","A Second Triclinic Polymorph of Coumarin 153","Acta Crystallographica Section C","1996","52","2","477","481","10.1107/S0108270195011668","","","0.71073","MoKα","","0.0688","0.0419","","0.1332","0.1224","","","","0.934","1.136","1.136","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004516","9.163","0.001","8.37","0.001","21.786","0.003","90","","96.95","0.02","90","","1658.6","0.4","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 N2 O2 -","- C19 H18 N2 O2 -","- C76 H72 N8 O8 -","4","1","KH1052","Ravikumar, K.; Mohan, K. C.; Roy, S.; Singh, A. K.","A Key Intermediate in the Synthesis of Pentamidine: 4,4'-[1,5-Pentanediylbis(oxy)]bisbenzonitrile","Acta Crystallographica Section C","1996","52","2","403","405","10.1107/S0108270195011966","","","0.71073","MoKα","","","0.043","","","0.049","","","","","0.93","0.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004517","12.681","0.007","7.261","0.004","16.654","0.009","90","","93.65","0.02","90","","1530.3","1.5","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-2-(1-indenyl)ethyl-toluenesulfonamide","","- C18 H19 N O2 S -","- C18 H19 N O2 S -","- C72 H76 N4 O8 S4 -","4","1","KH1057","Gainsford, G. J.; Lensink, C.","<i>N</i>-[2-(1-3<i>H</i>-Indenyl)ethyl]-<i>p</i>-toluenesulfonamide","Acta Crystallographica Section C","1996","52","2","472","474","10.1107/S0108270195013011","","","0.71073","MoKα","","0.0731","0.0454","","0.1053","0.0925","","","","1.044","1.083","1.083","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004518","36.71","0.04","5.754","0.007","11.22","0.02","90","","99.85","0.07","90","","2335","6","150","1","150","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C22 H21 F3 O9 S -","- C22 H21 F3 O9 S -","- C88 H84 F12 O36 S4 -","4","1","LI1139","Barnes, J. C.; Brimacombe, J. S.; Kabir, A. K. M. S.","Methyl 3-<i>O</i>-Benzoyl-4,6-<i>O</i>-benzylidene-2-<i>O</i>-trifluoromethylsulfonyl-α-<small>D</small>-mannopyranoside","Acta Crystallographica Section C","1996","52","2","416","418","10.1107/S0108270195012339","","","0.71073","MoKα","","0.1675","0.053","","0.168","0.0875","","","","0.61","0.912","0.912","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004519","12.847","0.002","15.196","0.003","20.57","0.004","94.61","0.02","90.07","0.02","114.53","0.02","3638.8","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C82 H60 Cr2 N2 O10 P4 -","- C82 H60 Cr2 N2 O10 P4 -","- C164 H120 Cr4 N4 O20 P8 -","2","1","MU1169","Lee, I.; Geib, S. J.; Cooper, N. J.","[PPN]~2~[Cr~2~(CO)~10~], a Salt of the Dimeric Cr^1{-^} Carbonyl Complex Without a Coordinating Counterion","Acta Crystallographica Section C","1996","52","2","292","294","10.1107/S0108270195001454","","","0.71073","MoKα","","0.0813","0.039","","0.2229","0.0783","","","","0.765","1.001","1.001","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004520","13.818","0.001","13.818","0.001","27.285","0.003","90","","90","","90","","5209.7","0.8","295","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C57 H38 Cl2 O12 Pb -","- C57 H36 Cl2 O12 Pb -","- C228 H144 Cl8 O48 Pb4 -","4","0.25","MU1180","Prout, K.; Vaughan-Lee, D.; Moloney, M. G.; Prottey, S. C.","Tetrakis(<i>o</i>-benzoylbenzoato-<i>O</i>,<i>O</i>')lead(IV) Dichloromethane Solvate","Acta Crystallographica Section C","1996","52","2","351","354","10.1107/S0108270195007785","","","0.71073","MoKα","","","0.0447","","","0.0464","","","","","1.21","1.21","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004521","7.92","0.002","12.929","0.003","12.177","0.002","90","","94.86","0.03","90","","1242.4","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","sodium hexanitroruthenate(II) monohydrate","sodium hexanitroruthenate(II) monohydrate","","- H2 N6 Na4 O13 Ru -","- H2 N6 Na4 O13 Ru -","- H8 N24 Na16 O52 Ru4 -","4","0.5","MU1193","Gromilov, S. A.; Alekseev, V. I.; Emelyanov, V. A.; Baidina, I. A.","Sodium Hexanitroruthenate(II) Monohydrate","Acta Crystallographica Section C","1996","52","2","288","290","10.1107/S0108270195012042","","","0.71069","MoKα","","0.0208","0.0179","","0.0437","0.0433","","","","0.897","0.96","0.96","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004522","8.42","0.002","14.796","0.002","19.504","0.0001","90","","96.22","0.01","90","","2415.5","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrabutylammonium Bis(1,3-dithiol-2-thione/selone-4,5-dithioate) Nickel (II)","","- C38 H72 N2 Ni S9.34 Se0.66 -","- C38 H72 N2 Ni S9.348 Se0.652 -","- C76 H144 N4 Ni2 S18.696 Se1.304 -","2","0.5","MU1199","Fun, H.-K.; Sivakumar, K.; Zuo, J.-L.; Yao, T.-M.; You, X.-Z.","A 2:1 Mixture of Tetrabutylammonium Bis(4,5-dimercapto-1,3-dithiole-2-thionato)nickelate(II) and its 2-Selenone Analogue","Acta Crystallographica Section C","1996","52","2","312","315","10.1107/S0108270195010754","","","0.71073","MoKα","","0.0448","0.0335","","0.0969","0.0921","","","","1.07","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004523","7.58","0.001","7.912","0.001","17.423","0.003","90","","90","","90","","1044.9","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Dimethyl-3-tolyl thiourea.","","- C10 H14 N2 S -","- C10 H14 N2 S -","- C40 H56 N8 S4 -","4","1","MU1206","Ramnathan, A.; Sivakumar, K.; Janarthanan, N.; Meerarani, D.; Ramadas, K.; Fun, H.-K.","Unsymmetrically Substituted Thioureas. 1,1-Dimethyl-3-<i>o</i>-tolylthiourea and 1,1-Diethyl-3-<i>o</i>-tolylthiourea","Acta Crystallographica Section C","1996","52","2","411","414","10.1107/S0108270195010778","","","0.71073","MoKα","","0.066","0.0402","","0.0919","0.0849","","","","0.887","1.016","1.016","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004524","8.436","0.001","8.488","0.001","17.419","0.003","90","","90","","90","","1247.3","0.3","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Diethyl-3-tolyl thiourea.","","- C12 H18 N2 S -","- C12 H18 N2 S -","- C48 H72 N8 S4 -","4","1","MU1206","Ramnathan, A.; Sivakumar, K.; Janarthanan, N.; Meerarani, D.; Ramadas, K.; Fun, H.-K.","Unsymmetrically Substituted Thioureas. 1,1-Dimethyl-3-<i>o</i>-tolylthiourea and 1,1-Diethyl-3-<i>o</i>-tolylthiourea","Acta Crystallographica Section C","1996","52","2","411","414","10.1107/S0108270195010778","","","0.71073","MoKα","","0.032","0.0291","","0.0792","0.0774","","","","1.048","1.068","1.068","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004525","20.66","0.002","7.706","0.001","29.217","0.004","90","","90","","90","","4651.5","1","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","αββα-3,4-Dimethyl-2,5-bis(3,4,5-trimethoxyphenyl)tetrahydrofuran","","- C24 H32 O7 -","- C24 H32 O7 -","- C192 H256 O56 -","8","1","MU1215","Fun, H.-K.; Sivakumar, K.; Yip, B.-C.; Othman, A. H.; Said, I. M.","αββα-3,4-Dimethyl-2,5-bis(3,4,5-trimethoxyphenyl)tetrahydrofuran","Acta Crystallographica Section C","1996","52","2","414","416","10.1107/S0108270195012054","","","0.71073","MoKα","","0.0824","0.047","","0.2237","0.1343","","","","0.935","1.037","1.037","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004526","10.069","0.003","14.545","0.002","16.784","0.002","90","","90.59","0.02","90","","2457.9","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis(diethylditiocarbamato)iodo-4-methoxyphenyltellurium(IV)","","- C17 H27 I N2 O S4 Te -","- C17 H27 I N2 O S4 Te -","- C68 H108 I4 N8 O4 S16 Te4 -","4","1","NA1148","Husebye, S.; Kudis, S.; Lindeman, S. V.","Bis(diethyldithiocarbamato)(iodo)(4-methoxyphenyl)tellurium(IV), <i>p</i>-MeOC~6~H~4~Te(Et~2~NCS~2~)~2~I, and its Isomorphous Partially Bromine-Replaced Analogue, <i>p</i>-MeOC~6~H~4~Te(Et~2~NCS~2~)~2~Br~0.41~I~0.59~","Acta Crystallographica Section C","1996","52","2","424","429","10.1107/S0108270195004902","","","0.71069","MoKα","","0.0498","0.0321","","0.0878","0.0836","","","","1.055","1.132","1.132","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004527","10.06","0.001","14.363","0.002","16.705","0.004","90","","90.63","0.01","90","","2413.6","0.7","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","(0.41Bromo/0.59Iodo)bis(diethyldithiocarbamato)-4-methoxyphenyltellurium(IV)","","- C17 H27 Br0.41 I0.59 N2 O S4 Te -","- C17 H27 Br0.41 I0.59 N2 O S4 Te -","- C68 H108 Br1.64 I2.36 N8 O4 S16 Te4 -","4","1","NA1148","Husebye, S.; Kudis, S.; Lindeman, S. V.","Bis(diethyldithiocarbamato)(iodo)(4-methoxyphenyl)tellurium(IV), <i>p</i>-MeOC~6~H~4~Te(Et~2~NCS~2~)~2~I, and its Isomorphous Partially Bromine-Replaced Analogue, <i>p</i>-MeOC~6~H~4~Te(Et~2~NCS~2~)~2~Br~0.41~I~0.59~","Acta Crystallographica Section C","1996","52","2","424","429","10.1107/S0108270195004902","","","0.71069","MoKα","","0.0824","0.0435","","0.1337","0.0973","","","","1.097","1.212","1.212","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004528","9.156","0.005","13.324","0.002","17.564","0.002","90","","90.96","0.03","90","","2142.4","1.2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Bromobis(dimethyldithiocarbamato)-4-methoxyphenyltellurium(IV) dichloromethane hemisolvate","","- C13.45 H19.9 Br Cl0.9 N2 O S4 Te -","- C13.45 H19.9 Br Cl0.9 N2 O S4 Te -","- C53.8 H79.6 Br4 Cl3.6 N8 O4 S16 Te4 -","4","1","NA1149","Husebye, S.; Kudis, S.; Lindeman, S. V.","Bromobis(dimethyldithiocarbamato)(4-methoxyphenyl)tellurium(IV) Dichloromethane Hemisolvate, <i>p</i>-MeOC~6~H~4~Te(Me~2~NCS~2~)~2~Br.0.5CH~2~Cl~2~","Acta Crystallographica Section C","1996","52","2","429","432","10.1107/S0108270195004914","","","0.71069","MoKα","","0.0848","0.0368","","0.0958","0.0775","","","","1.144","1.329","1.329","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2004529","8.381","0.003","14.495","0.003","10.351","0.003","90","","105.35","0.02","90","","1212.6","0.6","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H20 N2 O2 -","- C12 H20 N2 O2 -","- C48 H80 N8 O8 -","4","0.5","PA1162","Dromzee, Y.; Chiarelli, R.; Gambarelli, S.; Rassat, A.","Dupeyredioxyl (1,3,5,7-Tetramethyl-2,6-diazaadamantane-<i>N</i>,<i>N</i>'-dioxyl)","Acta Crystallographica Section C","1996","52","2","474","477","10.1107/S0108270195008286","","","0.71069","MoKα","","","0.035","","","0.031","","","","","3.2","3.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004530","11.1558","0.0008","11.574","0.001","9.68","0.002","90","","90","","90","","1249.9","0.3","293","","","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C12 H20 N2 O2 -","- C12 H20 N2 O4 -","- C48 H80 N8 O16 -","4","0.5","PA1162","Dromzee, Y.; Chiarelli, R.; Gambarelli, S.; Rassat, A.","Dupeyredioxyl (1,3,5,7-Tetramethyl-2,6-diazaadamantane-<i>N</i>,<i>N</i>'-dioxyl)","Acta Crystallographica Section C","1996","52","2","474","477","10.1107/S0108270195008286","","","0.71069","MoKα","","","0.04","","","0.034","","","","","2.6","2.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004531","8.467","0.001","5.526","0.001","35.792","0.007","90","","90.29","0.01","90","","1674.6","0.5","293","","293","","","","","","","","","3","P 1 21 1","P 2yb","4","","4-(1-methylheptyloxycarbonyl)phenyl 4-heptyloxytolane-4'-carboxylate","","- C37 H44 O5 -","- C37 H44 O5 -","- C74 H88 O10 -","2","1","PA1193","Zareba, I.; Allouchi, H.; Cotrait, M.; Destrade, C.; Nguyen, H. T.","A Chiral Mesogenic Compound","Acta Crystallographica Section C","1996","52","2","441","444","10.1107/S0108270195008584","","","1.54178","CopperKα","","","0.064","","","0.074","","","","","","","","","","","has coordinates","211413","2020-10-21","18:00:00",""
"2004532","11.6395","0.0009","5.9814","0.0006","13.6907","0.0009","90","","94.462","0.014","90","","950.26","0.14","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(R)-1-Phenylethylaminium (S)-2-(6-methoxy-2-naphthyl)propionate","","- C22 H25 N O3 -","- C22 H25 N O3 -","- C44 H50 N2 O6 -","2","1","PA1198","Dupont, L.; Pirotte, B.; De Tullio, P.; Delarge, J.","Absolute Configuration of (<i>R</i>)-1-Phenylethylammonium (<i>S</i>)-2-(6-Methoxy-2-naphthyl)propionate","Acta Crystallographica Section C","1996","52","2","393","395","10.1107/S0108270195011954","","","1.5418","CuKα","","0.0564","0.0376","","0.0946","0.0879","","","","0.944","1.056","1.056","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2004533","11.9739","0.0012","10.2088","0.0011","14.662","0.002","90","","113.836","0.007","90","","1639.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","8-Chloro-5-(4-methylpiperazin-1-yl)-11H-pyrido[2,3-b][1,5]benzodiazepine","","- C17 H18 Cl N5 -","- C17 H18 Cl N5 -","- C68 H72 Cl4 N20 -","4","1","PA1200","Dupont, L.; Liégeois, J.-F.; Rogister, F.; Delarge, J.","8-Chloro-5-(4-methylpiperazin-1-yl)-11<i>H</i>-pyrido[2,3-<i>b</i>][1,5]benzodiazepine","Acta Crystallographica Section C","1996","52","2","391","393","10.1107/S0108270195011942","","","1.5418","CuKα","","0.0647","0.0425","","0.1313","0.1072","","","","0.965","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004534","14.542","0.002","16.565","0.0002","19.334","0.002","90","","90","","90","","4657.3","0.8","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C52 H50 O10 -","- C52 H50 O10 -","- C208 H200 O40 -","4","1","PT1015","Shalaby, M. A.; Fronczek, F. R.; Voll, R. J.; Watkins, S. F.; Younathan, E. S.","2,3,4,5-Tetra-<i>O</i>-acetyl-1,6-di-<i>O</i>-(triphenylmethyl)-<small>D</small>-mannitol","Acta Crystallographica Section C","1996","52","2","381","383","10.1107/S0108270195013618","","","1.54184","CuKα","","","0.034","","","0.046","","","","","2.273","2.273","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004535","12.438","0.006","4.726","0.003","16.703","0.006","90","","92.5","0.02","90","","980.9","0.9","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bromacetyl salicylic acid","2-bromoacetoxy-benzoic acid","","- C9 H7 Br O4 -","- C9 H7 Br O4 -","- C36 H28 Br4 O16 -","4","1","PT1028","Loll, P. J.; Garavito, R. M.; Carrell, C. J.; Carrell, H. L.","2-Bromoacetoxybenzoic Acid, a Brominated Aspirin Analog","Acta Crystallographica Section C","1996","52","2","375","377","10.1107/S0108270195010390","","","0.71073","MoKα","","0.057","0.0413","","0.1114","0.1047","","","","0.961","1.117","1.117","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004536","5.222","0.002","8.389","0.002","4.759","0.001","93.04","0.03","102.59","0.02","92.57","0.02","202.84","0.1","291","2","291","2","","","","","","","","4","P 1","P 1","1","","","","- C6 H12 N2 O4 -","- C6 H12 N2 O4 -","- C6 H12 N2 O4 -","1","1","SX1004","Swenson, D. C.; Habermann, S. M.; Murphy, K. P.","Cyclo(<small>L</small>-alanyl-<small>L</small>-seryl).H~2~O and Cyclo(glycyl-<small>L</small>-seryl)","Acta Crystallographica Section C","1996","52","2","383","387","10.1107/S0108270195012248","","","0.7107","MoKα","","0.1051","0.0463","","0.1346","0.1017","","","","1.168","1.151","1.151","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004537","4.896","0.002","6.55","0.003","9.737","0.004","90","","90.8","0.04","90","","312.2","0.2","291","2","291","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C5 H8 N2 O3 -","- C5 H8 N2 O3 -","- C10 H16 N4 O6 -","2","1","SX1004","Swenson, D. C.; Habermann, S. M.; Murphy, K. P.","Cyclo(<small>L</small>-alanyl-<small>L</small>-seryl).H~2~O and Cyclo(glycyl-<small>L</small>-seryl)","Acta Crystallographica Section C","1996","52","2","383","387","10.1107/S0108270195012248","","","0.7107","MoKα","","0.0462","0.03","","0.0877","0.0798","","","","1.093","1.074","1.074","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004538","8.678","0.007","16.19","0.01","11.53","0.01","90","","99","0.01","90","","1600","2","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Isoxazolidines","trans-phenyl(2-phenyl-1,6-dioxa-2-azaspiro[4.4]non-3-yl)methanone","","- C19 H19 N O3 -","- C19 H19 N O3 -","- C76 H76 N4 O12 -","4","1","SX1007","Niwayama, S.; You, Y.; Houk, K. N.; Khan, S. I.","Two Isoxazolidines","Acta Crystallographica Section C","1996","52","2","486","489","10.1107/S0108270195013692","","","1.5418","CuKα","","0.163","0.046","","0.091","0.051","","","","1.71","1.457","1.457","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2004539","10.181","0.004","28.9","0.01","10.071","0.002","90","","90","","90","","2963.2","1.7","298","","298","","","","","","","","","4","P b c a","-P 2ac 2ab","61","Isoxazolidines","(3α,3aα,6aα)-(hexahydro-2-phenylfuro[3,2-d]isoxazol-3-yl)phenylmethanone","","- C18 H17 N O3 -","- C18 H17 N O3 -","- C144 H136 N8 O24 -","8","1","SX1007","Niwayama, S.; You, Y.; Houk, K. N.; Khan, S. I.","Two Isoxazolidines","Acta Crystallographica Section C","1996","52","2","486","489","10.1107/S0108270195013692","","","1.5418","CuKα","","0.162","0.048","","0.111","0.059","","","","1.779","1.337","1.337","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2004540","13.66","0.003","8.94","0.002","23.207","0.007","90","","100.14","0.02","90","","2789.8","1.2","298","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H47 Cl Ir N O P2 -","- C23 H46 Cl Ir N O P2 -","- C92 H184 Cl4 Ir4 N4 O4 P8 -","4","1","SZ1010","Grotjahn, D. B.; Lo, H. C.; Groy, T. L.","Chlorohydrido[2(1<i>H</i>)-pyridonato-<i>N</i>,<i>O</i>]bis[tris(1-methylethyl)phosphine]iridium(III)","Acta Crystallographica Section C","1996","52","2","300","302","10.1107/S0108270195003507","","","0.71073","MoKα","","","0.0356","","","0.0472","","","","","0.83","0.83","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004541","15.899","0.001","12.272","0.002","10.618","0.001","90","","90","","90","","2071.7","0.4","293","","","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C24 H29 N O2 -","- C24 H34 N O2 -","- C96 H136 N4 O8 -","4","0.5","SZ1019","Sivaraman, J.; Subramanian, K.; Velmurugan, D.; Subramanian, E.; Shanmugasundram, P. S.","3,3,6,6-Tetramethyl-10-(4-methylphenyl)-3,4,6,7,9,10-hexahydro-1,8(2<i>H</i>,5<i>H</i>)-acridinedione","Acta Crystallographica Section C","1996","52","2","481","483","10.1107/S0108270195010171","","","1.54184","CuKα","","","0.056","","","0.062","","","","","1.38","1.38","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004542","12.165","0.009","12.598","0.011","8.962","0.005","90","","94.84","0.05","90","","1368.6","1.7","295","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H9 Cl I N O4 -","- C12 H9 Cl I N O4 -","- C48 H36 Cl4 I4 N4 O16 -","4","1","SZ1024","Kerrigan, J. E.; Powers, J. C.; VanDerveer, D.","4-Chloro-7-(iodoacetyl)amino-3-methoxyisocoumarin","Acta Crystallographica Section C","1996","52","2","451","453","10.1107/S0108270195010080","","","0.71073","MoKα","","","0.05","","","0.052","","","","","1.56","1.56","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004543","6.872","0.001","9.96","0.002","12.782","0.002","91.72","0.01","92.14","0.01","94.31","0.01","871.3","0.3","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","Chloro(ethylenediamine)[6-phenylimidazo[2,1-b]thiazole]platinum(II) nitrate","","- C13 H16 Cl N5 O3 Pt S -","- C13 H16 Cl N5 O3 Pt S -","- C26 H32 Cl2 N10 O6 Pt2 S2 -","2","1","SZ1032","Arvanitis, G. M.; Griffitts, A. E.; Baffic, S. P.; Ho, D. M.","Chloro(ethylenediamine)(6-phenylimidazo[2,1-<i>b</i>]thiazole-<i>N</i>^7^)platinum(II) Nitrate","Acta Crystallographica Section C","1996","52","2","319","321","10.1107/S0108270195010067","","","0.71073","MoKα","","0.0292","0.023","","0.0522","0.0502","","","","1.059","1.077","1.077","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004544","12.3228","0.0013","13.0782","0.0006","11.6694","0.0012","98.505","0.006","105.878","0.008","106.988","0.006","1676.1","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5-Methoxybenzemethanamine 2-[(2,3-di(p-tolyl)-5-methyl-1H-inden-1-ylidene) (p-tolyl)-methyl]-N,N,-dimethyl.","","- C42 H41 N O -","- C42 H41 N O -","- C84 H82 N2 O2 -","2","1","SZ1037","Fernández-G, J. M.; Solorzano-Maldonado, K.; Panneerselvam, K.; Rodríguez-Romero, A.; Soriano-García, M.","Dimethyl(2-{[2,3-di(<i>p</i>-tolyl)-5-methyl-1-indenylidene](<i>p</i>-tolyl)methyl}-5-methoxyphenylmethyl)amine","Acta Crystallographica Section C","1996","52","2","460","462","10.1107/S0108270195010146","","","1.54178","CuKα","","0.0902","0.0652","","0.2186","0.1704","","","","1.106","1.058","1.058","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004545","9.691","0.002","9.691","0.002","24.841","0.006","90","","90","","120","","2020.4","0.8","140","2","140","2","","","","","","","","3","P 32 2 1","P 32 2""","154","1,4-benzoquinonebis(1,2-diphenylethyleneketal)","1,4,9,12-Tetraoxa-2,3,10,11-tetraphenyldispiro[4.2.4.2]tetradeca-6,13-diene","","- C34 H28 O4 -","- C34 H28 O4 -","- C102 H84 O12 -","3","0.5","SZ1047","Hibbs, D. E.; Hursthouse, M. B.; Malik, K. M. A.; Ward, R. S.; Pelter, A.; Aalberg, L.","2,3,10,11-Tetraphenyl-1,4,9,12-tetraoxadispiro[4.2.4.2]tetradeca-6,13-diene","Acta Crystallographica Section C","1996","52","2","379","381","10.1107/S0108270195012327","","","0.71069","MoKα","","0.0442","0.0309","","0.0629","0.061","","","","0.892","0.982","0.982","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004546","7.638","0.002","10.603","0.003","14.364","0.005","107.63","0.02","94.57","0.02","107.12","0.02","1041.2","0.6","296","","","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H20 N6 O3 -","- C22 H20 N6 O3 -","- C44 H40 N12 O6 -","2","1","TA1026","Yang, Q.-C.; Huang, D.-M.; Chen, H.-Y.; Tang, Y.-Q.","A 1:1 Molecular Complex of 1,5-Diphenylbiuret and Phenyl Carbamidonitrile","Acta Crystallographica Section C","1996","52","2","470","472","10.1107/S0108270195010900","","","0.71073","MoKα","","","0.0578","","","0.0637","","","","","2.45","2.45","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004547","18.472","0.004","13.207","0.002","13.592","0.002","90","","107.87","0.01","90","","3155.9","1","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H27 Cl3 Cr N7 O12 -","- C24 H27 Cl3 Cr N7 O12 -","- C96 H108 Cl12 Cr4 N28 O48 -","4","1","TA1028","McLachlan, G. A.; Fallon, G. D.; Spiccia, L.","[Cr{tren(impy)~3~}](ClO~4~)~3~, where tren(impy)~3~ = N[CH~2~CH~2~N= C(H)(py)]~3~","Acta Crystallographica Section C","1996","52","2","309","312","10.1107/S0108270195008870","","","0.71073","MoKα","","","0.056","","","0.074","","","","","1.83","1.83","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004548","14.109","0.001","14.109","0.001","26.697","0.005","90","","90","","120","","4602.4","1","293","1","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C33 H45 N5 O3 -","- C33 H45 N5 O3 -","- C198 H270 N30 O18 -","6","0.333333","TA1031","de Bruyn, P. J.; Gable, R. W.; Potter, A. C.; Solomon, D. H.","1:1 Adduct of Tris(4-hydroxy-3,5-dimethylbenzyl)amine and Hexamethylenetetramine","Acta Crystallographica Section C","1996","52","2","466","468","10.1107/S0108270195011127","","","0.71073","MoKα","","0.0468","0.0353","","0.0974","0.0916","","","","1.036","1.109","1.109","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004549","7.906","0.004","14.687","0.003","32.908","0.002","90","","92.05","0.02","90","","3819","2","213","1","213","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 Br N O5 -","- C20 H22 Br N O5 -","- C160 H176 Br8 N8 O40 -","8","2","TA1039","Banwell, M. G.; Hockless, D. C. R.; Peters, S. C.","An <i>ABC</i>-ring Analogue of Paclitaxel (Taxol^TM^)","Acta Crystallographica Section C","1996","52","2","370","372","10.1107/S0108270195010869","","","1.5418","CuKα","","0.0571","0.041","","0.0433","0.041","","","","","2.23","2.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004550","6.178","0.002","12.083","0.001","12.492","0.002","90","","91.73","0.02","90","","932.1","0.3","213.2","","213","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 O2 -","- C12 H12 O2 -","- C48 H48 O8 -","4","1","TA1041","Banwell, M. G.; Hockless, D. C. R.; Walter, J. M.","4a-Phenylperhydro-1,4-dioxacyclopropa[<i>cd</i>]pentalene","Acta Crystallographica Section C","1996","52","2","368","369","10.1107/S0108270195010882","","","1.5418","CuKα","","","0.038","","","0.035","","","","","1.62","1.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004551","4.8061","0.001","13.262","0.004","14.195","0.004","90","","90","","90","","904.8","0.4","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-Aza-9(10H)-acridone","","- C12 H8 N2 O -","- C12 H8 N2 O -","- C48 H32 N8 O4 -","4","1","TA1053","Clark, G. R.; Squire, C. J.","4-Aza-9(10<i>H</i>)-acridone","Acta Crystallographica Section C","1996","52","2","366","368","10.1107/S0108270195011589","","","0.71069","MoKα","","0.135","0.073","","0.2109","0.1637","","","","1.108","1.178","1.178","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004552","8.587","0.001","10.39","0.001","19.707","0.003","81","0.01","86.96","0.01","69.11","0.01","1622.4","0.4","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","Sodium tetraphenylcyclopentadienylate bis(dimethoxyethane)","","- C37 H41 Na O4 -","- C37 H41 Na O4 -","- C74 H82 Na2 O8 -","2","1","AB1228","Näther, C.; Hauck, T.; Bock, H.","Sodium Tetraphenylcyclopentadienide Bis(dimethoxyethane)","Acta Crystallographica Section C","1996","52","3","570","572","10.1107/S0108270195010687","","","0.71073","MoKα","","0.0875","0.0522","","0.1532","0.13","","","","1.015","1.068","1.068","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004553","21.839","0.009","8.995","0.005","11.823","0.005","90","","95.91","0.04","90","","2310.2","1.9","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H18 Br2 Co N2 O2 -","- C26 H18 Br2 Co N2 O2 -","- C104 H72 Br8 Co4 N8 O8 -","4","0.5","AB1229","Elmali, A.; Elerman, Y.; Svoboda, I.; Fuess, H.","<i>trans</i>-Bis[<i>N</i>-(4-bromophenyl)salicylaldiminato]cobalt(II)","Acta Crystallographica Section C","1996","52","3","553","554","10.1107/S0108270195011875","","","0.71069","MoKα","","0.0566","0.0334","","0.0924","0.0783","","","","1.057","1.053","1.053","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004554","15.1058","0.0006","7.5393","0.0002","6.6094","0.0003","90","","106.2","0.003","90","","722.84","0.05","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C5 H4 Li2 O7 -","- C5 H4 Li2 O7 -","- C20 H16 Li8 O28 -","4","0.5","AB1272","Gonçalves, N. S.; Santos, P. S.; Vencato, I.","Lithium Croconate Dihydrate","Acta Crystallographica Section C","1996","52","3","622","624","10.1107/S0108270195011887","","","0.71073","Mo","","0.0517","0.0472","","","0.0513","","","","","0.884","0.884","","","","","has coordinates","191094","2020-10-21","18:00:00",""
"2004555","13.479","0.005","10.197","0.003","13.954","0.005","90","","115.06","0.02","90","","1737.4","1.1","293","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H21 Cd N7 Ni O -","- C11 H21 Cd N6 Ni On2 -","- C44 H84 Cd4 N24 Ni4 On8 -","4","0.5","AB1281","Yuge, H.; Nishikiori, S.-I.; Iwamoto, T.","Double and Triple Interpenetrations of the Three-Dimensional Frameworks [Cd(mea)(daptn){Ni(CN)~4~}] and [Cd(mea)(dahxn){Ni(CN)~4~}].H~2~O (mea = 2-Aminoethanol, daptn = 1,5-Diaminopentane, dahxn = 1,6-Diaminohexane)","Acta Crystallographica Section C","1996","52","3","575","578","10.1107/S0108270195011899","","","0.71069","MoKα","","","0.0379","","","0.0529","","","","","1.359","1.359","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004556","9.247","0.002","13.434","0.006","16.367","0.003","90","","105.6","0.02","90","","1958.3","1.1","293","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H25 Cd N7 Ni O2 -","- C12 H25 Cd N6 Ni O On2 -","- C48 H100 Cd4 N24 Ni4 O4 On8 -","4","0.5","AB1281","Yuge, H.; Nishikiori, S.-I.; Iwamoto, T.","Double and Triple Interpenetrations of the Three-Dimensional Frameworks [Cd(mea)(daptn){Ni(CN)~4~}] and [Cd(mea)(dahxn){Ni(CN)~4~}].H~2~O (mea = 2-Aminoethanol, daptn = 1,5-Diaminopentane, dahxn = 1,6-Diaminohexane)","Acta Crystallographica Section C","1996","52","3","575","578","10.1107/S0108270195011899","","","0.71069","MoKα","","","0.0431","","","0.0443","","","","","1.172","1.172","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004557","9.001","0.001","10.321","0.001","25.121","0.002","90","","94.85","0.01","90","","2325.4","0.4","293","1","293","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,3-Dicyclopropyl-2-(1',2',3'-triphenylcyclopropen-3-yl)-propane-1,3-dione","","- C30 H26 O2 -","- C30 H26 O2 -","- C120 H104 O8 -","4","1","AB1296","Kopf, J.; Bretzke, C.; Domnin, I. N.; Plotkin, V. N.","1,3-Dicyclopropyl-2-(1,2,3-triphenylcyclopropen-3-yl)propane-1,3-dione: a Substituted Cyclopropene with a β-Dicarbonyl Fragment","Acta Crystallographica Section C","1996","52","3","722","724","10.1107/S0108270195012959","","","1.54178","CuKα","","0.0504","0.0482","","0.142","0.1397","","","","1.049","1.07","1.07","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004558","10.882","0.001","10.367","0.001","15.778","0.001","90","","99.39","0.01","90","","1756.1","0.3","293","1","293","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1'-(2,2-Dimethyl-1,3-propanedioyl)-5,5,5',5'-tetramethyl- bis-(1H-pyrrole)-2,2'(5H,5'H)-dione","","- C17 H22 N2 O4 -","- C17 H22 N2 O4 -","- C68 H88 N8 O16 -","4","1","AB1302","Kopf, J.; Wrobel, M. N.; Margaretha, P.","1,3-Bis(2,5-dihydro-5,5-dimethyl-2-oxo-1-pyrrolyl)-2,2-dimethyl-1,3-propanedione","Acta Crystallographica Section C","1996","52","3","672","674","10.1107/S0108270195012960","","","1.54178","CuKα","","0.0456","0.0437","","0.1334","0.1297","","","","1.115","1.121","1.121","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004559","7.381","0.001","32.096","0.002","7.884","0.001","90","","94.94","0.11","90","","1860.8","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","","","heroin","7,8-didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol diacetate","","- C21 H23 N O5 -","- C21 H23 N O5 -","- C84 H92 N4 O20 -","4","2","AB1311","Deschamps, J. R.; George, C.; Flippen-Anderson, J. L.","A Diacetylmorphine Polymorph","Acta Crystallographica Section C","1996","52","3","698","700","10.1107/S0108270195013503","","","1.54178","CuKα","","0.0595","0.0481","","0.1384","0.1262","","","","1.006","1.011","1.011","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004560","9.1029","0.0014","11.395","0.002","17.49","0.002","90","","104.953","0.01","90","","1752.8","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(trifluoromethyl)triphenylphosphinegold(I)","","- C19 H15 Au F3 P -","- C19 H15 Au F3 P -","- C76 H60 Au4 F12 P4 -","4","1","AB1330","Flörke, U.; Haupt, H.-J.; Jones, P. G.","Trifluoromethyl(triphenylphosphine)gold(I)","Acta Crystallographica Section C","1996","52","3","609","611","10.1107/S0108270195014880","","","0.71073","MoKα","","0.0317","0.0227","","0.0514","0.0496","","","","0.924","0.994","0.994","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004561","9.843","0.002","13.153","0.005","18.517","0.006","87.33","0.04","78.26","0.02","84.45","0.02","2335.3","1.3","294","1","294","1","","","","","","","","5","P -1","-P 1","2","Tris(triphenylsilyl)arsenite","Tris(triphenylsilyl)arsenite","","- C54 H45 As O3 Si3 -","- C54 H45 As O3 Si3 -","- C108 H90 As2 O6 Si6 -","2","1","AB1333","Ferguson, G.; Pollock, J. W.; O'Leary, B.; Spalding, T. R.","Tris(triphenylsilanolato)arsenite(III)","Acta Crystallographica Section C","1996","52","3","619","622","10.1107/S0108270195015629","","","0.7107","MolybdenumKα","","0.0572","0.0386","","0.1133","0.1072","","","","1.087","1.185","1.185","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004562","9.53","0.003","10.268","0.002","13.235","0.003","70.34","0.02","86.15","0.02","84.81","0.02","1213.7","0.5","294","1","294","1","","","","","","","","6","P -1","-P 1","2","","5,5-bis(dimethylphenylphosphine)-arachno-4,6-dithia-5-palladanonaborane","","- C16 H30 B6 P2 Pd S2 -","- C16 H30 B6 P2 Pd S2 -","- C32 H60 B12 P4 Pd2 S4 -","2","1","AB1335","Ferguson, G.; McCarthy, D. E.; Spalding, T. R.; Kennedy, J. D.","5,5-Bis(dimethylphenylphosphine)-4,6-dithia-5-pallada-<i>arachno</i>-nonaborane","Acta Crystallographica Section C","1996","52","3","548","550","10.1107/S0108270195015952","","","0.7107","MolybdenumKα","","0.071","0.038","","0.0913","0.0837","","","","1","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004563","11.478","0.003","13.027","0.003","17.55","0.004","90","","101.29","0.02","90","","2573.4","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrakis(triethylamine) Octamolybdate(VI) dihydrate","","- C24 H68 Mo8 N4 O28 -","- C24 H68 Mo8 N4 O28 -","- C48 H136 Mo16 N8 O56 -","2","0.5","AS1175","Fun, H.-K.; Yip, B.-C.; Niu, J.-Y.; You, X.-Z.","Tetrakis(triethylammonium) Octamolybdate(VI) Dihydrate","Acta Crystallographica Section C","1996","52","3","506","509","10.1107/S0108270195011747","","","0.71073","MoKα","","0.0364","0.0337","","0.0938","0.0925","","","","1.174","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004564","15.223","0.006","9.321","0.003","18.792","0.006","90","","104.77","0.02","90","","2578.4","1.6","260","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H32 Co N4 S3 -","- C23 H32 Co N4 S3 -","- C92 H128 Co4 N16 S12 -","4","1","AS1185","Yu, P.; Zhuang, B.; Huang, L.; Pan, B.","Tetraethylammonium Tris(pyridine-2-thiolato-<i>S</i>,<i>N</i>)cobalt(II), (Et~4~N)[Co(2-S-C~5~H~4~N)~3~]","Acta Crystallographica Section C","1996","52","3","630","632","10.1107/S0108270195010596","","","0.71069","MoKα","","","0.038","","","0.054","","","","","1.43","1.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004565","10.0284","0.001","15.7731","0.0013","15.6012","0.0015","114.715","0.008","102.418","0.014","78.189","0.009","2170.9","0.4","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","ap-8-chrolo-1,4-dimetyl-9-(2-methylbenzyl)triptycene","","- C30 H25 Cl -","- C30 H25 Cl -","- C120 H100 Cl4 -","4","2","AS1189","Nemoto, T.; Ohashi, Y.; Yamamoto, G.","<i>ap</i>-8-Chloro-1,4-dimethyl-9-(2-methylbenzyl)triptycene and <i>sc</i>*(9<i>S</i>*)-8-Chloro-1,4-dimethyl-9-(2-methylbenzyl)triptycene","Acta Crystallographica Section C","1996","52","3","716","720","10.1107/S0108270195009048","","","1.54184","CuKα","","0.0639","0.0608","","0.2107","0.2034","","","","1.075","1.067","1.067","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004566","23.803","0.003","8.4646","0.001","11.083","0.002","90","","98.13","0.04","90","","2210.6","0.6","296","2","296","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","sc^*^(9S^*^)-8-chloro-1,4-dimethyl-9-(2-methylbenzyl)triptycene","","- C30 H25 Cl -","- C30 H25 Cl -","- C120 H100 Cl4 -","4","1","AS1189","Nemoto, T.; Ohashi, Y.; Yamamoto, G.","<i>ap</i>-8-Chloro-1,4-dimethyl-9-(2-methylbenzyl)triptycene and <i>sc</i>*(9<i>S</i>*)-8-Chloro-1,4-dimethyl-9-(2-methylbenzyl)triptycene","Acta Crystallographica Section C","1996","52","3","716","720","10.1107/S0108270195009048","","","1.54184","CuKα","","0.1001","0.089","","0.2291","0.219","","","","1.109","1.143","1.143","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2004567","10.733","0.001","17.017","0.002","7.683","0.0001","90","","97.49","0.01","90","","1391.3","0.2","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ferrocinium tetrachloroantimonate.","","- C10 H10 Cl4 Fe Sb -","- C10 H10 Cl4 Fe Sb -","- C40 H40 Cl16 Fe4 Sb4 -","4","1","AS1201","Yamin, B. M.; Fun, H.-K.; Sivakumar, K.; Yip, B.-C.; Shawkataly, O. B.","Ferrocenium Tetrachloroantimonate","Acta Crystallographica Section C","1996","52","3","600","602","10.1107/S0108270195010948","","","0.71073","MoKα","","0.0259","0.0248","","0.0624","0.0618","","","","1.094","1.109","1.109","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004568","7.055","0.003","19.118","0.005","15.568","0.005","90","","98.32","0.04","90","","2077.7","1.3","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C44 H50 N6 O8 -","- C44 H50 N6 O8 -","- C88 H100 N12 O16 -","2","1","AS1202","Miyake, H.; Yamashita, T.; Hirotsu, K.; Kojima, Y.","A Cyclic Hexa-Pseudopeptide Constructed from <i>N</i>,<i>N</i>'-Ethylene-Bridged (<i>S</i>)-Phenylalanyl-(<i>S</i>)-Phenylalanine and Glycine","Acta Crystallographica Section C","1996","52","3","681","684","10.1107/S0108270195011905","","","0.7107","MoKα","","","0.047","","","0.059","","","","","1.63","1.63","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004569","7.046","0.001","7.9939","0.0009","9.1","0.003","106.81","0.02","89","0.03","114.74","0.01","442.45","0.18","296","","","","","","","","","","","6","P -1","-P 1","2","","","","- C6 H6 Br Cd N O3 -","- C6 H6 Br Cd N O3 -","- C12 H12 Br2 Cd2 N2 O6 -","2","1","AS1203","Zhang, C.; Xu, D.; Xu, Y.; Huang, X.","The Polymeric Cadmium Complex Poly[μ-(nicotinato-<i>O</i>,<i>O</i>':<i>N</i>)-μ-bromo-monoaquacadmium]","Acta Crystallographica Section C","1996","52","3","591","593","10.1107/S0108270195011917","","","0.71073","MoKα","","","0.027","","","0.038","","","","","1.13","1.13","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004570","13.1844","0.0009","6.2358","0.0007","17.562","0.002","90","","107.719","0.006","90","","1375.4","0.2","293","1","293","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","methyl trans-9,10-dihydro-9,10-ethanoanthracene-11-carboxylate","","- C18 H16 O2 -","- C18 H16 O2 -","- C72 H64 O8 -","4","1","AS1205","Gable, R. W.; Qureshi, A.; Schiesser, C. H.","Methyl <i>trans</i>-9,10-Dihydro-9,10-ethanoanthracene-11-carboxylate","Acta Crystallographica Section C","1996","52","3","674","675","10.1107/S0108270195010985","","","1.5418","CuKα(nickelfiltered)","","0.0463","0.0359","","0.0958","0.0877","","","","1.024","1.05","1.05","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004571","12.163","0.001","11.359","0.001","10.309","0.002","90","","113.58","0.01","90","","1305.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Cyclohexyl-3-phenyl thiourea","","- C13 H18 N2 S -","- C13 H18 N2 S -","- C52 H72 N8 S4 -","4","1","AS1207","Ramnathan, A.; Sivakumar, K.; Subramanian, K.; Srinivasan, N.; Ramadas, K.; Fun, H.-K.","1-Cyclohexyl-3-phenylthiourea","Acta Crystallographica Section C","1996","52","3","656","658","10.1107/S0108270195014065","","","0.71073","MoKα","","0.0601","0.0442","","0.1273","0.1201","","","","1.021","1.13","1.13","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004572","13.9887","0.0009","23.444","0.001","7.8082","0.0006","90","","90","","90","","2560.7","0.3","293","2","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H15 N O4 -","- C16 H15 N O4 -","- C128 H120 N8 O32 -","8","1","AS1210","Honda, T.; Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A.","Coumarin 343, C~16~H~15~NO~4~","Acta Crystallographica Section C","1996","52","3","679","681","10.1107/S0108270195012820","","","1.54184","CuKα","","","0.044","","","0.058","","","","","2.56","2.56","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004573","38.4","0.05","11","0.05","9.6","0.05","90","","97","0.1","90","","4025","3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H29 N O3 -","- C22 H29 N O3 -","- C176 H232 N8 O24 -","8","1","AS1211","Hamodrakas, S. J.; Perrakis, A.; Antoniadou-Vyzas, E.","A <i>de novo</i> Designed Possible 5-Lipoxygenase Inhibitor: α-Acetoxy-<i>N</i>-[1-(1-tricyclo[3.3.1.1^3,7^]dec-1-yl)ethyl]benzeneacetamide","Acta Crystallographica Section C","1996","52","3","677","679","10.1107/S0108270195013084","","","0.92","Monochromatic","","0.0682","0.0442","","0.277","0.105","","","","0.938","0.947","0.947","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2004574","32.686","0.004","4.094","0.005","10.257","0.007","90","","95.08","0.03","90","","1367.2","1.9","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Ethyl 4-[4'-(4""-n-octyloxybenzoyloxy)benzylidene]aminobenzoate","","- C31 H35 N O5 -","- C31 H35 N O5 -","- C62 H70 N2 O10 -","2","1","AS1215","Kurogoshi, S.; Hori, K.","Ethyl and Butyl 4-[4-(4-<i>n</i>-Octyloxybenzoyloxy)benzylidene]aminobenzoates","Acta Crystallographica Section C","1996","52","3","660","663","10.1107/S0108270195013321","","","1.5418","CuKα","","0.1154","0.0692","","0.872","0.1937","","","","1.052","1.014","1.014","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004575","9.577","0.002","34.681","0.006","9.562","0.003","97.43","0.02","108.28","0.02","83.74","0.02","2982.4","1.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Butyl 4-[4'-(4""-n-octyloxybenzoyloxy)benzylidene]aminobenzoate","","- C33 H39 N O5 -","- C33 H34 N O5 -","- C132 H136 N4 O20 -","4","2","AS1215","Kurogoshi, S.; Hori, K.","Ethyl and Butyl 4-[4-(4-<i>n</i>-Octyloxybenzoyloxy)benzylidene]aminobenzoates","Acta Crystallographica Section C","1996","52","3","660","663","10.1107/S0108270195013321","","","1.5418","CuKα","","0.104","0.0725","","0.5923","0.2223","","","","1.066","1.097","1.097","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004576","7.71","0.005","12.354","0.002","10.92","0.002","90","","106.92","0.02","90","","995.1","0.7","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H9 N O5 -","- C10 H9 N O5 -","- C40 H36 N4 O20 -","4","1","AS1218","Okabe, N.; Miura, J.; Shimosaki, A.","Xanthurenic Acid Monohydrate","Acta Crystallographica Section C","1996","52","3","663","665","10.1107/S0108270195013072","","","0.71069","MoKα","","","0.072","","","0.087","","","","","2.64","2.64","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2004577","12.723","0.004","13.429","0.002","8.737","0.007","103.54","0.03","99.02","0.05","92.72","0.04","1427.8","1.3","296","","296","","","","","","","","","5","P -1","-P 1","2","hexaazatriphenylenehexacarboxamide solvate","","","- C22 H25 N12 O8.5 S2 -","- C22 H25 N12 O8.5 S2 -","- C44 H50 N24 O17 S4 -","2","1","BK1108","Beeson, J. C.; Czarnik, A. W.; Fitzgerald, L. J.; Gerkin, R. E.","Hexaazatriphenylenehexacarboxamide Solvate Exhibiting π-Complexation in the Solid State","Acta Crystallographica Section C","1996","52","3","724","729","10.1107/S0108270195011036","","","0.71073","MoKα","","","0.047","","","0.052","","","","","1.68","1.68","","","","","has coordinates","192027","2020-10-21","18:00:00",""
"2004578","18.326","0.004","16.953","0.003","13.516","0.003","90","","111.25","0.03","90","","3913.7","1.6","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","aqua(2,2'-bipyrimidine-N,N')(4,5-dihydroxy-1,2-benzoquinonate-O,O')copper(II) pentahydrate","","- C14 H20 Cu N4 O10 -","- C14 H20 Cu N4 O10 -","- C112 H160 Cu8 N32 O80 -","8","1","BK1126","Decurtins, S.; Schmalle, H. W.; Schneuwly, P.; Zheng, L.-M.","Two 2,5-Dihydroxy-1,4-benzoquinonate-<i>O</i>,<i>O</i>'-Containing Mononuclear Complexes: [Cu(C~6~H~2~O~4~)(C~8~H~6~N~4~)(H~2~O)].5H~2~O and [Ni(C~6~H~2~O~4~)(C~12~H~12~N~2~)~2~].H~2~O (C~8~H~6~N~4~ = 2,2'-Bipyrimidine, C~12~H~12~N~2~ = 4,4'-Dimethyl-2,2'-bipyridine)","Acta Crystallographica Section C","1996","52","3","561","566","10.1107/S0108270195010298","","","0.71073","MoKα","","0.1518","0.0481","","0.1468","0.1055","","","","1.039","1.091","1.091","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004579","12.942","0.003","12.942","0.003","29.326","0.006","90","","90","","120","","4253.9","1.6","295","2","295","2","","","","","","","","5","P 61","P 61","169","","bis(4,4'-dimethyl-2,2'-bipyridine-N,N')(4,5-dihydroxy-1,2-benzoquinonate-O,O')- nickel(II) monohydrate","","- C30 H28 N4 Ni O5 -","- C30 H27 N4 Ni O5 -","- C180 H162 N24 Ni6 O30 -","6","1","BK1126","Decurtins, S.; Schmalle, H. W.; Schneuwly, P.; Zheng, L.-M.","Two 2,5-Dihydroxy-1,4-benzoquinonate-<i>O</i>,<i>O</i>'-Containing Mononuclear Complexes: [Cu(C~6~H~2~O~4~)(C~8~H~6~N~4~)(H~2~O)].5H~2~O and [Ni(C~6~H~2~O~4~)(C~12~H~12~N~2~)~2~].H~2~O (C~8~H~6~N~4~ = 2,2'-Bipyrimidine, C~12~H~12~N~2~ = 4,4'-Dimethyl-2,2'-bipyridine)","Acta Crystallographica Section C","1996","52","3","561","566","10.1107/S0108270195010298","","","0.71073","MoKα","","0.1479","0.0521","","0.1812","0.1259","","","","1.233","1.215","1.215","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004580","6.879","0.002","8.215","0.002","11.961","0.002","90","","93.3","0.2","90","","674.8","0.3","298","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H17 B N4 O5 -","- C10 H17 B N4 O5 -","- C20 H34 B2 N8 O10 -","2","1","BK1157","Singh, P.; Zottola, M.; Huang, S.; Shaw, B. R.; Pedersen, L. G.","2'-Deoxycytidine-N(3)-cyanoborane Monohydrate","Acta Crystallographica Section C","1996","52","3","693","696","10.1107/S0108270195013412","","","0.71073","MoKα","","","0.0456","","","0.0511","","","","","2.06","2.06","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004581","12.8859","0.0004","12.9276","0.001","13.5328","0.0007","64.067","0.009","87.82","0.006","67.207","0.006","1845.4","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Ethanol-(2,3,7,8,12,13,17,18-Octaethylporphinato)manganese(III) Perchlorate","","- C38 H50 Cl Mn N4 O5 -","- C38 H46 Cl Mn N4 O5 -","- C76 H92 Cl2 Mn2 N8 O10 -","2","1","BK1159","Cheng, B.; Scheidt, W. R.","(Ethanol)(2,3,7,8,12,13,17,18-octaethylporphinato)manganese(III) Perchlorate","Acta Crystallographica Section C","1996","52","3","585","588","10.1107/S0108270195010705","","","0.71073","MoKα","","0.0856","0.0672","","0.1905","0.1767","","","","1.053","1.106","1.106","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004582","14.487","0.005","14.978","0.006","15.081","0.005","118.45","0.03","110.79","0.03","86.76","0.03","2664","2","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H56 Br4 Cu4 N4 O12 -","- C44 H56 Br5 Cu4 N4 O12 -","- C88 H112 Br10 Cu8 N8 O24 -","2","1","BM1020","Turpeinen, U.; Hämäläinen, R.; Mutikainen, I.; Orama, O.","Tetrakis[μ-(3-bromobenzoato)-μ-(2-dimethylaminoethanolato)-copper(II)]","Acta Crystallographica Section C","1996","52","3","568","570","10.1107/S0108270195012406","","","0.71069","MoKα","","","0.054","","","0.0647","","","","","1.36","1.36","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004583","3.614","0.001","31.543","0.002","6.75","0.001","90","","93.05","0.01","90","","768.4","0.2","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-[bis(p-nitrosalicylato)disilver(I)]","","- C14 H8 Ag2 N2 O10 -","- C14 H8 Ag2 N2 O10 -","- C28 H16 Ag4 N4 O20 -","2","0.5","BM1026","Tahir, M. N.; Ülkü, D.; Muvsumov, E. M.","Poly[bis(<i>p</i>-nitrosalicylato-<i>O</i>:<i>O</i>')disilver(I)-<i>O</i>^3^:<i>Ag</i>';<i>Ag</i>:<i>O</i>^3'^]","Acta Crystallographica Section C","1996","52","3","593","595","10.1107/S010827019501314X","","","0.71073","MoKα","","0.1657","0.054","","","0.065","","","","","0.7","0.7","","","","","has coordinates","278313","2022-10-03","10:12:56",""
"2004584","11.371","0.001","15.433","0.001","17.954","0.001","90","","104.738","0.006","90","","3047.1","0.4","300","","300","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","dimethylaluminium diphenylphosphinate","","- C28 H32 Al2 O4 P2 -","- C28 H32 Al2 O4 P2 -","- C112 H128 Al8 O16 P8 -","4","0.5","BM1033","Corker, J. M.; Browning, D. J.; Webster, M.","Bis(μ-diphenylphosphinato-<i>O</i>:<i>O</i>')bis(dimethylaluminium)","Acta Crystallographica Section C","1996","52","3","583","585","10.1107/S0108270195013266","","","1.54178","CuKα","","","0.062","","","0.089","","","","","2.25","2.25","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2004585","9.627","0.008","10.584","0.007","17.084","0.009","90","","93.15","0.06","90","","1738","2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,5-Di(benzoylthio)-4,5-didehydro-1,3-dithiolane-2-thione","","- C17 H10 O2 S5 -","- C17 H10 O2 S5 -","- C68 H40 O8 S20 -","4","1","BM1041","Cox, P. J.; Doidge-Harrison, S. M. S. V.","Redetermination of 4,5-Di(benzoylthio)-4,5-didehydro-1,3-dithiolane-2-thione at 120 K","Acta Crystallographica Section C","1996","52","3","720","722","10.1107/S0108270195015162","","","0.71069","MoKα","","0.089","0.0434","","0.0921","0.0855","","","","0.71","0.932","0.932","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004586","9.48","0.003","9.4","0.003","7.399","0.002","90","","112.22","0.03","90","","610.4","0.3","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Mercury(II) hydrogenselenite selenite","Mercury(II) bis(hydrogenselenite) bis(selenite)","","- H2 Hg3 O12 Se4 -","- Hg3 O12 Se4 -","- Hg6 O24 Se8 -","2","0.5","BR1108","Koskenlinna, M.; Valkonen, J.","Mercury(II) Hydrogenselenite Selenite","Acta Crystallographica Section C","1996","52","3","491","493","10.1107/S0108270195012480","","","0.71073","MoKα","","","0.029","","","0.036","","","","","1.037","1.037","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004587","10.848","0.001","10.848","0.001","10.848","0.001","90","","90","","90","","1276.6","0.2","292","","292","","","","","","","","","6","F m -3 m","-F 4 2 3","225","Cadmium iridium hexacyanide dodecahydrate","Cadmium hexacyanoiridate (III) dodecahydrate","","- C12 H24 Cd3 Ir2 N12 O12 -","- C16.008 Cd4 Ir2.668 N16.008 O15.988 -","- C16.008 Cd4 Ir2.668 N16.008 O15.988 -","1","0.00520833","BR1126","Mullica, D. F.; Hayward, P. K.; Sappenfield, E. L.","Cadmium Hexacyanoiridate(III) Dodecahydrate","Acta Crystallographica Section C","1996","52","3","502","504","10.1107/S0108270195014387","","","0.71073","MoKα","","0.044","0.026","","1.335","0.032","","","","","1.099","1.099","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004588","20.348","0.004","13.501","0.002","11.701","0.003","90","","90","","90","","3214.5","1.1","293","","293","","","","","","","","","7","P b c n","-P 2n 2ab","60","","[bis(3-methylthiazolinylidene)]gold(I) trifluoromethanesulfonate","","- C9 H10 Au F3 N2 O3 S3 -","- C9 H10 Au F3 N2 O3 S3 -","- C72 H80 Au8 F24 N16 O24 S24 -","8","1","CF1002","Kruger, G. J.; Olivier, P. J.; Raubenheimer, H. G.","Bis(3-methyl-1,3-thiazolinylidene)gold(I) Trifluoromethanesulfonate","Acta Crystallographica Section C","1996","52","3","624","626","10.1107/S0108270195011152","","","0.71069","MoKα","","0.296","0.066","","0.071","0.054","","","","2.51","2.948","2.948","","","","","has coordinates","188742","2020-10-21","18:00:00",""
"2004589","14.428","0.006","12.885","0.006","7.999","0.005","90","","90","","90","","1487.1","1.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Tetrachlorobis(tetrahydrofuran)zirconium","Tetrachlorobis(tetrahydrofuran)zirconium","","- C8 H16 Cl4 O2 Zr -","- C8 H16 Cl4 O2 Zr -","- C32 H64 Cl16 O8 Zr4 -","4","1","CF1019","Eberle, M.; Röhr, C.","Tetrachlorobis(tetrahydrofuran-<i>O</i>)zirconium(IV)","Acta Crystallographica Section C","1996","52","3","566","568","10.1107/S0108270195011188","","","0.7107","MoKα","","0.0792","0.0686","","0.1965","0.1879","","","","1.096","1.151","1.151","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004590","7.784","0.003","20.606","0.005","11.705","0.003","90","","93.92","0.04","90","","1873.1","1","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 Te -","- C24 H18 Te -","- C96 H72 Te4 -","4","1","CF1026","Chen, H.; Hamor, T. A.; Singh, K.; McWhinnie, W. R.","Bis(2-biphenyl) Telluride","Acta Crystallographica Section C","1996","52","3","711","713","10.1107/S0108270195011176","","","0.71073","MoKα","","","0.0346","","","0.0773","","","","","1.041","1.041","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004591","6.463","0.001","10.665","0.002","15.623","0.003","87.07","0.03","82.13","0.03","88.24","0.03","1065","0.3","297","","","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H21 N O8 -","- C22 H21 N O8 -","- C44 H42 N2 O16 -","2","1","CR1169","Prayzner, P.; Ojadi, E. C. A.; Golen, J. A.; Williard, P. G.","3,4-Diphenylpyrrole-2,5-dicarboxylic Acid Acetic Acid Disolvate","Acta Crystallographica Section C","1996","52","3","665","667","10.1107/S0108270195010481","","","0.71073","MoKα","","","0.0578","","","0.0575","","","","","1.32","1.32","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004592","6.255","0.001","30.059","0.004","7.425","0.001","90","","113.95","0.02","90","","1275.8","0.4","295","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C12 H11 I N2 S -","- C12 H11 I N2 S -","- C48 H44 I4 N8 S4 -","4","1","CR1172","Tafeenko, V. A.; Schenk, H.; Paseshnichenko, K. A.; Aslanov, L. A.","7-Methyl-6-phenylimidazo[2,1-<i>b</i>]thiazolium Iodide","Acta Crystallographica Section C","1996","52","3","729","731","10.1107/S0108270195006561","","","0.71073","MoKα","","","0.019","","","0.021","","","","","1.62","1.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004593","15.658","0.005","8.352","0.003","16.746","0.005","90","","124.31","0.02","90","","1808.9","1.1","22","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H24 Cl4 Cu2 N4 -","- C10 H24 Cl4 Cu2 N4 -","- C40 H96 Cl16 Cu8 N16 -","4","0.5","CR1200","Wang, Z.; Willett, R. D.; Molnar, S.; Brewer, K. J.","Monoclinic Form of [Cu(C~10~H~24~N~4~)]CuCl~4~","Acta Crystallographica Section C","1996","52","3","581","583","10.1107/S0108270195012091","","","0.71073","MoKα","","","0.0376","","","0.0565","","","","","0.75","0.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004594","9.238","0.002","14.388","0.003","11.763","0.002","90","","109.4","0.02","90","","1474.7","0.5","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-etoxi-1-(5-chlorine,4-nitrous,2-hidroxiphenil)azo,2-aminopropene","","- C12 H13 Cl N4 O5 -","- C12 H13 Cl N4 O5 -","- C48 H52 Cl4 N16 O20 -","4","1","CR1204","Rodrigues, B. L.; do Gambardella, M. T.; de Figueiredo, L. J.; Kascheres, C.","Ethyl 2-[(<i>E</i>)-5-Chloro-2-hydroxy-4-nitrophenylazo]-3-(<i>E</i>)-amino-2-butenoate","Acta Crystallographica Section C","1996","52","3","705","707","10.1107/S0108270195013023","","","0.71073","MoKα","","0.1067","0.0447","","0.0563","0.0397","","","","1.44","1.94","1.94","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004595","10.025","0.001","8.689","0.001","12.063","0.001","90","0.009","114.01","0.01","90","0.01","959.86","0.18","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4-bis(2,2'-bipyrid-4-yl)benzene","","- C26 H18 N4 -","- C26 H18 N4 -","- C52 H36 N8 -","2","0.5","CR1205","Wang, W.; Baba, A.; Schmehl, R. H.; Mague, J. T.","A Rigid Bis-Bidentate Bridging Ligand: 1,4-Bis(2,2'-bipyrid-4-yl)benzene","Acta Crystallographica Section C","1996","52","3","658","660","10.1107/S010827019501242X","","","0.71073","MoKα","","0.082","0.038","","","0.047","","","","","1.494","1.494","","","","","has coordinates,has Fobs","278324","2022-10-03","14:41:53",""
"2004596","14.708","0.002","21.098","0.004","23.127","0.003","90","","93.29","0.01","90","","7164.7","1.9","230","2","230","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","Holmium ""carbons adjacent"" carborane-tmeda cluster","","","- C43 H111 B8 Cl2 Ho Li3 N8 Si4 -","- C43 H111 B8 Cl2 Ho Li3 N8 Si4 -","- C172 H444 B32 Cl8 Ho4 Li12 N32 Si16 -","4","1","CR1207","Zhang, H.; Wang, Y.; Maguire, J. A.; Hosmane, N. S.","A Holmium(III) `Carbons Adjacent' Carborane Cluster, [Li(C~6~H~16~N~2~)~2~][Li~2~(C~6~H~16~N~2~)~2~{HoCl~2~(C~8~H~22~B~4~Si~2~)~2~}].0.5C~6~H~6~","Acta Crystallographica Section C","1996","52","3","640","643","10.1107/S010827019501273X","","","0.71073","MoKα","","0.1028","0.0496","","0.1148","0.092","","","","0.992","1.053","1.053","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2004597","7.869","0.004","9.677","0.003","14.602","0.003","82.09","0.02","84.16","0.02","77.12","0.03","1070.7","0.7","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H24 N3 S4 Te -","- C15 H24 N3 S4 Te -","- C30 H48 N6 S8 Te2 -","2","1","DE1011","Rajashree, S.; Krishna Kumar, R.; Udupa, M. R.; Seshasayee, R.; Aravamudan, G.","The Hemi-Adduct of Bis(diethyldithiocarbamato-<i>S</i>,<i>S</i>')tellurium(II) with 4,4'-Bipyridyl","Acta Crystallographica Section C","1996","52","3","707","709","10.1107/S0108270195012273","","","0.71073","MoKα","","","0.027","","","0.03","","","","","0.62","0.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004598","30.973","0.008","8.04","0.005","21.268","0.006","90","","127.04","0.04","90","","4228","4","295","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H24 N2 O3 -","- C25 H24 N2 O3 -","- C200 H192 N16 O24 -","8","1","DE1014","Miao, F.-M.; Zhang, L.-J.; Wen, X.; Zhou, W.-H.; Niu, Z.-C.; Han, J.-G.; Liu, X.-L.","6'-Diethylamino-2'-methylaminospiro[isobenzofuran-1(3<i>H</i>),9'-[9<i>H</i>]xanthen]-3-one","Acta Crystallographica Section C","1996","52","3","700","702","10.1107/S0108270195013175","","","0.71073","MoKα","","","0.052","","","0.06","","","","","1.45","1.45","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004599","6.85","0.002","7.188","0.002","7.304","0.002","74.39","0.02","72.02","0.02","78.79","0.02","327.01","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Manganese Ethylenediammonium Bis(sulfate) Tetrahydrate","","- C2 H18 Mn N2 O12 S2 -","- C2 H18 Mn N2 O12 S2 -","- C2 H18 Mn N2 O12 S2 -","1","0.5","DU1123","Chaabouni, S.; Kamoun, S.; Daoud, A.; Jouini, T.","Manganese Ethylenediammonium Bis(sulfate) Tetrahydrate","Acta Crystallographica Section C","1996","52","3","505","506","10.1107/S0108270195011048","","","0.71069","MoKα","","0.0333","0.0329","","0.1019","0.1014","","","","1.154","1.167","1.167","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004600","17.252","0.003","16.565","0.003","10.422","0.002","90","","90","","90","","2978.4","0.9","200","1","200","1","","","","","","","","5","P n m a","-P 2ac 2n","62","","Lithiumtetrapenylborate-Dihydrate-Bis(tetrahydrofuran)","","- C32 H40 B Li O4 -","- C32 H40 B Li O4 -","- C128 H160 B4 Li4 O16 -","4","0.5","DU1138","Schödel, H.; Vaupel, T.; Bock, H.","Lithium Tetraphenylborate.2thf.2H~2~O","Acta Crystallographica Section C","1996","52","3","637","640","10.1107/S0108270195012522","","","0.71073","MoKα","","0.0915","0.0495","","0.1607","0.1392","","","","1.102","1.202","1.202","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004601","10.5096","0.0008","10.873","0.001","14.32","0.001","90","","106.261","0.008","90","","1570.9","0.2","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Tris(ethylammonium)decavanadate dihydrate","","","- C6 H34 N6 O30 V10 -","- C6 H34 N6 O30 V10 -","- C12 H68 N12 O60 V20 -","2","0.5","DU1141","Ninclaus, C.; Riou, D.; Férey, G.","A New Decavanadate Dihydrate Templated by Ethylenediamine","Acta Crystallographica Section C","1996","52","3","512","514","10.1107/S010827019501105X","","","0.71073","MoKα","","0.0673","0.0237","","0.0625","0.1282","","","","0.994","0.994","0.994","","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2004602","5.59","0.001","5.6932","0.0008","7.878","0.002","90","","90.26","0.009","90","","250.71","0.09","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- La2 Li Mo O6 -","- La2 Li Mo O6 -","- La4 Li2 Mo2 O12 -","2","0.5","DU1142","Tortelier, J.; Gougeon, P.","La~2~LiMoO~6~","Acta Crystallographica Section C","1996","52","3","500","502","10.1107/S010827019501153X","","","0.71073","MoKα","","","0.026","","","0.033","","","","","0.764","0.764","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004603","17.682","0.004","10.292","0.003","11.855","0.003","90","","90","","90","","2157.4","1","293","","","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C12 H28 N4 Ni O7 S4 -","- C12 H28 N4 Ni O7 S4 -","- C48 H112 N16 Ni4 O28 S16 -","4","1","FG1049","Li, W.-Z.; Wang, J.-L.; Miao, X.-S.; Zhou, Y.; Miao, F.-M.","1,4,10,13-Tetrathia-7,16-diazacyclooctadecanenickel(II) Nitrate Hydrate","Acta Crystallographica Section C","1996","52","3","555","557","10.1107/S0108270195009619","","","0.71073","MoKα","","","0.034","","","0.037","","","","","1.876","1.876","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004604","7.3319","0.0008","12.3885","0.0009","12.8313","0.0009","114.805","0.009","98.699","0.009","100.923","0.009","1003.38","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Nickel(II)-bis-[(d,l)-dicampholylmethanat]","Nickel(II)-bis[1-((+)-(1'R,3'S)-1',2',2',3'-tetramethyl-cyclopent-1'yl)- 3-((-)-(1'S,3'R)-1',2',2',3'-tetramethyl-cyclopent-1'yl)-propan-1,3- dionate]","","- C42 H70 Ni O4 -","- C42 H70 Ni O4 -","- C42 H70 Ni O4 -","1","0.5","FG1065","Ficker, R.; Hiller, W.; Ossig, A.; Schurig, V.","Nickel(II) Bis(<i>d</i>-campholyl-<i>l</i>-campholylmethanate)","Acta Crystallographica Section C","1996","52","3","543","545","10.1107/S0108270195010663","","","1.54184","CuKα","","0.0472","0.0446","","0.1204","0.1163","","","","1.119","1.126","1.126","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004605","15.41","0.003","3.953","0.001","18.081","0.006","90","","90","","90","","1101.4","0.5","295","","","","","","","","","","","3","P n a 21","","","","1,8-dichloroanthracene","","- C14 H8 Cl2 -","- C14 H8 Cl2 -","- C56 H32 Cl8 -","4","1","FG1096","del Benites, M.; Maverick, A. W.; Fronczek, F. R.","1,8-Dichloroanthracene","Acta Crystallographica Section C","1996","52","3","647","648","10.1107/S0108270195014673","","","0.71073","MoKα","","","0.057","","","0.059","","","","","1.955","1.955","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004606","11.782","0.003","17.087","0.004","14.771","0.003","90","","91.29","0.02","90","","2972.9","1.2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Chloro(propionyl-C)[2(1H)-pyridinonato-N,O]bis[tris(1-methylethyl)- phosphine]iridium(III)","","- C26 H51 Cl Ir N O2 P2 -","- C26 H51 Cl Ir N O2 P2 -","- C104 H204 Cl4 Ir4 N4 O8 P8 -","4","1","FG1097","Grotjahn, D. B.; Lo, H. C.; Groy, T. L.","Chloro(propionyl-<i>C</i>)[2(1<i>H</i>)-pyridonato-<i>N</i>,<i>O</i>]bis[tris(1-methylethyl)phosphine]iridium(III)","Acta Crystallographica Section C","1996","52","3","516","519","10.1107/S0108270195010997","","","0.71073","MoKα","","0.0331","0.0262","","0.0688","0.0647","","","","1.023","1.039","1.039","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2004607","12.575","0.002","13.42","0.001","13.53","0.002","93.64","","93.23","","95.23","","2264.7","0.5","298","2","566","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(triethylammonium) hexakis(isothiocyanato)-nickel(II)","","- C30 H64 N10 Ni S6 -","- C30 H64 N10 Ni S6 -","- C60 H128 N20 Ni2 S12 -","2","1","FG1110","Kruger, P. E.; McKee, V.","Tetrakis(triethylammonium) Hexakis(isothiocyanato-<i>N</i>)nickel(II)","Acta Crystallographica Section C","1996","52","3","617","619","10.1107/S0108270195013837","","","0.71073","MoKα","","0.0856","0.0552","","0.1638","0.1355","","","","1.024","1.047","1.047","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004608","6.359","0.001","16.752","0.002","13.653","0.001","90","","94.23","0.01","90","","1450.4","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-Methylenebis[5,5-dimethyl-2,2'-dioxide]1,3,2- dioxaphosphorinane","","- C11 H22 O6 P2 -","- C11 H22 O6 P2 -","- C44 H88 O24 P8 -","4","1","FG1133","Browning, C. S.; Burrow, T. E.; Farrar, D. H.; Lough, A. J.","2,2'-Methylenebis(5,5-dimethyl-1,3,2-dioxaphosphorinane 2-oxide)","Acta Crystallographica Section C","1996","52","3","652","654","10.1107/S0108270195014685","","","0.71073","MoKα","","0.058","0.0397","","0.1027","0.093","","","","1.015","1.05","1.05","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004609","11.805","0.004","12.428","0.003","10.021","0.004","100.89","0.03","114.89","0.03","77.51","0.03","1294.1","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","narceine hydrochloride","N,N-Dimethyl-2-[5-(2-carboxy-3,4-dimethoxybenzoylmethyl)-4-methoxy-1,3- benzodioxol-6-yl]ethylammonium Chloride (Narceine) Trihydrate","","- C23 H34 Cl N O11 -","- C23 H34 Cl N O11 -","- C46 H68 Cl2 N2 O22 -","2","1","HA1145","Baggio, R.; Baggio, S.; Pardo, M. I.; Capparelli, M. V.","Narceine Hydrochloride Trihydrate","Acta Crystallographica Section C","1996","52","3","703","705","10.1107/S0108270195012479","","","0.71073","MoKα","","0.0876","0.0485","","0.1627","0.1366","","","","1.026","1.103","1.103","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004610","8.215","0.002","7.105","0.003","9.512","0.002","90","","94.54","0.01","90","","553.5","0.3","294.2","","294.2","","","","","","","","","5","P 1 21 1","","","","","","- C7 H13 Cl2 N3 O2 -","- C10.5 H19.5 Cl3 N4.5 O3 -","- C21 H39 Cl6 N9 O6 -","2","1","HA1149","Vilchiz, V. H.; Norman, R. E.; Chang, S.-C.","<small>L</small>-Histidine Methyl Ester Dihydrochloride","Acta Crystallographica Section C","1996","52","3","696","698","10.1107/S0108270195013308","","","0.7107","MoKα","","","0.0327","","","0.0344","","","","","1.872","1.872","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004611","9.5234","0.002","14.528","0.005","12.913","0.003","90","","99.58","0.02","90","","1761.7","0.8","295","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H20 F6 Mo N O P -","- C15 H20 F6 Mo N O P -","- C60 H80 F24 Mo4 N4 O4 P4 -","4","1","HU1051","Wang, T.-F.; Wen, Y.-S.","Carbonyl(η^4^-1,3-cyclohexadiene)[(η^5^,κ<i>N</i>)-2-methylaminoethylcyclopentadienyl]molybdenum(II) Hexafluorophosphate","Acta Crystallographica Section C","1996","52","3","525","526","10.1107/S0108270195010328","","","0.7093","MoKα","","","0.035","","","0.045","","","","","2.73","2.73","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2004612","5.809","0.001","15.514","0.003","13.883","0.002","90","","90","","90","","1251.1","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H12 O3 S -","- C14 H12 O3 S -","- C56 H48 O12 S4 -","4","1","HU1074","Hellier, D. G.; Motevalli, M.","<i>cis</i>,<i>trans</i>-4,5-Diphenyl-1,3,2-dioxathiolane 2-Oxide, <i>cis</i>,<i>cis</i>-4,5-Diphenyl-1,3,2-dioxathiolane 2-Oxide and 4,4-Diphenyl-1,3,2-dioxathiolane 2-Oxide","Acta Crystallographica Section C","1996","52","3","739","743","10.1107/S0108270195012984","","","0.71069","MoKα","","0.073","0.0286","","0.082","0.0719","","","","0.921","1.075","1.075","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004613","6.456","0.001","7.808","0.001","12.636","0.002","93.86","0.01","98.97","0.01","98.81","0.01","619.03","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H12 O3 S -","- C14 H12 O3 S -","- C28 H24 O6 S2 -","2","1","HU1074","Hellier, D. G.; Motevalli, M.","<i>cis</i>,<i>trans</i>-4,5-Diphenyl-1,3,2-dioxathiolane 2-Oxide, <i>cis</i>,<i>cis</i>-4,5-Diphenyl-1,3,2-dioxathiolane 2-Oxide and 4,4-Diphenyl-1,3,2-dioxathiolane 2-Oxide","Acta Crystallographica Section C","1996","52","3","739","743","10.1107/S0108270195012984","","","0.71069","MoKα","","0.1945","0.0633","","0.1767","0.143","","","","0.862","1.197","1.197","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004614","8.748","0.001","17.697","0.002","8.418","0.001","90","","109.01","0.03","90","","1232.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C14 H12 O3 S -","- C14 H12 O3 S -","- C56 H48 O12 S4 -","4","1","HU1074","Hellier, D. G.; Motevalli, M.","<i>cis</i>,<i>trans</i>-4,5-Diphenyl-1,3,2-dioxathiolane 2-Oxide, <i>cis</i>,<i>cis</i>-4,5-Diphenyl-1,3,2-dioxathiolane 2-Oxide and 4,4-Diphenyl-1,3,2-dioxathiolane 2-Oxide","Acta Crystallographica Section C","1996","52","3","739","743","10.1107/S0108270195012984","","","0.71069","MoKα","","0.0546","0.0357","","0.1284","0.1203","","","","1.017","1.13","1.13","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004615","21.594","0.003","12.399","0.002","24.783","0.003","90","","92.1","0.02","90","","6631","1.6","298","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","","","- C36 H30 Au B F4 P2 -","- C36 H30 Au B F8 P2 -","- C288 H240 Au8 B8 F64 P16 -","8","1","HU1080","Wang, J.-C.","[Au(PPh~3~)~2~]^+^[BF~4~]^{-^}","Acta Crystallographica Section C","1996","52","3","611","613","10.1107/S0108270195012376","","","0.71073","MoKα","","","0.0395","","","0.0525","","","","","1.03","1.03","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004616","13.922","0.003","21.002","0.002","24.866","0.002","90","","105.51","0.01","90","","7005.8","1.8","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C80 H73 B N5 P2 Re S Si -","- C80 H73 B N5 P2 Re S Si -","- C320 H292 B4 N20 P8 Re4 S4 Si4 -","4","1","HU1129","Gernert, M. B.; Kooijman, H.; Hiller, W. P.; Dilworth, J. R.; Parrott, S. J.","[Re(NNPh)(NNHPh){2-S-C~5~H~3~N-3-Si(CH~3~)~3~}(PPh~3~)~2~]BPh~4~","Acta Crystallographica Section C","1996","52","3","545","548","10.1107/S0108270195011851","","","0.71073","MoKα","","0.0952","0.0377","","0.07","0.0584","","","","1.007","1.06","1.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004617","4.972","0.001","9.379","0.002","11.326","0.002","90","","92.18","0.01","90","","527.78","0.18","100","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H12 N4 O4 -","- C10 H12 N4 O4 -","- C20 H24 N8 O8 -","2","1","HU1142","Marfurt, J.; Stulz, E.; Trafelet, H. U.; Zingg, A.; Leumann, C.; Hazenkamp, M.; Judd, R.; Schenker, S.; Strouse, G.; Ward, T. R.; Förtsch, M.; Hauser, J.; Bürgi, H.-B.","7-(2'-Deoxy-α-<small>D</small>-ribofuranosyl)hypoxanthine","Acta Crystallographica Section C","1996","52","3","713","716","10.1107/S0108270195012662","","","0.71069","MoKα","","","0.0268","","","0.0357","","","","","1.2618","1.2618","","","","","has coordinates,has Fobs","205898","2020-10-21","18:00:00",""
"2004618","6.078","0.001","9.996","0.002","23.888","0.004","90","","90","","90","","1451.3","0.4","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H24 O6 -","- C12 H24 O6 -","- C48 H96 O24 -","4","1","JZ1071","Berens, U.; Raabe, G.","(2<i>R</i>,3<i>R</i>,5<i>S</i>,6<i>S</i>)-2,3-Diethoxy-5,6-bis(hydroxymethyl)-2,3-dimethyl-1,4-dioxane","Acta Crystallographica Section C","1996","52","3","669","672","10.1107/S0108270195012194","","","0.71069","MoKα","","","0.054","","","0.048","","","","","2.284","2.284","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004619","7.489","0.001","27.829","0.006","8.257","0.002","90","","102.05","0.03","90","","1682.9","0.6","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","3^1^,3^2^-didehydrorhodochlorin-15-acetic acid trimethylester","(2S,3S)-8-ethenyl-13-ethyl-2,3-dihydro-18-(methoxycarbonyl)-20- (methoxycarbonylmethyl)-3,7,12,17-tetramethylporphyrin-2- propionic acid methyl ester","","- C37 H42 N4 O6 -","- C37 H42 N4 O6 -","- C74 H84 N8 O12 -","2","1","JZ1072","Pajunen, A.; Stapelbroek-Möllmann, M. E.; Hynninen, P. H.","3^1^,3^2^-Didehydrorhodochlorin-15-acetic Acid Trimethyl Ester","Acta Crystallographica Section C","1996","52","3","743","746","10.1107/S0108270195012169","","","0.71073","MoKα","","0.1488","0.0819","","0.2474","0.1906","","","","0.939","1.111","1.111","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004620","7.124","0.004","8.687","0.003","10.6064","0.0013","90","","98.85","0.04","90","","648.6","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","neptunocene","Bis(cyclooctatetraenyl)neptunium(IV)","","- C16 H16 Np -","- C16 H16 Np -","- C32 H32 Np2 -","2","0.5","JZ1077","De Ridder, D. J. A.; Rebizant, J.; Apostolidis, C.; Kanellakopulos, B.; Dornberger, E.","Bis(cyclooctatetraenyl)neptunium(IV)","Acta Crystallographica Section C","1996","52","3","597","600","10.1107/S0108270195013047","","","0.71073","MoKα","","0.054","0.031","","0","0.038","","","","0","1.065","1.065","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2004621","14.997","0.007","10.84","0.002","19.16","0.008","90","","113.04","0.02","90","","2866.3","1.9","213","2","213","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","trans-Dichlorotris(dimethylphenylphosphine)isothiocyanatotechnetium(III)","","- C25 H33 Cl2 N P3 S Tc -","- C25 H33 Cl2 N P3 S Tc -","- C100 H132 Cl8 N4 P12 S4 Tc4 -","4","1","JZ1079","Abram, U.; Abram, S.; Dilworth, J. R.","Mixed-Ligand Complexes of Technetium. XIV. Structure of <i>trans</i>-[TcCl~2~(NCS)(Me~2~PhP)~3~]","Acta Crystallographica Section C","1996","52","3","605","607","10.1107/S0108270195012923","","","0.71073","MoKα","","0.1193","0.0491","","0.0891","0.0668","","","","1.155","1.095","1.095","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004622","15.298","0.004","6.097","0.001","22.037","0.004","90","","106.72","0.02","90","","1968.5","0.7","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","catena-{dinitratotriaquabis[meso-2,5-bis(trimethylammonio)adipate] dicadmium(II) dinitrate}]","","- C24 H54 Cd2 N8 O23 -","- C24 H54 Cd2 N8 O23 -","- C48 H108 Cd4 N16 O46 -","2","0.5","JZ1080","Wu, D.-D.; Mak, T. C. W.","Polymeric Cadmium(II) Nitrate Adduct of a Flexible Double Betaine: [Cd~2~(<i>L</i>)~2~(NO~3~)~2~(H~2~O)~3~]~<i>n~</i>(NO~3~)~2<i>n~</i> [<i>L</i> = <i>meso</i>-2,5-Bis(trimethylammonio)adipate]","Acta Crystallographica Section C","1996","52","3","529","532","10.1107/S0108270195012133","","","0.71073","MoKα","","0.0693","0.0384","","0.0871","0.0751","","","","1.063","1.129","1.129","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004623","8.236","0.001","11.26","0.003","11.608","0.003","90.3","0.02","101.98","0.01","110.44","0.02","983.2","0.4","210","2","210","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H22 F N3 O7 Se -","- C16 H22 F N3 O7 Se -","- C32 H44 F2 N6 O14 Se2 -","2","1","JZ1086","Poleschner, H.; Schilde, U.","The First Structure of a Vicinal (<i>E</i>)-Fluoroselenoolefin: (<i>E</i>)-(5-Fluoro-4-octen-4-yl)dimethylselenonium Picrate","Acta Crystallographica Section C","1996","52","3","644","647","10.1107/S0108270195014260","","","0.71073","MoKα","","0.0378","0.0299","","0.0813","0.0762","","","","1.021","1.03","1.03","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004624","12.108","0.007","7.277","0.003","10.835","0.009","90","","107.58","0.05","90","","910.1","1","294","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","N-n-ethyl-N,N-dimethylammonio acetic acid bromide","","- C6 H14 Br N O2 -","- C6 H14 Br N O2 -","- C24 H56 Br4 N4 O8 -","4","1","KA1118","Rudert, R.; Schulz, B.; Reck, G.; Vollhardt, D.; Kriwanek, J.","<i>n</i>-Butyl(carboxymethyl)dimethylammonium Bromide and (Carboxymethyl)ethyldimethylammonium Bromide","Acta Crystallographica Section C","1996","52","3","648","652","10.1107/S0108270195011541","","","0.71073","MoKα","","","0.052","","","0.061","","","","","1.354","1.354","","","","","has coordinates","208381","2020-10-21","18:00:00",""
"2004625","11.11","0.007","13.428","0.005","15.038","0.005","90","","90","","90","","2243.4","1.8","294","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-n-Butyl-N,N-dimethylammonio Acetic Acid Bromide","","- C8 H18 Br N O2 -","- C8 H18 Br N O2 -","- C64 H144 Br8 N8 O16 -","8","2","KA1118","Rudert, R.; Schulz, B.; Reck, G.; Vollhardt, D.; Kriwanek, J.","<i>n</i>-Butyl(carboxymethyl)dimethylammonium Bromide and (Carboxymethyl)ethyldimethylammonium Bromide","Acta Crystallographica Section C","1996","52","3","648","652","10.1107/S0108270195011541","","","0.71073","MoKα","","","0.053","","","0.052","","","","","2.19","2.19","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2004626","7.93","0.004","11.018","0.004","15.512","0.006","96.01","0.03","98.93","0.03","108","0.03","1256.4","1","292","2","293","2","","","","","","","","5","P -1","-P 1","2","","Isothiocyanatobis(1,10-phenanthroline)copper(II) Tricyanomethanide","","- C29 H16 Cu N8 S -","- C29 H16 Cu N8 S -","- C58 H32 Cu2 N16 S2 -","2","1","KA1130","Potočňák, I.; Dunaj-Jurčo, M.; Mikloš, D.; Jäger, L.","Isothiocyanatobis(1,10-phenanthroline)copper(II) Tricyanomethanide","Acta Crystallographica Section C","1996","52","3","532","535","10.1107/S0108270195007487","","","0.71073","MoKα","","0.0809","0.046","","0.1459","0.1198","","","","0.969","1.004","1.004","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004627","9.125","0.002","9.241","0.002","10.532","0.002","90","","90","","90","","888.1","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","hydrazinium hexafluorogallate","","- F6 Ga H15 N6 -","- F6 Ga H15 N6 -","- F24 Ga4 H60 N24 -","4","1","KA1142","Meden, A.; Siftar, J.; Golic, L.","Hydrazinium(1+) Hexafluorogallate(III) and Hydrazinium(2+) Aquapentafluorogallate(III)","Acta Crystallographica Section C","1996","52","3","493","496","10.1107/S0108270195011310","","","0.71069","MoKα","","0.035","0.033","","0.019","0.019","","","","1.036","1.024","1.024","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004628","9.248","0.001","10.942","0.001","11.199","0.001","90","","90","","90","","1133.24","0.19","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","hydrazinium pentafluoroaquagallate","","- F5 Ga H8 N2 O -","- F5 Ga H8 N2 O -","- F40 Ga8 H64 N16 O8 -","8","1","KA1142","Meden, A.; Siftar, J.; Golic, L.","Hydrazinium(1+) Hexafluorogallate(III) and Hydrazinium(2+) Aquapentafluorogallate(III)","Acta Crystallographica Section C","1996","52","3","493","496","10.1107/S0108270195011310","","","0.71069","MoKα","","0.037","0.026","","0.024","0.019","","","","1.162","1.026","1.026","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004629","5.079","0.001","13.925","0.003","9.45","0.002","90","","93.3","0.01","90","","667.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-methyl-2-thiophene carboxylic-acid","","- C6 H6 O2 S -","- C6 H6 O2 S -","- C24 H24 O8 S4 -","4","1","KA1147","Rudiño-Piñera, E.; Panneerselvam, K.; Soriano-García, M.","5-Methyl-2-thiophenecarboxylic Acid","Acta Crystallographica Section C","1996","52","3","675","677","10.1107/S0108270195012467","","","1.54178","CuKα","","0.042","0.0388","","0.1628","0.1016","","","","1.242","1.047","1.047","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004630","11.073","0.003","14.64","0.003","14.979","0.002","90","","100.36","0.02","90","","2388.6","0.9","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H52 Cu2 N4 O12 -","- C52 H52 Cu2 N4 O12 -","- C104 H104 Cu4 N8 O24 -","2","0.5","KH1048","Yu, Y.-P.; Zhu, D.-L.; Liu, S.-X.","A Dimeric Copper(II) Complex of an α-Hydroxylated Acid: [Cu(C~14~H~8~O~3~)(C~9~H~7~N)(H~2~O)]~2~.2C~3~H~7~NO.2H~2~O","Acta Crystallographica Section C","1996","52","3","628","630","10.1107/S0108270195011474","","","0.71069","MoKα","","","0.0437","","","0.053","","","","","1.25","1.25","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004631","13.078","0.002","14.721","0.002","15.437","0.001","90","","90","","90","","2972","0.6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Tris(2-aminoethyl)amine nickel(II) acetate perchlorate","","- C8 H21 Cl N4 Ni O6 -","- C8 H21 Cl N4 Ni O6 -","- C64 H168 Cl8 N32 Ni8 O48 -","8","2","KH1049","Fun, H.-K.; Yip, B.-C.; Lu, Z.-L.; Duan, C.-Y.; Tian, Y.-P.; You, X.-Z.","(Acetato-<i>O</i>,<i>O</i>')[tris(2-aminoethyl)amine-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']nickel(II) Perchlorate","Acta Crystallographica Section C","1996","52","3","509","512","10.1107/S0108270195010389","","","0.71073","MoKα","","0.0394","0.0375","","0.1078","0.1064","","","","1.045","1.061","1.061","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004632","9.458","0.001","9.644","0.001","9.889","0.001","94.81","0.02","117.76","0.02","114.16","0.02","684.9","0.3","293","","","","","","","","","","","3","P -1","-P 1","2","","","","- C13 H22 O5 -","- C13 H22 O5 -","- C26 H44 O10 -","2","1","KH1053","Bidyasagar, M.; Ravikumar, K.; Hassan, S. J.; Yadav, J. S.","Methyl 3-(<i>RS</i>)-Hydroxy-4-[(<i>RS</i>)-3,4,5,6-tetrahydro-2<i>H</i>-2-pyranyloxy]cyclohexanecarboxylate","Acta Crystallographica Section C","1996","52","3","687","689","10.1107/S0108270195011991","","","0.71069","MoKα","","","0.053","","","0.06","","","","","0.861","0.861","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004633","10.082","0.001","10.746","0.002","19.155","0.009","95.81","0.02","98.05","0.02","112.63","0.01","1869.1","1","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H42 Cd3 Cl6 N4 O11 -","- C24 H32 Cd3 Cl6 N4 O11 -","- C48 H64 Cd6 Cl12 N8 O22 -","2","1","KH1054","Wu, D.-D.; Mak, T. C. W.","Cadmium(II) Chloride Adduct with an Olefinic Double Betaine: <i>catena</i>-Poly[tetraaquadiethanoltris[dichlorocadmium(II)] <i>cis</i>-bis(4-dimethylamino-1-pyridinio)butenedioate hydrate]","Acta Crystallographica Section C","1996","52","3","526","529","10.1107/S0108270195011760","","","0.71073","MoKα","","","0.051","","","0.072","","","","","1.93","1.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004634","10.13","0.005","9.107","0.002","17.62","0.004","90","","106.57","0.03","90","","1558","0.9","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H25 Al N2 -","- C14 H25 Al N2 -","- C56 H100 Al4 N8 -","4","1","KH1055","Ma, X.; Wu, L.; Pan, Y.; Huang, X.; Wang, X.; Zhu, C.","Trimethyl(1-methyl-4-phenylpiperazine-<i>N</i>^1^)aluminium","Acta Crystallographica Section C","1996","52","3","607","609","10.1107/S0108270195012546","","","0.71073","MoKα","","","0.055","","","0.067","","","","","1.69","1.69","","","","","has coordinates","264421","2021-04-22","15:32:46",""
"2004635","8.266","0.002","30.465","0.005","8.334","0.001","90","","90","","90","","2098.7","0.7","293","","293","","","","","","","","","6","P n m a","-P 2ac 2n","62","","Bis(2-methyl-4-nitroanilinium) Tetrachlorocadmate","","- C14 H18 Cd Cl4 N4 O4 -","- C14 H18 Cd0.5 Cl3 N4 O4 -","- C56 H72 Cd2 Cl12 N16 O16 -","4","0.5","KH1059","Azumi, R.; Honda, K.; Goto, M.; Akimoto, J.; Oosawa, Y.; Tachibana, H.; Tanaka, M.; Matsumoto, M.","Bis(2-methyl-4-nitroanilinium) Tetrachlorocadmate","Acta Crystallographica Section C","1996","52","3","588","591","10.1107/S0108270195012935","","","0.7107","MoKα","","","0.043","","","0.042","","","","","1.23","1.23","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2004636","14.28","0.003","10.426","0.002","16.112","0.004","90","","112.065","0.014","90","","2223.1","0.9","240","0.2","240","0.2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","Tetrakis(dimethylsulphoxide-κ-O)copper(II) bis(perchlorate)","","- C8 H24 Cl2 Cu O12 S4 -","- C8 H24 Cl2 Cu O12 S4 -","- C32 H96 Cl8 Cu4 O48 S16 -","4","1","KH1069","Blake, A. J.; Grimditch, R. S.; Parsons, S.; Schröder, M.","Tetrakis(dimethyl sulfoxide-<i>O</i>)copper(II) Bis(perchlorate)","Acta Crystallographica Section C","1996","52","3","514","516","10.1107/S0108270195013795","","","0.71073","MoKα","","0.1548","0.0649","","0.1349","0.106","","","","0.977","1.119","1.119","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004637","6.835","0.001","6.995","0.002","8.54","0.001","86.77","0.005","88.663","0.008","84.456","0.013","405.68","0.14","150","1","150","1","","","","","","","","3","P -1","-P 1","2","β-methyl tricarballylic acid","2-methyl propane-1,2,3-tricarboxylic acid","","- C7 H10 O6 -","- C7 H10 O6 -","- C14 H20 O12 -","2","1","LI1138","Barnes, H. A.; Barnes, J. C.","Hydrogen Bonding in 2-Methyl-1,2,3-propanetricarboxylic Acid, Ammonium Dihydrogen 1,2,3-Propanetricarboxylate Hemihydrate and Tetraammonium 1,2,3,4-Butanetetracarboxylate Monohydrate","Acta Crystallographica Section C","1996","52","3","731","736","10.1107/S0108270195013527","","","0.71069","MoKα","","0.0505","0.036","","0.117","0.0896","","","","0.408","0.404","0.404","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004638","30.9331","0.0012","7.8035","0.0014","7.4103","0.0003","90","","93.565","0.004","90","","1785.3","0.3","150","1","150","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","ammonium tricarballylate hydrate (1:1:0.5)","propane-1,2,3-tricarboxylic acid, mono-ammonium salt hemi-hydrate","","- C6 H12 N O6.5 -","- C6 H11.49 N O6.5 -","- C48 H91.92 N8 O52 -","8","1","LI1138","Barnes, H. A.; Barnes, J. C.","Hydrogen Bonding in 2-Methyl-1,2,3-propanetricarboxylic Acid, Ammonium Dihydrogen 1,2,3-Propanetricarboxylate Hemihydrate and Tetraammonium 1,2,3,4-Butanetetracarboxylate Monohydrate","Acta Crystallographica Section C","1996","52","3","731","736","10.1107/S0108270195013527","","","0.71069","MoKα","","0.0589","0.04","","0.1","0.0866","","","","0.889","1.038","1.038","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004639","7.8714","0.0007","8.602","0.002","12.043","0.002","94.454","0.008","108.24","0.02","94.402","0.011","767.7","0.2","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","1,2,3,4-butanetetracarboxylic acid, tetra-ammonium salt, monohydrate","","- C8 H24 N4 O9 -","- C8 H24 N4 O9 -","- C16 H48 N8 O18 -","2","1","LI1138","Barnes, H. A.; Barnes, J. C.","Hydrogen Bonding in 2-Methyl-1,2,3-propanetricarboxylic Acid, Ammonium Dihydrogen 1,2,3-Propanetricarboxylate Hemihydrate and Tetraammonium 1,2,3,4-Butanetetracarboxylate Monohydrate","Acta Crystallographica Section C","1996","52","3","731","736","10.1107/S0108270195013527","","","0.71069","MoKα","","0.0489","0.035","","0.12","0.0906","","","","0.368","0.35","0.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004640","6.1621","0.0009","15.731","0.004","13.708","0.004","90","","102.07","0.02","90","","1299.4","0.5","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-diacetyl-1,4-dihydro-4-phenylpyridine","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C60 H60 N4 O8 -","4","1","LI1140","Beddoes, R. L.; Arshad, N.; Joule, J. A.","The Zinc‒Acetic Anhydride Reduction of Pyridines","Acta Crystallographica Section C","1996","52","3","654","656","10.1107/S0108270195013539","","","1.5418","CuKα","","","0.066","","","0.083","","","","","2.32","2.32","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004641","8.725","0.002","7.891","0.003","19.127","0.003","90","","100.03","0.03","90","","1296.7","0.6","296","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H12 Au Br N3 P -","- C9 H12 Au Br N3 P -","- C36 H48 Au4 Br4 N12 P4 -","4","1","MU1183","Al-Arfaj, A. R.; Hussain, M. S.; Isab, A. A.; Akhtar, M. N.","Bromo[tris(2-cyanoethyl)phosphine]gold(I), [(CEP)AuBr]","Acta Crystallographica Section C","1996","52","3","550","553","10.1107/S0108270195009814","","","0.71073","MoKα","","","0.0384","","","0.0421","","","","","1.001","1.001","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004642","9.334","0.008","11.112","0.005","14.526","0.009","90","","98.14","0.07","90","","1491.4","1.7","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H16 N2 Ni S5 -","- C9 H16 N2 Ni S5 -","- C36 H64 N8 Ni4 S20 -","4","1","MU1191","Sheng, T.; Wu, X.; Huang, Q.; Wang, Q.","(2-Thioxo-1,3-dithiole-4,5-dithiolato)(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine)nickel(II)","Acta Crystallographica Section C","1996","52","3","539","541","10.1107/S0108270195009826","","","0.71069","MoKα","","","0.054","","","0.063","","","","","1.14","1.14","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004643","13.866","0.002","14.0228","0.0008","15.316","0.001","100.16","0.006","97.712","0.009","104.641","0.007","2785.7","0.5","293","","293","","","","","","","","","4","P -1","-P 1","2","","1,1'-bis(octamethylferrocenium-yl)methyl ferrocene tetracyanoethenide pentacyanopropenide","","- C62 H62 Fe3 N9 -","- C62 H62 Fe3 N9 -","- C124 H124 Fe6 N18 -","2","1","MU1195","Barlow, S.; O'Hare, D.","[{(C~5~Me~4~H)Fe(C~5~Me~4~)CH~2~C~5~H~4~}~2~Fe]^2+^.[C~2~(CN)~4~]^{-^}.[C~3~(CN)~5~]^{-^}","Acta Crystallographica Section C","1996","52","3","578","581","10.1107/S010827019500984X","","","0.71073","MolybdenumKα","","","0.051","","","0.06","","","","","1.129","1.129","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004644","6.442","0.003","8.23","0.001","10.631","0.003","106.94","0.02","98.28","0.03","106.12","0.03","502.2","0.3","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H26 Ni O2 S4 -","- C16 H26 Ni O2 S4 -","- C16 H26 Ni O2 S4 -","1","0.5","MU1211","Xiong, R.-G.; Liu, C.-M.; Li, H.-Z.; You, X.-Z.; Huang, X.-Y.","Bis[<i>O</i>-(4-methylcyclohexyl) dithiocarbonato-<i>S</i>,<i>S</i>']nickel(II)","Acta Crystallographica Section C","1996","52","3","519","521","10.1107/S010827019501078X","","","0.71073","MoKα","","","0.036","","","0.047","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004645","10.682","0.002","12.742","0.002","15.508","0.004","90","","103.51","0.01","90","","2052.4","0.7","296","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H16 N2 Ni O3 S4 -","- C17 H16 N2 Ni O3 S4 -","- C68 H64 N8 Ni4 O12 S16 -","4","1","MU1213","Xiong, R.-G.; Zuo, J.-L.; Xu, E.-J.; You, X.-Z.; Huang, X.-Y.","(4,5-Diazafluoren-9-one-<i>N</i>^4^,<i>N</i>^5^)bis(<i>O</i>-ethyl dithiocarbonato-<i>S</i>,<i>S</i>')nickel(II)","Acta Crystallographica Section C","1996","52","3","521","523","10.1107/S0108270195010791","","","0.71073","MoKα","","","0.029","","","0.045","","","","","1.43","1.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004646","17.344","0.005","8.336","0.005","18.206","0.004","90","","117.63","0.01","90","","2332","1.6","296","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 N2 Ni O2 S4 -","- C20 H22 N2 Ni O2 S4 -","- C80 H88 N8 Ni4 O8 S16 -","4","1","MU1214","Guo, Y.-H.; Xue, Y.-Q.; Xiong, R.-G.; Zuo, J.-L.; You, X.-Z.; Huang, X.-Y.","(2,9-Dimethyl-1,10-phenanthroline-<i>N</i>^1^,<i>N</i>^10^)bis(<i>O</i>-ethyl dithiocarbonato-<i>S</i>,<i>S</i>')nickel(II)","Acta Crystallographica Section C","1996","52","3","523","525","10.1107/S0108270195010808","","","0.71073","MoKα","","","0.053","","","0.069","","","","","1.78","1.78","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004647","23.6801","0.0009","12.9415","0.0009","7.8455","0.0005","90","","106.069","0.004","90","","2310.4","0.2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Diaqua[2,6-diacetylpyridine bis(thiosemicarbazone)]manganese(II) Diperchlorate","","- C11 H19 Cl2 Mn N7 O10 S2 -","- C11 H19 Cl2 Mn N7 O10 S2 -","- C44 H76 Cl8 Mn4 N28 O40 S8 -","4","0.5","MU1217","Othman, A. H.; Lee, K.-L.; Fun, H.-K.; Yip, B.-C.","Diaqua[2,6-diacetylpyridine bis(thiosemicarbazone)]manganese(II) Diperchlorate","Acta Crystallographica Section C","1996","52","3","602","605","10.1107/S0108270195012145","","","0.71073","MoKα","","0.0579","0.0531","","0.1552","0.1516","","","","1.064","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004648","13.226","0.002","13.23","0.002","14.908","0.003","87.63","0.01","78.64","0.02","66.76","0.01","2348.1","0.7","293","","293","","","","","","","","","7","P -1","-P 1","2","Bromo-bis(triphenylphosphine-P})-(N,N-dibutyl-N'-phenylthiourea-S) copper(I)","Bromobis(triphenylphosphine-P})-(N,N-dibutyl-N'-phenylthiourea-S) copper(I)","","- C51 H54 Br Cu N2 P2 S -","- C51 H54 Br Cu N2 P2 S -","- C102 H108 Br2 Cu2 N4 P4 S2 -","2","1","NA1183","Singh, R.; Dikshit, S. K.","Bromo(<i>N</i>,<i>N</i>-dibutyl-<i>N</i>'-phenylthiourea-<i>S</i>)bis(triphenylphosphine-<i>P</i>)copper(I), [Cu(PPh~3~)~2~(dbptH)Br]","Acta Crystallographica Section C","1996","52","3","635","637","10.1107/S0108270195006500","","","0.71073","MoKα","","0.072","0.037","","0.034","0.032","","","","1.854","2.225","2.225","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004649","6.178","0.001","13.787","0.002","24.819","0.006","90","","90","","90","","2114","0.7","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1,8-Dimethyl-2-[(3-furoyl)aminomethyl]-5-phenyl- 2,3-dihydro-1H-1,4-benzodiazepin-4-ium Chloride","","- C23 H24 Cl N3 O2 -","- C23 H24 Cl N3 O2 -","- C92 H96 Cl4 N12 O8 -","4","1","NA1198","Blaton, N. M.; Peeters, O. M.; Meurisse, R. L.; De Ranter, C. J.","2-[(3-Furoyl)aminomethyl]-1,7-dimethyl-5-phenyl-2,3-dihydro-1<i>H</i>-1,4-benzodiazepin-4-ium Chloride","Acta Crystallographica Section C","1996","52","3","691","692","10.1107/S0108270195012893","","","0.71073","MoKα","","0.0824","0.0407","","0.1109","0.1109","","","","1.03","1.03","1.03","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004650","31.328","0.002","7.236","0.001","13.216","0.002","90","","97.8","0.1","90","","2968.2","1","295","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H14 Cl2 Cu N6 O2 -","- C10 H14 Cl2 Cu N6 O2 -","- C80 H112 Cl16 Cu8 N48 O16 -","8","1","NA1199","Valle, G.; Ettorre, R.; Peruzzo, V.","Dichlorobis(1-methylcytosine)copper(II)","Acta Crystallographica Section C","1996","52","3","626","628","10.1107/S0108270195013382","","","0.7107","MoKα","","","0.049","","","0.054","","","","","1.14","1.14","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004651","14.342","0.001","7.799","0.0008","21.592","0.002","90","0","91.6","0.01","90","0","2414.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Tricarbonyl(η^6^-1-tetralol)chromium","","- C13 H12 Cr O4 -","- C13 H12 Cr O4 -","- C104 H96 Cr8 O32 -","8","2","NA1200","Sardone, N.; Seresini, P.; Zecchi, G.","Tricarbonyl(η^6^-1-tetralol)chromium","Acta Crystallographica Section C","1996","52","3","613","615","10.1107/S0108270195012856","","","1.54184","CuKα","","0.04","0.034","","","0.034","","","","","1.07","1.07","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2004652","12.0135","0.0007","4.339","0.002","6.5864","0.0004","90","","90","","90","","343.33","0.16","293","","","","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- B2 O4 Sr -","- B2 O4 Sr -","- B8 O16 Sr4 -","4","0.5","OH1085","Kim, J.-B.; Lee, K.-S.; Suh, I.-H.; Lee, J.-H.; Park, J.-R.; Shin, Y.-H.","Strontium Metaborate, SrB~2~O~4~","Acta Crystallographica Section C","1996","52","3","498","500","10.1107/S0108270195010341","","","0.71073","MoKα","","","0.0504","","","0.0551","","","","","1.5271","1.5271","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004653","10.186","0.004","23.842","0.004","6.62","0.003","90","","90","","90","","1607.7","1","298","","298","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Sodium (ethylenediaminetetraacetato)gallate(III) trihydrate","","- C10 H18 Ga N2 Na O11 -","- C10 Ga N2 Na O11 -","- C40 Ga4 N8 Na4 O44 -","4","1","OH1086","Nakamura, K.; Kurisaki, T.; Wakita, H.; Yamaguchi, T.","Sodium (Ethylenediaminetetraacetato)gallate(III) Trihydrate","Acta Crystallographica Section C","1996","52","3","573","575","10.1107/S0108270195012017","","","0.7107","MoKα","","","0.055","","","0.063","","","","","2.78","2.78","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004654","6.299","0.001","9.432","0.003","6.967","0.002","90","","90","","90","","413.92","0.19","293","1","293","1","","","","","","","","5","P m m n :2","-P 2ab 2a","59","","","","- Cl Cu3 Er O8 Se2 -","- Cl Cu3 Er O8 Se2 -","- Cl2 Cu6 Er2 O16 Se4 -","2","0.25","OH1088","Berrigan, R.; Gatehouse, B. M.","Cu~3~Er(SeO~3~)~2~O~2~Cl, the Erbium Analogue of Francisite","Acta Crystallographica Section C","1996","52","3","496","497","10.1107/S0108270195014120","","","0.71073","MoKα","","","0.034","","","0.039","","","","","0.98","0.98","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004655","10.169","0.003","8.748","0.002","15.254","0.005","104.45","0.05","97.4","0.05","109.22","0.05","1207.3","0.9","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C27 H32 N4 O2 -","- C27 H32 N4 O2 -","- C54 H64 N8 O4 -","2","1","PA1199","Pierrot, M.; Giorgi, M.; El Messaoudi, M.; Hasnaoui, A.; El Aatmani, M.; Lavergne, J. P.","3,12-Dimesityl-6,8-dimethyl-5,10-dioxa-1,2,4,11-tetraazatricyclo[7.3.1.0^2,6^]trideca-3,7,11-triene and 3,12-Dimesityl-6,8,13-trimethyl-5,10-dioxa-1,2,4,11-tetraazatricyclo[7.3.1.0^2,6^]trideca-3,7,11-triene","Acta Crystallographica Section C","1996","52","3","736","739","10.1107/S0108270195013126","","","0.71073","MoKα","","","0.041","","","0.054","","","","","1.84","1.84","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004656","9.894","0.003","9.908","0.003","14.78","0.005","105.29","0.05","94.07","0.05","112.2","0.05","1270.2","1","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H34 N4 O2 -","- C28 H34 N4 O2 -","- C56 H68 N8 O4 -","2","1","PA1199","Pierrot, M.; Giorgi, M.; El Messaoudi, M.; Hasnaoui, A.; El Aatmani, M.; Lavergne, J. P.","3,12-Dimesityl-6,8-dimethyl-5,10-dioxa-1,2,4,11-tetraazatricyclo[7.3.1.0^2,6^]trideca-3,7,11-triene and 3,12-Dimesityl-6,8,13-trimethyl-5,10-dioxa-1,2,4,11-tetraazatricyclo[7.3.1.0^2,6^]trideca-3,7,11-triene","Acta Crystallographica Section C","1996","52","3","736","739","10.1107/S0108270195013126","","","0.71073","MoKα","","","0.04","","","0.053","","","","","1.85","1.85","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004657","6.966","0.004","8.993","0.004","10.932","0.004","96.03","0.15","104.12","0.16","104.84","0.16","631.7","1","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H10 Cr O5 -","- C13 H10 Cr O5 -","- C26 H20 Cr2 O10 -","2","1","PA1203","Lamiot, J.; Baert, F.; Brocard, J.; Goetgheluck, S.","Tricarbonyl(η^6^-3-methyl-2-vinylbenzoic acid)chromium","Acta Crystallographica Section C","1996","52","3","595","597","10.1107/S0108270195013114","","","0.71073","MoKα","","","0.0474","","","0.0479","","","","","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004658","12.391","0.004","13.403","0.004","8.849","0.003","98.35","0.02","89.96","0.02","62.55","0.02","1286.5","0.8","173","","","","","","","","","","","8","P -1","-P 1","2","","","","- C17 H18 Cl2 Cu F6 N2 O6 S3 -","- C17 H18 Cl2 Cu F6 N2 O6 S3 -","- C34 H36 Cl4 Cu2 F12 N4 O12 S6 -","2","1","PA1205","Diebold, A.; Kyritsakas, N.; Fischer, J.; Weiss, R.","A Bis(6-methyl-2-pyridylmethyl) Thioether (DMPT) Copper(II) Complex, [Cu(OSO~2~CF~3~)~2~(C~14~H~16~N~2~S)].CH~2~Cl~2~","Acta Crystallographica Section C","1996","52","3","632","634","10.1107/S0108270195012649","","","1.54184","CuKα","","","0.037","","","0.06","","","","","1.364","1.364","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004659","23.85","0.02","6.08","0.01","12.14","0.02","90","","90","","90","","1760","4","295","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H14 F6 O4 -","- C17 H14 F6 O4 -","- C68 H56 F24 O16 -","4","1","PA1209","Hamzaoui, F.; Baert, F.","A New Pyrethroid Insecticide, RU41414","Acta Crystallographica Section C","1996","52","3","689","690","10.1107/S0108270195013102","","","0.71073","MoKα","","","0.05","","","0.05","","","","","1.07","1.07","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2004660","14.63","0.004","12.616","0.003","11.709","0.003","90","","90","","90","","2161.2","1","295","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C11 H13 Cl O Ti -","- C11 H13 Cl O Ti -","- C88 H104 Cl8 O8 Ti8 -","8","1","SX1010","Gibson, D. H.; Ding, Y.; Mashuta, M. S.; Richardson, J. F.","Chlorobis(η^5^-cyclopentadienyl)methoxytitanium","Acta Crystallographica Section C","1996","52","3","559","560","10.1107/S0108270195012297","","","0.71073","MoKα","","","0.039","","","0.04","","","","","2.13","2.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004661","6.629","0.001","7.908","0.001","12.985","0.001","82.556","0.008","76.504","0.009","67.621","0.007","611.43","0.13","297","","","","","","","","","","","3","P -1","-P 1","2","","","","- C15 H16 O3 -","- C15 H16 O3 -","- C30 H32 O6 -","2","1","SZ1015","Cote, M. L.; Thompson, H. W.; Lalancette, R. A.","Hydrogen-Bonding Pattern of a β-Keto Acid: (±)-10-oxo-3,4-benzobicyclo[4.3.1]dec-3-ene-1-carboxylic Acid","Acta Crystallographica Section C","1996","52","3","684","687","10.1107/S0108270195012303","","","0.71073","MoKα","","","0.045","","","0.0581","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004662","7.668","0.002","8.997","0.001","9.01","0.002","115.75","0.02","91.32","0.02","97.45","0.02","552.9","0.2","296","","","","","","","","","","","4","P -1","-P 1","2","","","","- C8 H15 O4 P -","- C8 H15 O4 P -","- C16 H30 O8 P2 -","2","1","SZ1035","Sanders, T. C.; Hammond, G. B.; Golen, J. A.; Williard, P. G.","Diethyl (1-Hydroxy-2-butynyl)phosphonate","Acta Crystallographica Section C","1996","52","3","667","669","10.1107/S0108270195012315","","","0.71073","MoKα","","","0.075","","","0.089","","","","","1.76","1.76","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004663","8.758","0.002","10.01","0.004","28.466","0.006","90","0.02","90","0.02","90","0.02","2495.5","1.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C27 H40 O6 -","- C27 H40 O6 -","- C108 H160 O24 -","4","1","TA1034","Cambie, R. C.; Lal, A. R.; Rickard, C. E. F.","A Sesterterpene Lactone from <i>Petrosaspongia nigra</i> sp. nov.","Acta Crystallographica Section C","1996","52","3","709","711","10.1107/S0108270195010857","","","0.71069","MoKα","","0.0984","0.0564","","0.2345","0.1183","","","","1.102","1.103","1.103","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004664","12.141","0.002","12.01","0.001","19.248","0.002","90","","97.03","0.01","90","","2785.5","0.6","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N,N'-bis(2-aminoethyl)-N,N'-bis(2-ammonioethyl)ethylenediamineplatinum(II) bis(tetrachloroplatinate) trihydrate","","- C10 H36 Cl8 N6 O3 Pt3 -","- C10 H30 Cl8 N6 O3 Pt3 -","- C40 H120 Cl32 N24 O12 Pt12 -","4","1","TA1044","Sakai, K.; Tanaka, Y.; Tsubomura, T.","[<i>N</i>,<i>N</i>'-Bis(2-aminoethyl-κ<i>N</i>)-<i>N</i>,<i>N</i>'-bis(2-ammonioethyl)ethylenediamine-κ^2^<i>N</i>,<i>N</i>']platinum(II) Bis(tetrachloroplatinate) Trihydrate","Acta Crystallographica Section C","1996","52","3","541","543","10.1107/S0108270195011413","","","0.71069","MoKα","","","0.0669","","","0.0443","","","","","1.51","1.51","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004665","17.578","0.003","9.909","0.004","22.945","0.004","90","","90","","90","","3996.6","1.9","296","1","296","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C23 H20 Cl Ni P -","- C23 H20 Cl Ni P -","- C184 H160 Cl8 Ni8 P8 -","8","1","TA1050","Hockless, D. C. R.; Whittall, I. R.; Humphrey, M. G.","Chloro(η^5^-cyclopentadienyl)(triphenylphosphine)nickel(II)","Acta Crystallographica Section C","1996","52","3","535","537","10.1107/S0108270195011103","","","0.7107","MoKα","","","0.0323","","","0.021","","","","","1.728","1.728","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004666","12.575","0.002","14.454","0.003","18.365","0.004","90","","90","","90","","3338","1.1","293","","293.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H34 F6 Fe P4 -","- C33 H34 F6 Fe P4 -","- C132 H136 F24 Fe4 P16 -","4","1","TA1051","Pabel, M.; Willis, A. C.; Wild, S. B.","[<i>R</i>-(<i>R</i>*,<i>R</i>*)]-(η^5^-Cyclopentadienyl)[1,2-phenylenebis(methylphenylphosphine-<i>P</i>)](1-phenylphosphirane-<i>P</i>)iron(II) Hexafluorophosphate","Acta Crystallographica Section C","1996","52","3","557","559","10.1107/S0108270195011784","","","0.7107","MoKα","","","0.056","","","0.032","","","","","1.96","1.96","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004667","7.089","0.003","13.781","0.001","10.141","0.003","90","","91.39","0.03","90","","990.4","0.5","213","1","213","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H28 N2 Pt S4 -","- C16 H28 N2 Pt S4 -","- C32 H56 N4 Pt2 S8 -","2","0.5","TA1052","Heath, G. A.; Hockless, D. C. R.; Prenzler, P. D.","Bis(<i>N</i>,<i>N</i>-<i>cyclo</i>-heptamethylenedithiocarbamato-<i>S</i>,<i>S</i>')platinum(II), a Platinum Dithiocarbamate Containing a Large Carbocyclic Ring","Acta Crystallographica Section C","1996","52","3","537","539","10.1107/S0108270195011383","","","0.7107","MoKα","","","0.035","","","0.047","","","","","2.82","2.82","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004668","7.025","0.0014","8.408","0.002","21.89","0.004","90","","97.89","0.03","90","","1280.7","0.5","150","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","monophenyl carborane","1-Phenyl-1,2-dicarba-closo-dodecaborane","","- C8 H16 B10 -","- C8 H16 B10 -","- C32 H64 B40 -","4","1","AB1287","Thomas, R. Ll.; Rosair, G. M.; Welch, A. J.","A New Crystalline Form of 1-Phenyl-1,2-dicarba-<i>closo</i>-dodecaborane(12)","Acta Crystallographica Section C","1996","52","4","1024","1026","10.1107/S010827019501198X","","","0.71073","MoKα","","0.0632","0.0544","","0.1431","0.1362","","","","1.031","1.072","1.072","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2004669","8.289","0.005","6.312","0.004","11.786","0.004","90","","93.19","0.03","90","","615.7","0.6","295","1","295","1","","","","","","","","2","P 1 21/a 1","-P 2yab","14","","","","- C18 H12 -","- C18 H12 -","- C36 H24 -","2","0.5","AB1295","Capparelli, M. V.; Machado, R.; De Sanctis, Y.; Arce, A. J.","<i>trans</i>-1,1'-Bis(indenylidene)","Acta Crystallographica Section C","1996","52","4","947","949","10.1107/S0108270195014600","","","0.71069","MoKα","","","0.0421","","","0.0428","","","","","2.908","2.908","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004670","10.89","0.001","17.714","0.003","8.94","0.001","97.24","0.01","105.824","0.008","93.82","0.01","1636.8","0.4","243","2","243","2","","","","","","","","6","P 1","P 1","1","","(S)-(+)-[(benzyloxymethyl)(tert-butyl)methylsilyl] methyl ketone 2,4,6- triisopropylphenylsulfonylhydrazone","","- C30 H48 N2 O3 S Si -","- C30 H48 N2 O3 S Si -","- C60 H96 N4 O6 S2 Si2 -","2","2","AB1320","Bratovanov, S.; Linden, A.; Bienz, S.","Absolute Configuration of (<i>S</i>)-(+)-[(Benzyloxymethyl)(<i>tert</i>-butyl)methylsilyl] Methyl Ketone","Acta Crystallographica Section C","1996","52","4","1045","1047","10.1107/S0108270195014338","","","0.71073","MoKα","","0.0853","0.0501","","0.1446","0.127","","","","1.012","1.046","1.046","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004671","7.133","0.001","13.206","0.001","20.355","0.005","90","","90","","90","","1917.4","0.6","294","1","294","1","","","","","","","","4","P c a b","-P 2bc 2ac","61","","N,N-Dimethyl-2,4-dinitroaniline","","- C8 H9 N3 O4 -","- C8 H9 N3 O4 -","- C64 H72 N24 O32 -","8","1","AB1321","Low, J. N.; Doidge-Harrison, S. M. S. V.; Cobo, J.","<i>N</i>,<i>N</i>-Dimethyl-2,4-dinitroaniline","Acta Crystallographica Section C","1996","52","4","964","966","10.1107/S0108270195014612","","","0.7107","MolybdenumKα","","0.1113","0.0464","","0.1099","0.0986","","","","0.799","1.146","1.146","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004672","25.303","0.003","9.953","0.004","25.071","0.003","90","","112.08","0.01","90","","5851","3","300","","300","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2,2'-bipyridyl)(methyl)(phenyl)palladium(II)","","- C17 H16 N2 Pd -","- C17 H16 N2 Pd -","- C272 H256 N32 Pd16 -","16","4","AB1331","Spek, A. L.; Janssen, M. D.; Markies, B. A.; van Koten, G.","A Second Polymorph of 2,2'-Bipyridyl(methyl)(phenyl)palladium(II)","Acta Crystallographica Section C","1996","52","4","868","871","10.1107/S0108270195014909","","","0.71073","MoKα","","","0.069","","","0.19","","","","","1.023","1.023","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004673","22.264","0.004","14.249","0.004","22.004","0.003","90","","93.562","0.015","90","","6967","3","294","1","294","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Bis[μ-bis(diphenylphosphino)hexane-P,P']digold(I) hexafluoroantimonate acetonitrile solvate","","- C63.2 H68.8 Au2 F12 N1.6 P4 Sb2 -","- C60 H64 Au2 F12 P4 Sb2 -","- C240 H256 Au8 F48 P16 Sb8 -","4","0.5","AB1344","Ferguson, G.; Gabe, E. J.; Spalding, T. R.; Kelleher, A.-M.","Bis[μ-bis(diphenylphosphino)hexane-<i>P</i>:<i>P</i>']digold(I) Hexafluoroantimonate Acetonitrile Solvate","Acta Crystallographica Section C","1996","52","4","768","770","10.1107/S0108270196000996","","","0.7107","MolybdenumKα","","0.0798","0.0372","","0.0982","0.0891","","","","0.985","1.144","1.144","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004674","9.9005","0.0008","10.5082","0.0012","11.314","0.002","62.779","0.014","72.583","0.011","88.966","0.008","988.9","0.3","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","trans-bis(tricyclohexylphosphine)tetracarbonylmolybdenum(0)","","- C40 H66 Mo O4 P2 -","- C40 H66 Mo O4 P2 -","- C40 H66 Mo O4 P2 -","1","0.5","AB1347","Alyea, E. C.; Ferguson, G.; Kannan, S.","<i>trans</i>-Tetracarbonylbis(tricyclohexylphosphine)molybdenum(0), <i>trans</i>-[Mo(CO)~4~(PCy~3~)~2~]","Acta Crystallographica Section C","1996","52","4","765","767","10.1107/S010827019600100X","","","0.7107","MolybdenumKα","","0.0844","0.0411","","0.0925","0.0841","","","","0.962","1.091","1.091","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004675","9.498","0.002","14.443","0.003","20.318","0.004","78.56","0.03","85.43","0.03","88.77","0.03","2723.1","1","298","","","","","","","","","","","3","P -1","-P 1","2","","","","- C37 H26 O2 -","- C37 H26 O2 -","- C148 H104 O8 -","4","2","AS1145","Mathew, T.; Kumar, S. A.; Das, S.; Rath, N. P.; George, M. V.","A Photoproduct Derived from 9-Benzyl-Substituted Dibenzobarrelene","Acta Crystallographica Section C","1996","52","4","942","944","10.1107/S0108270195013667","","","1.54178","CuKα","","","0.0571","","","0.0796","","","","","1.01","1.01","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004676","7.424","0.001","7.325","0.001","13.959","0.001","78.67","0.01","75.15","0.01","63.98","0.01","656.28","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H12 N4 O S -","- C15 H12 N4 O S -","- C30 H24 N8 O2 S2 -","2","1","AS1188","Song, C. E.; Jin, B. W.; Jeong, J. H.","3-(6-Methoxy-2-benzimidazolyl)benzothiazolin-2-imine","Acta Crystallographica Section C","1996","52","4","962","964","10.1107/S0108270195013357","","","0.71073","MoKα","","0.0388","0.0376","","0.1006","0.0996","","","","1.099","1.108","1.108","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004677","10.246","0.002","14.487","0.002","4.2536","0.0005","90","","90.23","0.01","90","","631.37","0.17","293","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C12 H8 B2 I2 -","- C12 H8 B2 I2 -","- C24 H16 B4 I4 -","2","0.25","AS1194","Akutsu, H.; Kozawa, K.; Uchida, T.","5,10-Diiodo-5,10-dihydroboranthrene","Acta Crystallographica Section C","1996","52","4","991","993","10.1107/S0108270195010742","","","0.71073","MoKα","","","0.054","","","0.039","","","","","1.53","1.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004678","27.638","0.002","11.938","0.003","16.433","0.002","90","","120.208","0.006","90","","4685.7","1.4","296","","296","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis(μ~3~-oxo-O,O,O)-heptakis(μ~2~-acetato-O,O')-bis(2,2'-bipyridine) tetramanganese(III) perchlorate","","- C34 H37 Cl Mn4 N4 O20 -","- C33 H37 Cl Mn4 N4 O20 -","- C132 H148 Cl4 Mn16 N16 O80 -","4","0.5","AS1198","Tamane, T.; Tsubomura, T.; Sakai, K.","[Mn~4~^III^(μ~3~-O)~2~(μ-O~2~CMe)~7~(2,2'-bipyridine)~2~]ClO~4~","Acta Crystallographica Section C","1996","52","4","777","779","10.1107/S0108270195013333","","","0.71069","MoKα","","","0.0752","","","0.066","","","","","3.33","3.33","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004679","8.27","0.002","9.361","0.002","10.689","0.002","113.88","0.01","98.81","0.02","105.94","0.01","693.9","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,1'-(dithiodicarbonothioyl)bispyrrolidine.","","- C10 H16 N2 S4 -","- C10 H16 N2 S4 -","- C20 H32 N4 S8 -","2","1","AS1200","Yamin, B. M.; Suwandi, S. A.; Fun, H.-K.; Sivakumar, K.; Shawkataly, O. B.","Triclinic Form of Dipyrrolidinylthiuram Disulfide","Acta Crystallographica Section C","1996","52","4","951","953","10.1107/S0108270195013059","","","0.71073","MoKα","","0.0755","0.043","","0.1146","0.1044","","","","0.869","1.049","1.049","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004680","8.826","0.001","9.464","0.001","35.02","0.004","90","","90","","90","","2925.2","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Boc-Gly-Gly-(L)-Phe-(D)-Leu-OMe dihydrate","","","- C25 H42 N4 O9 -","- C25 H42 N4 O9 -","- C100 H168 N16 O36 -","4","1","AS1206","Fenude, E.; Casalone, G.","Three Protected Tetrapeptides","Acta Crystallographica Section C","1996","52","4","973","978","10.1107/S0108270195013345","","","0.71073","MoKα","","0.0841","0.0477","","0.1071","0.0922","","","","1.055","1.103","1.103","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004681","8.919","0.002","9.353","0.001","35.408","0.004","90","","90","","90","","2953.7","0.8","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Boc-Gly-Gly-(L)-Phe-(D)-Met-OMe dihydrate","","","- C24 H40 N4 O9 S -","- C24 H40 N4 O9 S -","- C96 H160 N16 O36 S4 -","4","1","AS1206","Fenude, E.; Casalone, G.","Three Protected Tetrapeptides","Acta Crystallographica Section C","1996","52","4","973","978","10.1107/S0108270195013345","","","0.71073","MoKα","","0.0762","0.0507","","0.1316","0.116","","","","1.006","1.033","1.033","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004682","8.879","0.001","9.344","0.001","35.674","0.004","90","","90","","90","","2959.7","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Boc-Gly-Gly-(D)-Phe-(L)-Nle-OMe dihydrate","","","- C25 H42 N4 O9 -","- C25 H42 N4 O9 -","- C100 H168 N16 O36 -","4","1","AS1206","Fenude, E.; Casalone, G.","Three Protected Tetrapeptides","Acta Crystallographica Section C","1996","52","4","973","978","10.1107/S0108270195013345","","","0.71073","MoKα","","0.0808","0.0455","","0.1043","0.0917","","","","1.018","1.094","1.094","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004683","11.323","0.002","17.602","0.004","9.852","0.002","90","","101.94","0.02","90","","1921.1","0.7","298","","","","","","","","","","","3","P 1 21/m 1","","","","","","- C75 H14 O2 -","- C72.5 H14 O2 -","- C145 H28 O4 -","2","0.5","AS1208","Tezuka, Y.; Kawasaki, N.; Yajima, H.; Ishii, T.; Oyama, T.; Takeuchi, K.; Nakao, A.; Katayama, C.","Bis(4-methoxyphenyl)methano[60]fullerene with a Methano Bridge at the 6‒6-Ring Junction","Acta Crystallographica Section C","1996","52","4","1008","1010","10.1107/S0108270195013096","","","0.71073","MoKα","","","0.041","","","0.038","","","","","0.756","0.756","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004684","8.759","0.001","11.745","0.003","7.322","0.001","91.54","0.02","111.07","0.01","82","0.02","695.8","0.2","296","","296","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H14 O4 S3 -","- C12 H14 O4 S3 -","- C24 H28 O8 S6 -","2","1","AS1212","Parvez, M.; Mesher, S. T. E.; Clark, P. D.","2,3-Bis(ethylsulfonyl)benzo[<i>b</i>]thiophene","Acta Crystallographica Section C","1996","52","4","905","907","10.1107/S0108270195013369","","","0.71069","MoKα","","","0.0375","","","0.0383","","","","","2.081","2.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004685","6.959","0.001","10.778","0.002","9.489","0.002","90","","109.28","0.02","90","","671.8","0.2","193","","193","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H8 N6 O3 -","- C2 H8 N6 O3 -","- C8 H32 N24 O12 -","4","1","BK1041","Martin, A.; Pinkerton, A. A.; Schiemann, A.","Energetic Materials: the Biguanidium Nitrates","Acta Crystallographica Section C","1996","52","4","966","970","10.1107/S0108270195012200","","","0.71073","MoKα","","0.046","0.046","","","0.048","","","","","1.42","1.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004686","14.0232","0.0008","6.8842","0.0005","8.9541","0.0005","90","","90","","90","","864.42","0.09","193","","193","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C2 H9 N7 O6 -","- C2 H9 N7 O6 -","- C8 H36 N28 O24 -","4","1","BK1041","Martin, A.; Pinkerton, A. A.; Schiemann, A.","Energetic Materials: the Biguanidium Nitrates","Acta Crystallographica Section C","1996","52","4","966","970","10.1107/S0108270195012200","","","0.71073","MoKα","","0.033","0.027","","","0.037","","","","","0.854","0.854","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004687","7.409","0.001","7.619","0.001","9.843","0.001","82.02","0.01","83.2","0.01","69.92","0.01","515.3","0.12","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C2 H9 Cl2 N5 O8 -","- C2 H9 Cl2 N5 O8 -","- C4 H18 Cl4 N10 O16 -","2","1","BK1092","Martin, A.; Pinkerton, A. A.","Two Energetic Ionic Materials: the Biguanidium Perchlorates","Acta Crystallographica Section C","1996","52","4","1048","1052","10.1107/S0108270195014624","","","0.71073","MoKα","","0.042","0.03","","","0.035","","","","","3.205","3.205","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004688","7.7421","0.0009","9.874","0.002","12.267","0.002","112.75","0.01","91.89","0.01","111.91","0.01","784.9","0.2","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C2 H8 Cl N5 O4 -","- C2 H8 Cl1.5 N5 O6 -","- C8 H32 Cl6 N20 O24 -","4","2","BK1092","Martin, A.; Pinkerton, A. A.","Two Energetic Ionic Materials: the Biguanidium Perchlorates","Acta Crystallographica Section C","1996","52","4","1048","1052","10.1107/S0108270195014624","","","0.71073","MoKα","","0.045","0.036","","","0.047","","","","","2.677","2.677","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004689","6.759","0.002","13.803","0.001","15.124","0.003","90","","109.43","0.01","90","","1330.6","0.5","293","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C12 H10 Cu N3 O5 P -","- C24 H20 Cu2 N6 O10 P2 -","- C48 H40 Cu4 N12 O20 P4 -","2","0.5","BK1160","Parker, O. J.; Harvey, R. M.; Breneman, G. L.","Di-μ-phosphinato-bis[(1,10-phenanthroline)copper(II)] Nitrate, [Cu~2~(H~2~PO~2~)~2~(phen)~2~](NO~3~)~2~","Acta Crystallographica Section C","1996","52","4","871","873","10.1107/S0108270195010675","","","0.71073","MoKα","","","0.029","","","0.054","","","","","2.55","2.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004690","9.72","0.004","7.657","0.002","14.708","0.007","90","","103.63","0.04","90","","1063.8","0.7","298","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H38 O4 -","- C22 H38 O4 -","- C44 H76 O8 -","2","1","BK1162","Zhou, L.; Timmermann, B. N.; Grittini, C.; Bruck, M. A.; Enemark, J. H.","Tarapacol 15-Acetate, a New Diterpenoid from <i>Grindelia tarapacana Phil</i>.","Acta Crystallographica Section C","1996","52","4","1042","1044","10.1107/S0108270195013473","","","0.71073","MoKα","","","0.06","","","0.067","","","","","1.92","1.92","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004691","9.527","0.001","10.731","0.001","22.525","0.002","90","","99.63","0.01","90","","2270.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bisdiphenylphosphino methane disulfide","","- C25 H22 P2 S2 -","- C25 H22 P2 S2 -","- C100 H88 P8 S8 -","4","1","BK1168","Carmalt, C. J.; Cowley, A. H.; Decken, A.; Lawson, Y. G.; Norman, N. C.","Bis(diphenylphosphino)methane Disulfide","Acta Crystallographica Section C","1996","52","4","931","933","10.1107/S0108270195013230","","","0.71073","MoKα","","0.0643","0.046","","0.108","0.0927","","","","1.124","1.138","1.138","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004692","14.105","0.004","32.281","0.004","18.473","0.003","90","","107.38","0.01","90","","8027","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","μ-Oxo-bis[(5,10,15,20-tetraphenylporphyrinato)oxomolybdenum(V)]","","- C88.5 H60 Cl Mo2 N8 O4.5 -","- C88.5 H60 Cl Mo2 N8 O4.5 -","- C354 H240 Cl4 Mo8 N32 O18 -","4","1","BK1173","Cheng, B.; Scheidt, W. R.","μ-Oxo-bis[(5,10,15,20-tetraphenylporphyrinato)oxomolybdenum(V)]","Acta Crystallographica Section C","1996","52","4","832","835","10.1107/S0108270195014648","","","0.71073","MoKα","","0.0581","0.0466","","0.1684","0.1421","","","","1.093","1.097","1.097","","","","","has coordinates","202202","2020-10-21","18:00:00",""
"2004693","13.236","0.003","17.146","0.005","20.781","0.006","90","","103.04","0.02","90","","4595","2","296","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H45 N O6 P2 Re2 -","- C51 H45 N O8 P2 Re2 -","- C204 H180 N4 O32 P8 Re8 -","4","1","BK1177","Gibson, D. H.; Bardon, R. F.; Mehta, J. M.; Mashuta, M. S.; Richardson, J. F.","1-Carbonyl-2,2-<i>cis</i>-dicarbonyl-μ-formato-1<i>C</i>:2<i>O</i>,<i>O</i>'-1-nitrosyl-1-(η^5^-pentamethylcyclopentadienyl)-2,2-<i>trans</i>-bis(triphenylphosphine)dirhenium","Acta Crystallographica Section C","1996","52","4","852","854","10.1107/S010827019501376X","","","0.71073","MoKα","","","0.034","","","0.034","","","","","1.59","1.59","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004694","5.8867","0.0008","7.023","0.001","17.9952","0.0007","90","","92.473","0.008","90","","743.27","0.15","294.2","","294.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H9 N O3 -","- C7 H9 N O3 -","- C28 H36 N4 O12 -","4","1","BK1178","Tzou, J.-R.; Huang, A.; Fleming, F. F.; Norman, R. E.; Chang, S.-C.","1-Cyanomethyl-6,7,8-trioxabicyclo[3.2.1]octane","Acta Crystallographica Section C","1996","52","4","1012","1014","10.1107/S0108270195014004","","","0.7107","MoKα","","","0.037","","","0.0424","","","","","1.913","1.913","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004695","15.683","0.002","8.888","0.002","12.653","0.003","90","","90","","90","","1763.7","0.6","296","","296.2","","","","","","","","","6","P b c n","-P 2n 2ab","60","","Diaquabis(1-H-3-methyl-4-amine-5-thione-1,2,4-triazole)nickel(II) nitrate","","- C6 H16 N10 Ni O8 S2 -","- C6 H16 N10 Ni O8 S2 -","- C24 H64 N40 Ni4 O32 S8 -","4","0.5","BK1184","Sen, A. K.; Dubey, S. N.; Squattrito, P. J.","Diaquabis(4-amino-3-methyl-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione)nickel(II) Nitrate: a Sulfur‒Nitrogen Chelate","Acta Crystallographica Section C","1996","52","4","865","868","10.1107/S010827019501496X","","","0.7107","MoKα","","0.0673","0.035","","0.0355","0.033","","","","","2.166","2.166","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004696","5.564","0.002","5.327","0.002","34.038","0.002","90","","92.81","0.02","90","","1007.7","0.5","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","fluorene-1-carboxylic acid","","","- C14 H10 O2 -","- C14 H10 O2 -","- C56 H40 O8 -","4","1","BK1185","Blackburn, A. C.; Dobson, A. J.; Gerkin, R. E.","Fluorene-1-carboxylic Acid","Acta Crystallographica Section C","1996","52","4","907","910","10.1107/S0108270195014971","","","0.71073","MoKα","","","0.054","","","0.066","","","","","2.06","2.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004697","6.0904","0.0009","18.414","0.004","9.94","0.002","90","","96.999","0.012","90","","1106.5","0.4","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H8 Cl2 O4 Ru -","- C7 H8 Cl2 O4 Ru -","- C28 H32 Cl8 O16 Ru4 -","4","1","BK1187","Gray, G. M.; Duffey, C. H.","<i>fac</i>-Tricarbonyldichloro(tetrahydrofuran)ruthenium(II)","Acta Crystallographica Section C","1996","52","4","861","863","10.1107/S0108270195015174","","","0.71073","MoKα","","","0.039","","","0.048","","","","","1.022","1.022","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004698","13.084","0.003","6.527","0.001","15.397","0.003","90","","104.66","0.02","90","","1272.1","0.4","138","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H19 N O S -","- C14 H19 N O S -","- C56 H76 N4 O4 S4 -","4","1","BK1188","Hossain, M. B.; van der Helm, D.; Sangiah, S.; Berlin, K. D.","7-Benzyl-3-thia-7-azabicyclo[3.3.1]nonane 3-Oxide","Acta Crystallographica Section C","1996","52","4","995","998","10.1107/S0108270195015447","","","0.71073","MoKα","","","0.044","","","0.043","","","","","1.9","1.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004699","11.273","0.003","10.41","0.004","13.796","0.003","90","","100.35","0.02","90","","1592.6","0.8","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-amino-4-hydroxybenzenesulfonic acid hemihydrate","","- C6 H8 N O4.5 S -","- C6 H8 N O4.5 S -","- C48 H64 N8 O36 S8 -","8","2","BK1189","Gunderman, B. J.; Squattrito, P. J.","3-Amino-4-hydroxybenzenesulfonic Acid Hemihydrate","Acta Crystallographica Section C","1996","52","4","940","942","10.1107/S0108270195014466","","","0.7107","MoKα","","0.0563","0.038","","0.0413","0.04","","","","","2.65","2.65","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004700","3.888","0.003","9.984","0.004","27.537","0.008","90","","93.09","0.08","90","","1067.4","1","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(2-amino-5-bromobenzoyl)pyridine","","- C12 H9 Br N2 O -","- C12 H9 Br N2 O -","- C48 H36 Br4 N8 O4 -","4","1","BM1039","Cox, P. J.; Anisuzzaman, A. T. Md.; Pryce-Jones, R. H.; Shankland, N.; Skellern, G. G.","2-(2-Amino-5-bromobenzoyl)pyridine","Acta Crystallographica Section C","1996","52","4","929","931","10.1107/S0108270195014776","","","0.71069","MoKα","","0.0571","0.0427","","0.0915","0.0895","","","","1.01","1.166","1.166","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004701","10.995","0.002","14.837","0.003","10.316","0.002","102.63","0.02","96.95","0.02","83.16","0.02","1622.6","0.6","150","","150","","","","","","","","","5","P -1","-P 1","2","","diethylgallium diphenylphosphinate","","- C32 H40 Ga2 O4 P2 -","- C32 H40 Ga2 O4 P2 -","- C64 H80 Ga4 O8 P4 -","2","1","BM1040","Browning, D. J.; Corker, J. M.; Webster, M.","Diethylgallium Diphenylphosphinate","Acta Crystallographica Section C","1996","52","4","882","884","10.1107/S0108270195014508","","","0.71069","MoKα","","0.0459","0.0308","","0.0894","0.082","","","","1.02","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004702","12.552","0.003","19.18","0.003","9.997","0.002","90","","90","","90","","2406.8","0.8","293","","293","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","octacaesium decatungstosilicate nonahydrate","","- Cs8 H18 O43 Si W10 -","- Cs8 O45 Si W10 -","- Cs16 O90 Si2 W20 -","2","0.5","BR1104","Hartl, H.; Hubert, V.","Octacaesium Decatungstosilicate Nonahydrate","Acta Crystallographica Section C","1996","52","4","757","759","10.1107/S0108270195014284","","","0.7107","MoKα","","0.073","0.07","","0.07","0.07","","","","4.142","4.232","4.232","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004703","8.2508","0.0006","8.2508","0.0006","18.745","0.002","90","","90","","120","","1105.12","0.16","293","2","","","","","","","","","","7","P 63/m","-P 6c","","","","","- C6 H10 Bi La N6 O5 S6 -","- C6 H6 Bi La N6 O5 S6 -","- C12 H12 Bi2 La2 N12 O10 S12 -","2","0.166667","BR1118","Maniukiewicz, W.; Sieron, L.; Bukowska-Strzyzewska, M.; Turek, A.","Triaquahexathiocyanatobismuthlanthanum Dihydrate, [Bi(SCN)~6~La(H~2~O)~3~].2H~2~O, and Triaquahexathiocyanatobismuthneodymium Dihydrate, [Bi(SCN)~6~Nd(H~2~O)~3~].2H~2~O","Acta Crystallographica Section C","1996","52","4","753","757","10.1107/S0108270195013801","","","0.71073","MoKα","","0.0329","0.0277","","0.0593","0.0537","","","","1.162","1.172","1.172","","","","","has coordinates","208743","2020-10-21","18:00:00",""
"2004704","8.2","0.002","8.2","0.002","18.606","0.003","90","","90","","120","","1083.5","0.4","293","2","","","","","","","","","","7","P 63/m","-P 6c","","","","","- C6 H10 Bi N6 Nd O5 S6 -","- C6 H6 Bi N6 Nd O5 S6 -","- C12 H12 Bi2 N12 Nd2 O10 S12 -","2","0.166667","BR1118","Maniukiewicz, W.; Sieron, L.; Bukowska-Strzyzewska, M.; Turek, A.","Triaquahexathiocyanatobismuthlanthanum Dihydrate, [Bi(SCN)~6~La(H~2~O)~3~].2H~2~O, and Triaquahexathiocyanatobismuthneodymium Dihydrate, [Bi(SCN)~6~Nd(H~2~O)~3~].2H~2~O","Acta Crystallographica Section C","1996","52","4","753","757","10.1107/S0108270195013801","","","0.71073","MoKα","","0.0567","0.0464","","0.141","0.1199","","","","1.071","1.078","1.078","","","","","has coordinates","208743","2020-10-21","18:00:00",""
"2004705","10.622","0.003","5.459","0.002","13.708","0.004","90","","104.4","0.02","90","","769.9","0.4","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H5 N3 O2 S -","- C7 H5 N3 O2 S -","- C28 H20 N12 O8 S4 -","4","1","CF1034","Lokaj, J.; Vrábel, V.; Ilavský, D.; Bartovič, A.","2-Amino-4-nitrobenzothiazole","Acta Crystallographica Section C","1996","52","4","1040","1042","10.1107/S0108270195012728","","","0.71073","MoKα","","","0.037","","","0.042","","","","","1.34","1.34","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004706","8.006","0.001","12.097","0.002","8.794","0.001","90","","101.12","0.01","90","","835.7","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-1-acetoxymethyl-2-acetyl-1-methyl- 1,2,3,4-tetrahydro-6,7-dimethoxyisoquinoline","","- C17 H23 N O5 -","- C17 H23 N O5 -","- C34 H46 N2 O10 -","2","1","CF1035","Maurin, J. K.; Czarnocki, Z.; Paluchowska, B.","(<i>S</i>)-1-Acetoxymethyl-2-acetyl-1,2,3,4-tetrahydro-6,7-dimethoxy-1-methylisoquinoline","Acta Crystallographica Section C","1996","52","4","953","955","10.1107/S0108270195014491","","","1.54178","CuKα","","0.0446","0.0355","","0.1024","0.0967","","","","1.033","1.079","1.079","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004707","8.104","0.001","9.975","0.001","9.986","0.002","90","","90","","90","","807.2","0.2","195","3","195","3","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,4-Dibromo-1,4-disilabutane","","- C2 H8 Br2 Si2 -","- C2 H8 Br2 Si2 -","- C8 H32 Br8 Si8 -","4","0.5","CF1041","Mitzel, N. W.; Riede, J.; Schmidbaur, H.","1,4-Dibromo-1,4-disilabutane","Acta Crystallographica Section C","1996","52","4","980","982","10.1107/S010827019501451X","","","0.71069","MoKα","","0.0485","0.0315","","0.0779","0.0676","","","","1.168","1.243","1.243","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004708","20.455","0.002","8.528","0.0008","20.338","0.002","90","","92.237","0.007","90","","3545.1","0.6","294","1","294","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Ferrocenyl-3-phenylquinoxaline","","- C24 H18 Fe N2 -","- C24 H18 Fe N2 -","- C192 H144 Fe8 N16 -","8","1","CF1042","Glidewell, C.; Scott, J. P.; Ferguson, G.","2-Ferrocenyl-3-phenylquinoxaline","Acta Crystallographica Section C","1996","52","4","770","773","10.1107/S0108270195015022","","","0.7107","MolybdenumKα","","0.0594","0.034","","0.0883","0.0823","","","","1.012","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004709","7.643","0.001","9.8349","0.0012","18.629","0.002","90","","90","","90","","1400.3","0.3","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-Ferrocenyl-2-phenylethanedione","","- C18 H14 Fe O2 -","- C18 H14 Fe O2 -","- C72 H56 Fe4 O8 -","4","1","CF1043","Glidewell, C.; Gottfried, M. J.; Trotter, J.; Ferguson, G.","1-Ferrocenyl-2-phenylethanedione","Acta Crystallographica Section C","1996","52","4","773","775","10.1107/S0108270195015034","","","0.7107","MolybdenumKα","","0.0561","0.0319","","0.0712","0.0658","","","","0.977","1.071","1.071","","","","","has coordinates","192282","2020-10-21","18:00:00",""
"2004710","9.509","0.002","10.312","0.002","11.541","0.002","99.51","0.02","90.59","0.02","100.24","0.02","1097.4","0.4","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","Bis(1-ferrocenylpropyl) ether","","- C26 H30 Fe2 O -","- C26 H30 Fe2 O -","- C52 H60 Fe4 O2 -","2","1","CF1047","Ferguson, G.; Trotter, J.; Glidewell, C.; Zakaria, C. M.","Racemic Bis(1-ferrocenylpropyl) Ether","Acta Crystallographica Section C","1996","52","4","775","777","10.1107/S0108270195015046","","","0.7107","MolybdenumKα","","0.0528","0.0336","","0.0869","0.0816","","","","1.019","1.122","1.122","","","","","has coordinates","192283","2020-10-21","18:00:00",""
"2004711","11.222","0.005","10.725","0.008","12.002","0.008","90","","98.03","0.05","90","","1430.3","1.6","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H9 I3 N2 -","- C10 H9 I3 N2 -","- C40 H36 I12 N8 -","4","1","CF1051","Fialho De Assis, E.; Howie, R. A.; Wardell, J. L.","2-(2-Pyridyl)pyridinium Triiodide","Acta Crystallographica Section C","1996","52","4","955","957","10.1107/S0108270195014533","","","0.71073","MoKα","","","0.057","","","0.067","","","","","0.61","0.61","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004712","7.7051","0.0009","8.061","0.0008","20.419","0.002","90","","93.338","0.009","90","","1266.1","0.2","296","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H11 I O3 -","- C13 H11 I O3 -","- C52 H44 I4 O12 -","4","2","CR1135","Prince, P.; Fronczek, F. R.; Gandour, R. D.","1-Iodo-2-methoxy-7-naphthyl Acetate","Acta Crystallographica Section C","1996","52","4","944","947","10.1107/S0108270195010432","","","0.71073","MoKα","","","0.0417","","","0.0485","","","","","2.493","2.493","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004713","7.156","0.001","8.599","0.004","11.06","0.004","100.02","0.03","104.81","0.02","96.2","0.03","639.6","0.4","288","2","288","2","","","","","","","","5","P -1","-P 1","2","2-Aminoperimidine hydrobromide dihydrate","","","- C11 H14 Br N3 O2 -","- C11 H13 Br N3 O2 -","- C22 H26 Br2 N6 O4 -","2","1","CR1182","Baker, S. M.; Baughman, R. G.; Meloan, C. E.; Mumba, P.","2-Aminoperimidinium Bromide Dihydrate","Acta Crystallographica Section C","1996","52","4","998","1000","10.1107/S010827019501208X","","","0.71073","MoKα","","0.0596","0.0364","","0.0898","0.0777","","","","1.007","1.036","1.036","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004714","11.873","0.002","14.322","0.004","17.541","0.006","90","","90","","90","","2982.8","1.4","295","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C18 H22 O2 -","- C18 H22 O2 -","- C144 H176 O16 -","8","1","DE1005","Ghosh, K.; Pramanik, A.","(1<i>RS</i>,4a<i>SR</i>,12a<i>SR</i>)-1-Methyl-1,2,3,4,4a,5,6,7,12,12a-decahydrodibenzo[<i>a</i>,<i>d</i>]cyclooctene-1,4a-carbolactone","Acta Crystallographica Section C","1996","52","4","1029","1030","10.1107/S0108270195013199","","","0.71073","MoKα","","","0.0708","","","0.0705","","","","","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004715","14.8793","0.0007","8.9205","0.0006","7.2837","0.0004","90","","90","","90","","966.77","0.1","294","","","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C6 H11 Cl N2 O S -","- C6 H11 Cl N2 O S -","- C24 H44 Cl4 N8 O4 S4 -","4","1","DE1010","Seth, S.; Das, A. K.; Mak, T. C. W.","An Unusual C(<i>sp</i>^2^)—H···Cl Interaction in the Solid State: Reinvestigation of 4,6-Dimethylpyrimidine-2-thione Hydrochloride Monohydrate","Acta Crystallographica Section C","1996","52","4","910","913","10.1107/S0108270195012388","","","0.71073","MoKα","","","0.034","","","0.037","","","","","1.116","1.116","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004716","12.462","0.002","7.722","0.002","15.453","0.003","90","","110.16","0.03","90","","1396","0.6","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaqua-[2-ethylphenylamino-N,N-diacetato-N,O,O']zinc(II)","","- C12 H17 N O6 Zn -","- C12 H17 N O6 Zn -","- C48 H68 N4 O24 Zn4 -","4","1","DE1012","Hidalgo, M. A.; Suárez-Varela, J.; Avila-Rosón, J. C.; Martín-Ramos, J. D.; Romerosa, A.","Diaqua(2-ethylphenyliminodiacetato-<i>N</i>,<i>O</i>,<i>O</i>')zinc(II)","Acta Crystallographica Section C","1996","52","4","810","812","10.1107/S0108270195014132","","","0.71069","MoKα","","0.1939","0.0387","","0.1819","0.042","","","","","1.62","1.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004717","13.939","0.007","12.21","0.008","9.298","0.003","106.62","0.03","88.96","0.02","114.32","0.05","1372.8","1.4","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H24 Ca N4 O18 -","- C20 H22 Ca N4 O18 -","- C40 H44 Ca2 N8 O36 -","2","1","DE1013","","Dimeric Aqua(3,5-dinitrobenzoato)(triethylene glycol)calcium(II) 3,5-Dinitrobenzoate Hydrate","Acta Crystallographica C","1996","52","","786","789","10.1107/S0108270195013187","","","0.71073","MoKα","","","0.065","","","0.058","","","","","1.174","1.174","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004718","5.964","0.003","27.04","0.02","11.376","0.006","90","","94.42","0.05","90","","1829.1","1.9","293","","","","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C9 H23 Ag N2 O S4 W -","- C9 H23 Ag N2 O S4 W -","- C36 H92 Ag4 N8 O4 S16 W4 -","4","1","DE1020","Huang, Q.; Wu, X.; Wang, Q.; Sheng, T.","The Polymeric Cluster Complex {[(CH~3~CH~2~)~3~NH][WAgS~4~].(DMF)}~<i>n~</i>","Acta Crystallographica Section C","1996","52","4","795","797","10.1107/S0108270195013758","","","0.71069","MoKα","","","0.0448","","","0.0498","","","","","1.11","1.11","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004719","14.692","0.002","13.88","0.001","9.759","0.001","90","","90","","90","","1990.1","0.4","293","2","293","","","","","","","","","5","P m n 21","P 2ac -2","31","2:1 complex (N-cyclopentyl-4-phenylpyridinium bromide : 4-phenylpyridine)","","","- C43 H48 Br3 N3 O -","- C43 H47 Br3 N3 O -","- C86 H94 Br6 N6 O2 -","2","0.5","DU1122","Wouters, J.; Evrard, G.; Durant, F.; Kalgutkar, A.; Castagnoli, Jnr, N.","An MPP^+^ Analog: the 2:1 <i>N</i>-Cyclopentyl-4-phenylpyridinium Bromide‒4-Phenylpyridine Complex","Acta Crystallographica Section C","1996","52","4","1033","1036","10.1107/S010827019501362X","","","1.54178","CuKα","","0.0562","0.0447","","0.1119","0.0997","","","","1.085","1.104","1.104","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004720","9.199","0.001","5.731","0.003","28.812","0.006","90","","95.08","0.01","90","","1513","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Cyclohexylamino-2-phenyl-4-thiazolecarbonitrile","","- C16 H17 N3 S -","- C16 H17 N3 S -","- C64 H68 N12 S4 -","4","1","DU1133","Kammoun, M.; Hajjem, B.; Jouini, T.; Baccar, B.","5-Cyclohexylamino-2-phenyl-4-thiazolecarbonitrile","Acta Crystallographica Section C","1996","52","4","1006","1007","10.1107/S0108270195013709","","","0.71069","MoKα","","0.0551","0.0401","","0.0955","0.0897","","","","1.179","1.254","1.254","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004721","8.411","0.002","14.454","0.003","15.8","0.003","90","","91.32","0.03","90","","1920.3","0.7","119","","","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C20 H37 Cl5 Fe3 O8 P4 Si2 -","- C20 H37 Cl5 Fe3 O8 P4 Si2 -","- C40 H74 Cl10 Fe6 O16 P8 Si4 -","2","1","FG1051","Simons, R. S.; Tessier, C. A.","[Fe~2~(CO)~4~(PMe~3~)~4~(μ-H)(μ-SiCl~2~)][Fe(CO)~4~(SiCl~3~)]","Acta Crystallographica Section C","1996","52","4","840","842","10.1107/S0108270195013825","","","0.71073","MoKα","","","0.0398","","","0.0432","","","","","1.03","1.03","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004722","25.497","0.002","9.208","0.002","18.012","0.002","90","","129.78","0.02","90","","3249.9","1.3","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H17 O2 Sb -","- C18 H17 O2 Sb -","- C144 H136 O16 Sb8 -","8","1","FG1062","Pankaj, S.; Rosas, N.; Espinosa-Pérez, G.; Cabrera, A.","Triphenylstibine Dihydroxide","Acta Crystallographica Section C","1996","52","4","889","891","10.1107/S0108270195013898","","","0.71073","MoKα","","","0.0591","","","0.0673","","","","","1.24","1.24","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2004723","7.365","0.002","9.102","0.003","11.165","0.003","77.52","0.03","73.47","0.02","71.27","0.03","673.1","0.4","293","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H32 Mn N2 O10 -","- C24 H32 Mn N2 O10 -","- C24 H32 Mn N2 O10 -","1","0.5","FG1078","Haendler, H. M.","A Manganese Quinaldinate Complex: <i>trans</i>-[Diaquabis(2-quinolinecarboxylato)manganese(II)]‒Water‒Ethanol (1/2/2)","Acta Crystallographica Section C","1996","52","4","801","803","10.1107/S0108270195013904","","","0.71073","MoKα","","","0.045","","","0.065","","","","","1.54","1.54","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004724","25.109","0.002","18.557","0.004","18.436","0.007","90","","134.85","0.02","90","","6090","3","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-triaquocalcium-1,4,7,10-tetraazacyclododecane- N,N',N"",N'''-tetraaceto calcium hydrate","","- C16 H45.4 Ca2 N4 O18.7 -","- C16 H42.3 Ca2 N4 O18.65 -","- C128 H338.4 Ca16 N32 O149.2 -","8","1","FG1080","Anderson, O. P.; Reibenspies, J. H.","{Ca(OH~2~)~3~[Ca(DOTA)].7.7H~2~O}~<i>n~</i>","Acta Crystallographica Section C","1996","52","4","792","795","10.1107/S0108270195013916","","","0.71073","MoKα","","0.0976","0.0681","","0.2066","0.1999","","","","1.317","1.483","1.483","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004725","19.403","0.005","6.555","0.001","19.512","0.006","90","","97.38","0.02","90","","2461.1","1.1","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","triaquabis(O,O'-hydrogenoxalate) (O,O'-oxalate)(μ^3^-sulfide)tris(μ^2^-sulfide)trimolybdenum(IV)","","- C10 H20 Mo3 O17 S4 -","- C10 H4 Mo3 O17 S4 -","- C40 H16 Mo12 O68 S16 -","4","1","FG1088","Cotton, F. A.; Daniels, L. M.; Shang, M.; Llusar, R.; Schwotzer, W.","A Trinuclear Cluster of Molybdenum(IV), Mo~3~(μ~3~-S)(μ~2~-S)~3~(HC~2~O~4~)~2~(C~2~O~4~)(H~2~O)~3~","Acta Crystallographica Section C","1996","52","4","835","838","10.1107/S0108270195013928","","","0.71073","MoKα","","0.1637","0.0514","","0.1027","0.0931","","","","0.825","1.096","1.096","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004726","5.934","0.002","9.237","0.002","17.512","0.005","90","","90","","90","","959.9","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","JLG-244","2,4-dinitro-cis-1,5-dimethyl-2,4-diazabicyclo[3,2.0]heptan-3-one","","- C7 H10 N4 O5 -","- C7 H10 N4 O5 -","- C28 H40 N16 O20 -","4","1","FG1098","Deschamps, J. R.; George, C.; Gilardi, R. D.; Gagnon, J. L.; Zajac, Jnr, W. W.","<i>cis</i>-1,5-Dimethyl-2,4-dinitro-2,4-diazabicyclo[3.2.0]heptan-3-one and <i>cis</i>-1,5-Dimethyl-2,4-dinitro-2,4-diazabicyclo[3.1.0]hexan-3-one","Acta Crystallographica Section C","1996","52","4","993","995","10.1107/S010827019501393X","","","0.71073","MoKα","","0.0429","0.0333","","0.0904","0.0831","","","","1.071","1.079","1.079","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004727","7.306","0.001","10.83","0.002","11.525","0.002","90","","91.3","0.02","90","","911.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4-dinitro-cis-1,5-dimethyl-2,4-diazabicyclo[3,1.0]hexan-3-one","","- C6 H8 N4 O5 -","- C6 H8 N4 O5 -","- C24 H32 N16 O20 -","4","1","FG1098","Deschamps, J. R.; George, C.; Gilardi, R. D.; Gagnon, J. L.; Zajac, Jnr, W. W.","<i>cis</i>-1,5-Dimethyl-2,4-dinitro-2,4-diazabicyclo[3.2.0]heptan-3-one and <i>cis</i>-1,5-Dimethyl-2,4-dinitro-2,4-diazabicyclo[3.1.0]hexan-3-one","Acta Crystallographica Section C","1996","52","4","993","995","10.1107/S010827019501393X","","","0.71073","MoKα","","0.1062","0.0547","","0.1526","0.1233","","","","1.032","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004728","13.746","0.001","14.137","0.002","19.039","0.003","90","","94.1","0.01","90","","3690.3","0.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H40 Cd Cl N2 P S4 -","- C34 H40 Cd Cl N2 P S4 -","- C136 H160 Cd4 Cl4 N8 P4 S16 -","4","1","FG1103","Baggio, R.; Garland, M. T.; Perec, M.","The Five-Coordinate Cadmium Halide Bis(diethyldithiocarbamate) Complexes [PPh~4~][Cd(S~2~CNEt~2~)~2~Cl] and [PPh~4~][Cd(S~2~CNEt~2~)~2~Br]","Acta Crystallographica Section C","1996","52","4","823","826","10.1107/S0108270195013941","","","0.71073","MoKα","","0.0631","0.0358","","0.0804","0.0692","","","","1.036","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004729","13.858","0.002","14.159","0.003","19.25","0.003","90","","93.87","","90","","3768.5","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H40 Br Cd N2 P S4 -","- C34 H40 Br Cd N2 P S4 -","- C136 H160 Br4 Cd4 N8 P4 S16 -","4","1","FG1103","Baggio, R.; Garland, M. T.; Perec, M.","The Five-Coordinate Cadmium Halide Bis(diethyldithiocarbamate) Complexes [PPh~4~][Cd(S~2~CNEt~2~)~2~Cl] and [PPh~4~][Cd(S~2~CNEt~2~)~2~Br]","Acta Crystallographica Section C","1996","52","4","823","826","10.1107/S0108270195013941","","","0.71073","MoKα","","0.0963","0.0567","","0.1508","0.1282","","","","1.072","1.129","1.129","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004730","15.442","0.003","14.865","0.004","30.383","0.007","90","","90","","90","","6974","3","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C32 H32 Cu2 I2 N6 O2 -","- C32 H32 Cu2 I2 N6 O2 -","- C256 H256 Cu16 I16 N48 O16 -","8","1","FG1121","Bhaduri, S.; Rugmini, V.; Sapre, N. Y.; Jones, P. G.","Dimeric Iodo[1,1-di(2-pyridyl)-3-butenolato]copper(II) Bis(acetonitrile) Solvate, [Cu~2~(C~14~H~13~N~2~O)~2~I~2~].2CH~3~CN","Acta Crystallographica Section C","1996","52","4","804","806","10.1107/S0108270195013953","","","0.71073","MoKα","","0.0639","0.0344","","0.0973","0.0766","","","","1.072","1.016","1.016","","","","","has coordinates","194481","2020-10-21","18:00:00",""
"2004731","9.796","0.004","17.725","0.007","6.042","0.001","97.22","0.02","95.7","0.02","104.65","0.03","997.5","0.6","200","","200","","","","","","","","","5","P 1","P 1","1","","","","- C20 H23 Br N2 O4 -","- C20 H23 Br N2 O4 -","- C40 H46 Br2 N4 O8 -","2","2","FG1126","Parvez, M.; Rusiewicz, M.","Absolute Configuration of <small>D</small>-Brompheniramine Maleate","Acta Crystallographica Section C","1996","52","4","901","904","10.1107/S0108270195015125","","","0.71069","MoKα","","","0.035","","","0.039","","","","","1.262","1.262","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004732","25.016","0.006","5.881","0.008","11.299","0.008","90","","98.17","0.03","90","","1645","3","296","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,1'-bis(2-sulfonatoethyl)-4,4'-bipyridinium monohydrate","","- C14 H18 N2 O7 S2 -","- C14 H18 N2 O7 S2 -","- C56 H72 N8 O28 S8 -","4","0.5","FG1127","Vermeulen, L. A.; Robinson, P. D.","A Photochromic Zwitterionic Viologen: 4,4'-Bipyridinium-1,1'-bis(2-ethylsulfonate) Monohydrate","Acta Crystallographica Section C","1996","52","4","984","986","10.1107/S0108270195013989","","","0.71069","MoKα","","","0.044","","","0.052","","","","","1.48","1.48","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004733","5.525","0.002","10.968","0.003","30.003","0.005","90","","91.01","0.03","90","","1817.8","0.9","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H21 Cl2 N3 -","- C19 H21 Cl2 N3 -","- C76 H84 Cl8 N12 -","4","1","FG1128","Parvez, M.","Clemizole Hydrochloride","Acta Crystallographica Section C","1996","52","4","904","905","10.1107/S0108270195015113","","","0.71069","MoKα","","","0.0663","","","0.0647","","","","","2.967","2.967","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004734","11.721","0.001","13.156","0.001","14.278","0.001","90","","95.1","0.01","90","","2193","0.3","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H21 O4 P -","- C28 H21 O4 P -","- C112 H84 O16 P4 -","4","1","HA1100","Mani Naidu, S.; Krishnaiah, M.; Sivakumar, K.; Manohar, H.","8-(3-Methylphenoxy)-16<i>H</i>-dinaphtho[2,1-<i>d</i>;1',2'-<i>g</i>][1,3,2]dioxaphosphocine 8-oxide","Acta Crystallographica Section C","1996","52","4","1052","1054","10.1107/S0108270195013886","","","0.71069","MoKα","","","0.04","","","0.048","","","","","1.23","1.23","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004735","4.987","0.005","9.998","0.003","20.567","0.001","101.81","0.02","94.21","0.02","94.95","0.02","995.6","1","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H16 N8 O8 -","- C17 H16 N8 O8 -","- C34 H32 N16 O16 -","2","1","HA1101","Mani Naidu, S.; Krishnaiah, M.; Sivakumar, K.; Sharma, R. P.","2,4-Pentanedione Bis(2,4-dinitrophenylhydrazone)","Acta Crystallographica Section C","1996","52","4","1054","1056","10.1107/S0108270195013874","","","0.71069","MoKα","","","0.06","","","0.066","","","","","1.36","1.36","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004736","20.417","0.004","7.711","0.002","16.719","0.003","90","","113.71","0.02","90","","2410","1","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 N4 O4 -","- C11 H10 N4 O4 -","- C88 H80 N32 O32 -","8","2","HA1102","Mani Naidu, S.; Krishnaiah, M.; Sivakumar, K.; Sharma, R. P.","1-(2,4-Dinitrophenyl)-3,5-dimethylpyrazole","Acta Crystallographica Section C","1996","52","4","1056","1058","10.1107/S0108270195013862","","","0.71069","MoKα","","","0.055","","","0.061","","","","","1.9","1.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004737","22.516","0.005","6.937","0.001","17.469","0.004","90","","101.51","0.02","90","","2673.7","1","298","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H19 N O5.5 P -","- C10 H19 N O5.5 P -","- C80 H152 N8 O44 P8 -","8","1","HA1103","Mani Naidu, S.; Krishnaiah, M.; Sivakumar, K.","3-Hydroxy-6-methyl-2-pyridylmethyl Isopropylphosphonate Sesquihydrate","Acta Crystallographica Section C","1996","52","4","1058","1060","10.1107/S0108270195013850","","","1.5418","CuKα","","","0.056","","","0.068","","","","","1.87","1.87","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004738","4.863","0.002","10.804","0.001","20.139","0.005","90","","96.19","0.03","90","","1051.9","0.5","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(4-nitrophenyl)-4-piperidinol","","- C11 H14 N2 O3 -","- C11 H14 N2 O3 -","- C44 H56 N8 O12 -","4","1","HA1146","Tomlin, D. W.; Bunning, T. J.; Price, G. E.; Fratini, A. V.; Adams, W. W.","1-(4-Nitrophenyl)-4-piperidinol","Acta Crystallographica Section C","1996","52","4","1000","1002","10.1107/S0108270195014545","","","0.71073","MoKα","","","0.064","","","0.041","","","","","1.376","1.376","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004739","7.565","0.001","12.046","0.001","13.701","0.001","90","","90","","90","","1248.5","0.2","298","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C7 H14 Cl2 Pd S3 -","- C7 H14 Cl2 Pd S3 -","- C28 H56 Cl8 Pd4 S12 -","4","1","HL1041","Lee, G.-H.; Tzeng, B.-C.","Palladium Complexes of 1,4,7-Trithiacyclodecane","Acta Crystallographica Section C","1996","52","4","879","882","10.1107/S0108270193013769","","","0.71069","MoKα","","","0.026","","","0.026","","","","","1.16","1.16","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004740","18.117","0.001","11.608","0.001","13.611","0.001","90","","96.4","0.01","90","","2844.6","0.4","298","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H42 Cl2 O7 Pd S6 -","- C14 H44 Cl O6 Oc2 Pd S6 -","- C56 H176 Cl4 O24 Oc8 Pd4 S24 -","4","0.5","HL1041","Lee, G.-H.; Tzeng, B.-C.","Palladium Complexes of 1,4,7-Trithiacyclodecane","Acta Crystallographica Section C","1996","52","4","879","882","10.1107/S0108270193013769","","","0.71069","MoKα","","","0.035","","","0.042","","","","","2.66","2.66","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004741","9.395","0.007","14.373","0.008","14.53","0.005","89.11","0.04","88.27","0.04","86.79","0.04","1957.9","1.9","293","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H18 N4 S Se2 -","- C19 H18 N4 S Se2 -","- C76 H72 N16 S4 Se8 -","4","2","HR1038","Billing, D. G.; Boeyens, J. C. A.; Cook, L. M.; Lai, L.-L.; Reid, D. H.","5,6,7,8-Tetrahydro-2,3-diphenyl-2aλ^4^-thia-2,3,4a,8a-tetraazacyclopent[<i>cd</i>]azulene-1[2<i>H</i>],4[3<i>H</i>]-diselone","Acta Crystallographica Section C","1996","52","4","970","973","10.1107/S0108270195012637","","","0.71073","MoKα","","","0.0791","","","0.1052","","","","","1.07","1.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004742","7.573","0.002","21.152","0.005","11.756","0.002","90","","90","","90","","1883.1","0.7","295","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C10 H7 N O4 -","- C10 H7 N O4 -","- C80 H56 N8 O32 -","8","1","HU1020","Feeder, N.; Jones, W.","Structures of Five ω-Phthalimidoaliphatic Carboxylic Acids","Acta Crystallographica Section C","1996","52","4","913","919","10.1107/S010827019501626X","","","0.71069","Mo","","","0.066","","","0.066","","","","","1.949","1.949","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004743","7.079","0.004","8.949","0.005","15.893","0.007","90","","98.84","0.04","90","","994.9","0.9","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C11 H9 N O4 -","- C11 H9 N O4 -","- C44 H36 N4 O16 -","4","1","HU1020","Feeder, N.; Jones, W.","Structures of Five ω-Phthalimidoaliphatic Carboxylic Acids","Acta Crystallographica Section C","1996","52","4","913","919","10.1107/S010827019501626X","","","0.71069","Mo","","","0.046","","","0.046","","","","","0.756","0.756","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004744","7.336","0.006","10.95","0.003","14.693","0.005","100.79","0.03","104.5","0.05","83.53","0.06","1119.8","1.1","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H11 N O4 -","- C12 H10 N O4 -","- C48 H40 N4 O16 -","4","2","HU1020","Feeder, N.; Jones, W.","Structures of Five ω-Phthalimidoaliphatic Carboxylic Acids","Acta Crystallographica Section C","1996","52","4","913","919","10.1107/S010827019501626X","","","0.71069","Mo","","","0.064","","","0.064","","","","","1.115","1.115","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2004745","6.574","0.004","4.899","0.002","37.413","0.013","90","","95.18","0.03","90","","1200","1","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 N O4 -","- C13 H12 N O4 -","- C52 H48 N4 O16 -","4","1","HU1020","Feeder, N.; Jones, W.","Structures of Five ω-Phthalimidoaliphatic Carboxylic Acids","Acta Crystallographica Section C","1996","52","4","913","919","10.1107/S010827019501626X","","","0.71069","Mo","","","0.072","","","0.072","","","","","1.595","1.595","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2004746","21.055","0.008","4.662","0.001","28.067","0.009","90","","105.22","0.03","90","","2658.4","1.5","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C14 H15 N O4 -","- C14 H14 N O4 -","- C112 H112 N8 O32 -","8","2","HU1020","Feeder, N.; Jones, W.","Structures of Five ω-Phthalimidoaliphatic Carboxylic Acids","Acta Crystallographica Section C","1996","52","4","913","919","10.1107/S010827019501626X","","","0.71073","Mo","","","0.08","","","0.08","","","","","1.835","1.835","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004747","5.054","0.001","14.747","0.005","12.568","0.003","90","","92.88","0.02","90","","935.5","0.4","295","","","","","","","","","","","4","C 1 c 1","C -2yc","","","","","- C9 H9 N O4 -","- C9 H9 N O4 -","- C36 H36 N4 O16 -","4","1","HU1075","Feeder, N.; Jones, W.","Structures of Four <i>p</i>-Amidoperbenzoic Acids","Acta Crystallographica Section C","1996","52","4","919","923","10.1107/S0108270195016271","","","0.71069","MoKα","","","0.056","","","0.056","","","","","1.184","1.184","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004748","4.8853","0.001","15.68","0.004","12.793","0.003","90","","92.21","0.02","90","","979.2","0.4","296","2","296","2","","","","","","","","4","C 1 c 1","C -2yc","9","p-propanamidoperbenzoic","p-propanamidoperbenzoic acid","","- C10 H11 N O4 -","- C10 H11 N O4 -","- C40 H44 N4 O16 -","4","1","HU1075","Feeder, N.; Jones, W.","Structures of Four <i>p</i>-Amidoperbenzoic Acids","Acta Crystallographica Section C","1996","52","4","919","923","10.1107/S0108270195016271","","","0.71069","MoKα","","0.0855","0.0412","","0.1339","0.118","","","","0.827","0.977","0.977","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004749","10.75","0.003","14.477","0.006","6.875","0.003","90","","90","","90","","1069.9","0.7","295","","","","","","","","","","","4","P b c m","-P 2c 2b","","","","","- C11 H13 N O4 -","- C11 H13 N O4 -","- C44 H52 N4 O16 -","4","0.5","HU1075","Feeder, N.; Jones, W.","Structures of Four <i>p</i>-Amidoperbenzoic Acids","Acta Crystallographica Section C","1996","52","4","919","923","10.1107/S0108270195016271","","","0.71069","MoKα","","","0.054","","","0.054","","","","","0.88","0.88","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004750","10.729","0.005","14.026","0.007","8.654","0.003","90","","111.59","0.03","90","","1210.9","1","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C12 H15 N O4 -","- C12 H15 N O4 -","- C48 H60 N4 O16 -","4","1","HU1075","Feeder, N.; Jones, W.","Structures of Four <i>p</i>-Amidoperbenzoic Acids","Acta Crystallographica Section C","1996","52","4","919","923","10.1107/S0108270195016271","","","0.71069","MoKα","","","0.068","","","0.068","","","","","1.286","1.286","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004751","9.558","0.002","20.676","0.004","9.591","0.002","90","","90","","90","","1895.4","0.7","130","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Bis(tert-butyl acetoacetato)aquocopper(II)","","- C16 H28 Cu O7 -","- C16 H28 Cu O7 -","- C64 H112 Cu4 O28 -","4","0.5","HU1134","Patnaik, S.; Guru Row, T. N.; Raghunathan, L.; Devi, A.; Goswami, J.; Shivashankar, S. A.; Chandrasekaran, S.; Robinson, W. T.","Low-Temperature Structure of Two Copper-Based Precursors for MOCVD: Aquabis(<i>tert</i>-butyl acetoacetato)copper(II) and Bis(dipivaloylmethanido)copper(II)","Acta Crystallographica Section C","1996","52","4","891","894","10.1107/S0108270195012157","","","0.71073","MoKα","","0.0616","0.0386","","0.1086","0.0924","","","","1.015","0.985","0.985","","","","","has coordinates","191094","2020-10-21","18:00:00",""
"2004752","10.175","0.002","10.939","0.002","11.469","0.002","90","","112.06","0.03","90","","1183.1","0.5","130","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","bis(dipivaloylmethanido)copper(II) ?","","- C22 H38 Cu O4 -","- C22 H38 Cu O4 -","- C44 H76 Cu2 O8 -","2","0.5","HU1134","Patnaik, S.; Guru Row, T. N.; Raghunathan, L.; Devi, A.; Goswami, J.; Shivashankar, S. A.; Chandrasekaran, S.; Robinson, W. T.","Low-Temperature Structure of Two Copper-Based Precursors for MOCVD: Aquabis(<i>tert</i>-butyl acetoacetato)copper(II) and Bis(dipivaloylmethanido)copper(II)","Acta Crystallographica Section C","1996","52","4","891","894","10.1107/S0108270195012157","","","0.71073","MoKα","","0.0778","0.0462","","0.1455","0.1182","","","","0.811","0.787","0.787","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004753","7.502","0.005","8.32","0.006","11.809","0.006","87","0.05","89.76","0.05","69.65","0.06","690","0.8","80","2","80","2","","","","","","","","5","P -1","-P 1","2","","fac-trichloro(tetrahydrofuran)(d,l-tetrahydrofurfuranol)titanium(III)","","- C9 H18 Cl3 O3 Ti -","- C9 H18 Cl3 O3 Ti -","- C18 H36 Cl6 O6 Ti2 -","2","1","JZ1073","Olejnik, Z.; Lis, T.; Utko, J.; Sobota, P.","Low-Temperature Structures of <i>fac</i>-Trichloro(tetrahydrofuran)(<small>D</small>, <small>L</small>-tetrahydrofurfuranol)titanium(III) and <i>fac</i>-Trichloro(tetrahydrofuran)(<small>D</small>, <small>L</small>-tetrahydrofurfuroxide)titanium(IV)","Acta Crystallographica Section C","1996","52","4","847","850","10.1107/S0108270195013485","","","0.71069","MoKα","","","0.0267","","","0.0689","","","","","1.091","1.091","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004754","9.074","0.008","12.553","0.009","15.65","0.02","90","","131.06","0.12","90","","1344","3","80","2","80","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","fac-trichloro(tetrahydrofuran)(d,l-tetrahydrofurfuroxide)titanium(IV)","","- C9 H17 Cl3 O3 Ti -","- C9 H17 Cl3 O3 Ti -","- C36 H68 Cl12 O12 Ti4 -","4","1","JZ1073","Olejnik, Z.; Lis, T.; Utko, J.; Sobota, P.","Low-Temperature Structures of <i>fac</i>-Trichloro(tetrahydrofuran)(<small>D</small>, <small>L</small>-tetrahydrofurfuranol)titanium(III) and <i>fac</i>-Trichloro(tetrahydrofuran)(<small>D</small>, <small>L</small>-tetrahydrofurfuroxide)titanium(IV)","Acta Crystallographica Section C","1996","52","4","847","850","10.1107/S0108270195013485","","","0.71069","MoKα","","","0.0233","","","0.0629","","","","","1.107","1.107","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004755","7.89","0.001","11.752","0.001","17.028","0.001","90","","90","","90","","1578.9","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-tert-Butyloxycarbonyl-6(S)-hydroxymethyl-3(S)-methylethyl- piperazin-2-one","","- C13 H24 N2 O4 -","- C13 H24 N2 O4 -","- C52 H96 N8 O16 -","4","1","JZ1074","Kolter, T.; Rübsam, F.; Giannis, A.; Nieger, M.","4-<i>tert</i>-Butyloxycarbonyl-6(<i>S</i>)-(hydroxymethyl)-3(<i>S</i>)-(1-methylethyl)piperazin-2-one","Acta Crystallographica Section C","1996","52","4","978","980","10.1107/S0108270195013278","","","1.54178","CuKα","","0.0921","0.0674","","0.2097","0.1845","","","","1.042","1.061","1.061","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004756","10.545","0.002","12.924","0.002","14.856","0.002","90.6","0.01","100.06","0.01","99.47","0.01","1964.7","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Cis-Diaquabis(1,10-phenanthroline-N,N')Zinc(II) Di(thiosulfate-S-)(1,10-phenanthroline-N,N'-)Zincate(II) Hydrate","","- C36 H30 N6 O9 S4 Zn2 -","- C36 H30 N6 O8.997 S3.998 Zn2 -","- C72 H60 N12 O17.994 S7.996 Zn4 -","2","1","JZ1082","Baggio, R.; Baggio, S.; Pardo, M. I.; Garland, M. T.","<i>cis</i>-Diaquabis(1,10-phenanthroline-<i>N</i>,<i>N</i>')zinc(II) (1,10-Phenanthroline-<i>N</i>,<i>N</i>')bis(thiosulfato-<i>S</i>)zincate(II) Monohydrate","Acta Crystallographica Section C","1996","52","4","820","823","10.1107/S010827019501359X","","","0.71073","MoKα","","0.0658","0.0458","","0.1333","0.1183","","","","0.986","1.012","1.012","","","","","has coordinates,has disorder","199684","2020-10-21","18:00:00",""
"2004757","8.694","0.001","11.344","0.002","11.636","0.003","74.29","0.02","87.43","0.02","70.66","0.02","1041.1","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Nonasodium Bis(hexahydroxoaluminate) Trihydroxide Hexahydrate","","- Al2 H27 Na9 O21 -","- Al2 H27 Na9 O21 -","- Al4 H54 Na18 O42 -","2","1","JZ1084","Zabel, V.; Schneider, M.; Weinberger, M.; Gessner, W.","Nonasodium Bis(hexahydroxoaluminate) Trihydroxide Hexahydrate","Acta Crystallographica Section C","1996","52","4","747","749","10.1107/S0108270195015277","","","0.71073","MoKα","","0.0587","0.032","","0.0823","0.0728","","","","1.052","1.135","1.135","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004758","21.316","0.011","12.296","0.007","20.686","0.008","90","","109.98","0.06","90","","5096","5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Cs8 F10 Fe15 O48 P12 -","- Cs8 F10 Fe15 O48 P12 -","- Cs32 F40 Fe60 O192 P48 -","4","0.5","JZ1087","Frenzen, G.; Yakubovich, O. V.; Mel'nikov, O. K.","A New Synthetic Fluoride Phosphate of Mixed-Valence Iron: Cs~8~Fe~8~^3+^Fe~7~^2+^F~10~(PO~4~)~12~","Acta Crystallographica Section C","1996","52","4","749","753","10.1107/S0108270195015472","","","0.71073","MoKα","","0.0472","0.0357","","0.0899","0.0847","","","","1.077","1.119","1.119","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004759","12.007","0.003","18.708","0.005","31.213","0.01","90","","90","","90","","7011","3","293","2","293","2","","","","","","","","7","I b c a","-I 2b 2c","73","","tris(4,4'-bipyrimidine)ruthenium(II) dihexafluorophosphate monoacetone","","- C27 H24 F12 N12 O P2 Ru -","- C27 H24 F12 N12 O P2 Ru -","- C216 H192 F96 N96 O8 P16 Ru8 -","8","0.5","JZ1090","Breu, J.; Belser, P.; Yersin, H.","Tris(4,4'-bipyrimidine)ruthenium(II) Bis(hexafluorophosphate) Acetone Solvate","Acta Crystallographica Section C","1996","52","4","858","861","10.1107/S0108270195014156","","","0.71069","MoKα","","0.0497","0.0387","","0.118","0.1109","","","","0.981","1.056","1.056","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004760","12.6439","0.0015","13.677","0.002","17.107","0.003","67.357","0.01","85.069","0.012","86.429","0.01","2718.8","0.7","208","2","208","2","","","","","","","","6","P -1","-P 1","2","Bis(triphenylphosphine)iminiumnitrito(phthalocyaninato)zincate Hydrate","","","- C68 H48 N10 O3 P2 Zn -","- C68 H48 N10 O3 P2 Zn -","- C136 H96 N20 O6 P4 Zn2 -","2","1","JZ1091","Assmann, B.; Sievertsen, S.; Homborg, H.","Bis(triphenylphosphine)iminium Nitrito(phthalocyaninato)zincate Hydrate","Acta Crystallographica Section C","1996","52","4","876","879","10.1107/S0108270195014351","","","0.71069","MoKα","","0.0412","0.0295","","0.0776","0.0726","","","","1.04","1.067","1.067","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004761","14.063","0.003","5.267","0.0005","18.941","0.003","90","","98.387","0.014","90","","1388","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6,6'-Diphenyl-3,3'-bis-1,2,4,5-tetrazine","","- C16 H10 N8 -","- C16 H10 N8 -","- C64 H40 N32 -","4","1","JZ1094","Breu, J.; Range, K.-J.; Biedermann, N.; Schmid, K.; Sauer, J.","Arene‒Arene Stacking in 6,6'-Diphenyl-3,3'-bi-1,2,4,5-tetrazine and 6-Phenyl-1,2,4,5-tetrazine-3-carbaldehyde Benzoylhydrazone Monohydrate","Acta Crystallographica Section C","1996","52","4","936","940","10.1107/S0108270195015216","","","0.71069","MoKα","","0.1055","0.0378","","0.0886","0.0724","","","","0.745","0.968","0.968","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004762","6.53","0.0003","8.6338","0.0006","27.7016","0.0009","90","","96.052","0.003","90","","1553.08","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Phenyl-1,2,4,5-tetrazine-3-carbaldehyde-benzoylhydrazone monohydrate","","- C16 H14 N6 O2 -","- C16 H14 N6 O2 -","- C64 H56 N24 O8 -","4","1","JZ1094","Breu, J.; Range, K.-J.; Biedermann, N.; Schmid, K.; Sauer, J.","Arene‒Arene Stacking in 6,6'-Diphenyl-3,3'-bi-1,2,4,5-tetrazine and 6-Phenyl-1,2,4,5-tetrazine-3-carbaldehyde Benzoylhydrazone Monohydrate","Acta Crystallographica Section C","1996","52","4","936","940","10.1107/S0108270195015216","","","1.5418","CuKα","","0.1345","0.0428","","0.1186","0.0994","","","","0.808","1.005","1.005","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004763","9.236","0.002","11.236","0.002","9.283","0.002","90","","90.44","0.02","90","","963.3","0.3","293","2","293","2","","","","","","","","5","I 1 2/m 1","-I 2y","12","Quecksilberdiiodid.(18-Krone-6)","1,4,7,10,13,16-Hexaoxacyclooctadecan-Quecksilberdiiodid","","- C12 H24 Hg I2 O6 -","- C12 H24 Hg I2 O6 -","- C24 H48 Hg2 I4 O12 -","2","0.25","JZ1095","El Essawi, M.; Abd El Khalik, S.; Tebbe, K.-F.","Verfeinerung von Quecksilberdiiodid-(18-Krone-6), Hg(18-krone-6)I~2~","Acta Crystallographica Section C","1996","52","4","818","820","10.1107/S0108270195014697","","","0.71069","MoKα","","0.0203","0.0175","","0.0394","0.0388","","","","1.068","1.106","1.106","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004764","10.5458","0.0009","12.4347","0.001","12.5963","0.0012","65.749","0.009","85.167","0.008","68.828","0.007","1400.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tetraphenylphosphonium trans-Tetrabromoaquacarbonylosmate(III)","","- C25 H22 Br4 O2 Os P -","- C25 H22 Br4 O2 Os P -","- C50 H44 Br8 O4 Os2 P2 -","2","1","JZ1098","Höhling, M.; Preetz, W.","Tetraphenylphosphonium <i>trans</i>-Aquatetrabromo(carbonyl)osmate(III), <i>trans</i>-[(C~6~H~5~)~4~P][OsBr~4~(CO)(H~2~O)]","Acta Crystallographica Section C","1996","52","4","863","865","10.1107/S0108270195014259","","","0.71069","MoKα","","0.0683","0.0298","","0.0725","0.0556","","","","1.162","1.069","1.069","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004765","16.897","0.002","4.9442","0.0005","12.295","0.001","90","","103.418","0.009","90","","999.11","0.18","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Cobalt Silicon Diphosphate","","- Co2 O14 P4 Si -","- Co2 O14 P4 Si -","- Co8 O56 P16 Si4 -","4","0.5","JZ1108","Glaum, R.; Schmidt, A.","Cobalt Silicon Diphosphate, Co~2~Si(P~2~O~7~)~2~","Acta Crystallographica Section C","1996","52","4","762","764","10.1107/S0108270195016982","","","0.71069","MoKα","","0.0398","0.02","","0.0505","0.046","","","","1.047","1.096","1.096","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004766","5.938","0.001","10.206","0.002","16.447","0.004","90","","90","","90","","996.7","0.4","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C11 H10 O4 -","- C11 H10 O4 -","- C44 H40 O16 -","4","1","KA1134","Flasche, M.; Raabe, G.","Two Diastereomers of Benzylidene-<small>D</small>-erythronolactone","Acta Crystallographica Section C","1996","52","4","895","899","10.1107/S0108270195012443","","","1.54179","CuKα","","","0.036","","","0.036","","","","","5.15","5.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004767","5.7","0.0007","10.7002","0.0009","16.142","0.001","90","","90","","90","","984.52","0.16","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C11 H10 O4 -","- C11 H10 O4 -","- C44 H40 O16 -","4","1","KA1134","Flasche, M.; Raabe, G.","Two Diastereomers of Benzylidene-<small>D</small>-erythronolactone","Acta Crystallographica Section C","1996","52","4","895","899","10.1107/S0108270195012443","","","1.54179","CuKα","","","0.035","","","0.03","","","","","3.877","3.877","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004768","6.097","0.007","6.804","0.005","16.92","0.02","90","","97.66","0.06","90","","695.6","1.3","295","3","295","3","","","","","","","","5","P 1 21 1","P 2yb","4","","(2R,3R) 3-Amino-1-(1'-methyloxycarbonyl-2-methyl-prop-1'-enyl)-4-oxoazetidine-2- sulfonic Acid Monohydrate","","- C9 H16 N2 O7 S -","- C9 H16 N2 O7 S -","- C18 H32 N4 O14 S2 -","2","1","KA1146","Mandic, Z.; Kiralj, R.; Kojic-Prodic, B.; Kovacevic, M.","(2<i>R</i>,3<i>R</i>)-3-Ammonio-1-(1-methoxycarbonyl-2-methyl-1-propenyl)-4-oxoazetidine-2-sulfonate Monohydrate: a New Chiral β-Lactam Synthon","Acta Crystallographica Section C","1996","52","4","988","991","10.1107/S0108270195014077","","","0.71073","MoKα","","","0.0408","","","0.0431","","","","","0.46","0.46","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004769","18.847","0.003","13.715","0.002","17.543","0.003","90","","95.93","0.04","90","","4510.4","1.3","140","2","140","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Iodo-tris(triphenylphosphine)silver(I)","","- C54 H45 Ag I P3 -","- C54 H45 Ag I P3 -","- C216 H180 Ag4 I4 P12 -","4","1","KA1149","Hibbs, D. E.; Hursthouse, M. B.; Malik, K. M. A.; Beckett, M. A.; Jones, P. W.","Iodotris(triphenylphosphine)silver(I), [Ag(PPh~3~)~3~I]","Acta Crystallographica Section C","1996","52","4","884","887","10.1107/S0108270195015228","","","0.71069","MoKα","","0.0558","0.0489","","0.1177","0.116","","","","1.011","1.096","1.096","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004770","10.433","0.002","33.313","0.001","9","0.004","90","","90","","90","","3128","1.5","173","1","173","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","6-O-p-bromobenzoyl-salvileucolide-methylester","","","- C33 H43 Br O7 -","- C33 H43 Br O7 -","- C132 H172 Br4 O28 -","4","1","KA1151","Linden, A.; Juch, M.; Rüedi, P.","Absolute Configuration of 6-<i>O</i>-<i>p</i>-Bromobenzoylsalvileucolide Methyl Ester","Acta Crystallographica Section C","1996","52","4","933","935","10.1107/S0108270195014089","","","0.71069","MoKα","","0.1563","0.0511","","0.0433","0.036","","","","","1.458","1.458","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004771","16.013","0.006","11.86","0.006","9.643","0.002","90","","98.5","0.02","90","","1811.2","1.2","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","2,2'-[(1,2-cyclohexanediyl)bis(nitrilomethylidyne)]bisphenol","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C80 H88 N8 O8 -","4","1","KA1152","Cannadine, J. C.; Corden, J. P.; Errington, W.; Moore, P.; Wallbridge, M. G. H.","Two Schiff Base Ligands Derived from 1,2-Diaminocyclohexane","Acta Crystallographica Section C","1996","52","4","1014","1017","10.1107/S0108270195014090","","","0.71073","MoKα","","0.0484","0.0436","","0.1219","0.1071","","","","1.022","1.064","1.064","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004772","11.832","0.009","13.797","0.005","12.954","0.007","90","","112.51","0.04","90","","1954","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[(1,2-cyclohexanediyl)bis(nitriloethylidyne)]bisphenol","","- C22 H26 N2 O2 -","- C22 H26 N2 O2 -","- C88 H104 N8 O8 -","4","1","KA1152","Cannadine, J. C.; Corden, J. P.; Errington, W.; Moore, P.; Wallbridge, M. G. H.","Two Schiff Base Ligands Derived from 1,2-Diaminocyclohexane","Acta Crystallographica Section C","1996","52","4","1014","1017","10.1107/S0108270195014090","","","0.71073","MoKα","","0.1343","0.0451","","0.286","0.0896","","","","0.688","1.054","1.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004773","7","0.004","30.605","0.005","7.151","0.003","90","","110.32","0.04","90","","1436.7","1.1","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 O3 -","- C18 H16 O3 -","- C72 H64 O12 -","4","1","KA1158","Böcskei, Z.; Simon, K.; Varga, M.; Hermecz, I.","Ipriflavone, an Antiostheophorotic Agent","Acta Crystallographica Section C","1996","52","4","1022","1024","10.1107/S0108270195015241","","","1.5418","CuKα","","0.1986","0.0741","","0.3279","0.2047","","","","1.033","1.101","1.101","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2004774","17.0989","0.0022","10.4699","0.0018","17.7115","0.0024","90","","109.721","0.008","90","","2984.8","0.8","294","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H68 Cl2 N4 O2 Sn2 -","- C32 H34 Cl N2 O Sn -","- C128 H136 Cl4 N8 O4 Sn4 -","4","1","KA1159","Hazell, A.; Hu, H.; Khoo, L. E.","Chloro{2-[2-(dimethylamino)ethyliminomethyl]phenol}triphenyltin(IV) Benzene Hemisolvate, [SnCl(C~6~H~5~)~3~(C~11~H~16~N~2~O)].0.5C~6~H~6~","Acta Crystallographica Section C","1996","52","4","873","876","10.1107/S0108270195014107","","","0.71073","MoKα","","","0.033","","","0.042","","","","","0.968","0.968","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004775","8.678","0.003","16.152","0.002","8.421","0.001","90","","112.75","0.01","90","","1088.5","0.4","300","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H32 Cl2 Cu N4 O8 -","- C14 H32 Cl2 Cu N4 O8 -","- C28 H64 Cl4 Cu2 N8 O16 -","2","0.5","KH1042","Wang, A.; Lee, T.-J.; Chi, T.-Y.; Liao, F.-L.; Liu, G.-S.; Chung, C.-S.","Diperchlorato[(1<i>RS</i>,4<i>RS</i>,5<i>SR</i>,7<i>RS</i>,8<i>SR</i>,11<i>SR</i>,12<i>RS</i>,14<i>SR</i>)-(5,7,12,14-tetramethyl-1,4,8,11-tetraazacyclotetradecane)]copper(II)","Acta Crystallographica Section C","1996","52","4","806","807","10.1107/S0108270195012704","","","0.71073","MoKα","","","0.0492","","","0.051","","","","","1.01","1.01","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004776","27.395","0.008","10.804","0.003","19.201","0.003","90","","126.54","0.02","90","","4566","2","296","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H42 Cu4 N6 S10 -","- C36 H42 Cu4 N6 S10 -","- C144 H168 Cu16 N24 S40 -","4","0.5","KH1046","Li, H.; Sheng, T.; Huang, Q.; Wu, X.","Tetrakis(3-methylpyridine)-1κ<i>N</i>,2κ<i>N</i>,3κ<i>N</i>,4κ<i>N</i>-bis(μ~4~-pentathio)-1:2κ^2^<i>S</i>^1^,2κ<i>S</i>^4^,3κ<i>S</i>^2^,3:4κ^2^<i>S</i>^5^;1κ<i>S</i>^4'^,1:3κ^2^<i>S</i>^1'^,2:4κ^2^<i>S</i>^5'^,4κ<i>S</i>^2'^-tetracopper(I) Bis(3-methylpyridine) Solvate","Acta Crystallographica Section C","1996","52","4","887","889","10.1107/S0108270195011462","","","0.71073","MoKα","","","0.049","","","0.068","","","","","0.97","0.97","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004777","20.738","0.007","9.791","0.003","30.251","0.01","90","","90","","90","","6142","3","291","2","291","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-butyl-1-[[2'-(1H-tetrazol-5-yl)biphenyl-4-yl]methyl]- 5-phenyl-6-dimethoxymethyl-1H-imidazopyridine","","- C33 H33 N7 O2 -","- C33 H33 N7 O2 -","- C264 H264 N56 O16 -","8","1","KH1056","Shin, W.; Yoon, T.-S.; Yoo, S. E.","A Non-Peptide Angiotensin II Receptor Antagonist: 2-Butyl-6-dimethoxymethyl-5-phenyl-1-{[2'-(1<i>H</i>-tetrazol-5-yl)biphenyl-4-yl]methyl}-1<i>H</i>-imidazo[5,4-<i>b</i>]pyridine","Acta Crystallographica Section C","1996","52","4","1019","1022","10.1107/S0108270195011978","","","1.5418","CuKα","","0.2565","0.1066","","0.3363","0.2575","","","","1.327","1.824","1.824","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004778","8.943","0.001","9.222","0.002","17.184","0.002","90","","90.53","0.01","90","","1417.1","0.4","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-Diammine-bis(pyrazole)platinum(II) nitrate","","- C6 H14 N8 O6 Pt -","- C6 H14 N8 O6 Pt -","- C24 H56 N32 O24 Pt4 -","4","1","KH1060","Sakai, K.; Ishikura, A.; Tsubomura, T.; Matsumoto, K.","Two Different Crystal Forms of <i>cis</i>-diamminebis(pyrazole)platinum(II) Nitrate","Acta Crystallographica Section C","1996","52","4","779","783","10.1107/S0108270195013461","","","0.71069","MoKα","","","0.0391","","","0.0377","","","","","3.18","3.18","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004779","10.049","0.002","7.531","0.003","12.298","0.001","90","","98.89","0.01","90","","919.5","0.4","296","","296","","","","","","","","","5","P 1 21 1","P 2yb","4","","cis-Diammine-bis(pyrazole)platinum(II) nitrate pyrazole","","- C9 H18 N10 O6 Pt -","- C9 H18 N10 O6 Pt -","- C18 H36 N20 O12 Pt2 -","2","1","KH1060","Sakai, K.; Ishikura, A.; Tsubomura, T.; Matsumoto, K.","Two Different Crystal Forms of <i>cis</i>-diamminebis(pyrazole)platinum(II) Nitrate","Acta Crystallographica Section C","1996","52","4","779","783","10.1107/S0108270195013461","","","0.71069","MoKα","","","0.0383","","","0.0248","","","","","1.2","1.2","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004780","7.428","0.002","18.238","0.002","12.4692","0.0014","90","","90.743","0.016","90","","1689.1","0.5","298","3","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H25 N4 O3 Tc -","- C14 H25 N4 O3 Tc -","- C56 H100 N16 O12 Tc4 -","4","1","KH1061","Tsai, C.-S.; Lu, T.-H.; Duh, J.-Y.; Yeh, S.-J.","(<i>meso</i>-4,8-Diaza-3,9-dimethyl-6,6-trimethyleneundecane-2,10-dione dioximato-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')oxotechnetium(V), [TcO(C~14~H~25~N~4~O~2~)]","Acta Crystallographica Section C","1996","52","4","838","840","10.1107/S0108270195014181","","","0.71073","MoKα","","","0.032","","","0.051","","","","","2.02","2.02","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004781","12.12","0.003","18.425","0.003","7.11","0.006","90","","90","","90","","1587.7","1.4","296","","296","","","","","","","","","7","P m m n :2","-P 2ab 2a","59","","Di-μ-pyrazolato-bis[(2,2'-bipyridine)platinum(II)] tetrafluoroborate monohydrate","","- C26 H24 B2 F8 N8 O Pt2 -","- C25 H21 B F6 N8 O0.25 Pt -","- C50 H42 B2 F12 N16 O0.5 Pt2 -","2","0.25","KH1064","Sakai, K.; Sato, T.; Tsubomura, T.; Matsumoto, K.","Di-(μ-pyrazolato-<i>N</i>:<i>N</i>')-bis[(2,2'-bipyridine-<i>N</i>,<i>N</i>')platinum(II)] Bis(tetrafluoroborate) Monohydrate","Acta Crystallographica Section C","1996","52","4","783","786","10.1107/S0108270195014326","","","0.71069","MoKα","","","0.0577","","","0.0334","","","","","1.84","1.84","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004782","11.494","0.001","6.263","0.001","12.479","0.001","90","","111.01","0.01","90","","838.6","0.18","298","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H20 N2 O2 -","- C20 H20 N2 O2 -","- C40 H40 N4 O4 -","2","1","MU1207","Vencato, I.; Neves, A.; Ceccato, A. S.; Horn, Jnr, A.","<i>N</i>,<i>N</i>-Bis(2-hydroxybenzyl)-<i>N</i>-(2-pyridylmethyl)amine, H~2~BBPA","Acta Crystallographica Section C","1996","52","4","949","951","10.1107/S0108270195014739","","","0.71073","MoKα","","0.129","0.073","","","0.074","","","","","0.99","0.99","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004783","12.67","0.01","15.73","0.01","17.471","0.009","90","","102.76","0.05","90","","3396","4","150","","423.2","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C31 H44 Cl2 O2 P4 Pt -","- C31 H44 Cl2 O2 P4 Pt -","- C124 H176 Cl8 O8 P16 Pt4 -","4","1","MU1219","Chiffey, A. F.; Evans, J.; Levason, W.; Reid, G.","[Pt(PMe~3~)~2~(dppm)]Cl~2~.2H~2~O [dppm = Bis(diphenylphosphino)methane]","Acta Crystallographica Section C","1996","52","4","799","801","10.1107/S0108270195014570","","","0.71073","MoKα","","0.097","0.071","","0.083","0.08","","","","4.07","4.28","4.28","","","","","has coordinates","208382","2020-10-21","18:00:00",""
"2004784","6.992","0.003","13.356","0.005","9.521","0.003","90","","104.05","0.03","90","","862.5","0.6","150","","423.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H18 Mo O10 P2 -","- C10 H18 Mo O10 P2 -","- C20 H36 Mo2 O20 P4 -","2","0.5","MU1224","Champness, N. R.; Hopkins, A. M.; Reid, G.","<i>trans</i>-[Mo(CO)~4~{P(OMe)~3~}~2~]","Acta Crystallographica Section C","1996","52","4","797","799","10.1107/S010827019501479X","","","0.71073","MoKα","","0.0314","0.029","","0.0365","0.0363","","","","2.87","3.083","3.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004785","10.224","0.001","21.514","0.002","10.23","0.001","90","","90","","90","","2250.2","0.4","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Dimethylbis(O-cyclohexyldithiocarbonato)tin(IV).","","- C16 H28 O2 S4 Sn -","- C16 H28 O2 S4 Sn -","- C64 H112 O8 S16 Sn4 -","4","0.5","MU1227","Mohamed-Ibrahim, M. I.; Khor, C.-K.; Fun, H.-K.; Sivakumar, K.","Bis(<i>O</i>-cyclohexyl dithiocarbonato)dimethyltin(IV)","Acta Crystallographica Section C","1996","52","4","845","846","10.1107/S0108270195015009","","","0.71073","MoKα","","0.0749","0.0668","","0.1605","0.1577","","","","1.157","1.245","1.245","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004786","14.04","0.001","10.222","0.001","25.699","0.003","90","","93.63","0.01","90","","3680.8","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Pyrrolidinedithiocarbamatobis(triphenylphosphine)silver(I).","","- C41 H38 Ag N P2 S2 -","- C41 H38 Ag N P2 S2 -","- C164 H152 Ag4 N4 P8 S8 -","4","1","MU1228","Othman, A. H.; Fun, H.-K.; Sivakumar, K.","(<i>N</i>-Pyrrolidinecarbodithioato-<i>S</i>,<i>S</i>')bis(triphenylphosphine)silver(I)","Acta Crystallographica Section C","1996","52","4","843","845","10.1107/S0108270195014806","","","0.71073","MoKα","","0.0589","0.041","","0.1763","0.1111","","","","1.032","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004787","7.162","0.001","20.033","0.002","10.611","0.001","90","","107.21","0.01","90","","1454.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","p-Methoxybenzaldehyde Nictonylhydrazone Dihydrate.","","- C14 H17 N3 O4 -","- C14 H17 N3 O4 -","- C56 H68 N12 O16 -","4","1","MU1230","Fun, H.-K.; Sivakumar, K.; Lu, Z.-L.; Duan, C.-Y.; Tian, Y.-P.; You, X.-Z.","<i>p</i>-Methoxybenzaldehyde Nicotinoylhydrazone Dihydrate","Acta Crystallographica Section C","1996","52","4","986","988","10.1107/S010827019501540X","","","0.71073","MoKα","","0.0603","0.0466","","0.1426","0.1345","","","","1.063","1.181","1.181","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004788","6.11","0.001","14.106","0.001","16.609","0.0009","90","","90","","90","","1431.5","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-phenyl-4,5-dimethoxy-2,7,8,9-tetrahydroisoquinolinium","","- C17 H19 N O2 -","- C17 H19 N O2 -","- C68 H76 N4 O8 -","4","1","NA1134","","X-ray Structure Investigations of Potential β-Blockers. II. 6,7-Dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline","Acta Crystallographica C","1996","52","","1038","1040","10.1107/S0108270195013606","","","1.54178","CuKα","","0.0603","0.0429","","0.1221","0.1055","","","","1.276","1.275","1.275","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004789","13.718","0.001","7.4307","0.0003","18.4638","0.0009","90","","91.524","0.005","90","","1881.43","0.18","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichloro-bis(nicotinamide-N^1^-acetato)zinc(II)","","- C16 H16 Cl2 N4 O6 Zn -","- C16 H16 Cl2 N4 O6 Zn -","- C64 H64 Cl8 N16 O24 Zn4 -","4","0.5","NA1184","Zelenák, V.; Györyová, K.; Císarová, I.; Loub, J.","Dichlorobis(nicotinamide-<i>N</i>^1^-acetate-<i>O</i>)zinc(II)","Acta Crystallographica Section C","1996","52","4","808","810","10.1107/S0108270195015186","","","0.71073","MoKα","","0.0275","0.0234","","0.0617","0.0599","","","","1.061","1.081","1.081","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2004790","6.595","0.002","9.964","0.002","17.821","0.002","90","","94.76","0.02","90","","1167","0.4","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 N2 O4 Sn2 -","- C18 H24 N2 O4 Sn2 -","- C36 H48 N4 O8 Sn4 -","2","0.5","NA1192","Stocco, G.; Guli, G.; Girasolo, M. A.; Bruno, G.; Nicolò, F.; Scopelliti, R.","Poly[<i>trans</i>-bis{trimethyltin(IV)}-μ-(2,2'-bipyridyl-4,4'-dicarboxylato-<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>''')]. A Layered Structure Composed of Sheets Interconnected by Organometallic Moieties","Acta Crystallographica Section C","1996","52","4","829","832","10.1107/S0108270195013400","","","0.71073","MoKα","","","0.0219","","","0.0295","","","","","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004791","7.569","0.001","11.557","0.002","12.158","0.003","61.84","0.01","88.74","0.02","84.59","0.01","933.2","0.3","293","","","","","","","","","","","8","P -1","-P 1","2","","","","- C15 H17 F6 N2 O P Pt S -","- C15 H17 F6 N2 O P Pt S -","- C30 H34 F12 N4 O2 P2 Pt2 S2 -","2","1","NA1193","Bruno, G.; Nicolò, F.; Scopelliti, R.; Arena, G.","(Dimethyl sulfoxide-<i>S</i>)methyl(1,10-phenanthroline-<i>N</i>,<i>N</i>')platinum(II) Hexafluorophosphate","Acta Crystallographica Section C","1996","52","4","827","829","10.1107/S0108270195013394","","","0.71073","MoKα","","","0.0213","","","0.0497","","","","","1.017","1.017","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004792","11.388","0.004","19.834","0.006","13.009","0.005","90","","112.18","0.03","90","","2720.9","1.7","293","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H21 Br N O3 P2 Re -","- C27 H20 Br N O3 P2 Re -","- C108 H80 Br4 N4 O12 P8 Re4 -","4","1","NA1196","Graziani, R.; Casellato, U.","[Bis(diphenylphosphino)amine-<i>P</i>,<i>P</i>']bromotricarbonylrhenium(I), [ReBr(CO)~3~{NH(PPh~2~)~2~}]","Acta Crystallographica Section C","1996","52","4","850","852","10.1107/S0108270195012844","","","0.71073","MoKα","","","0.042","","","0.042","","","","","3.69","3.69","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004793","7.2894","0.0009","14.221","0.004","17.324","0.005","106.49","0.03","99.47","0.02","93.37","0.01","1687.9","0.8","293","","293","","","","","","","","","5","P -1","-P 1","2","Bis(trietanolamine)Ca(II) 3,5-dinitribenzoate","Bis(trietanolamine)Ca(II) 3,5-dinitribenzoate","","- C26 H36 Ca N6 O18 -","- C26 H36 Ca N6 O18 -","- C52 H72 Ca2 N12 O36 -","2","1","NA1201","","Bis(triethanolamine)calcium 3,5-Dinitrobenzoate","Acta Crystallographica C","1996","52","","789","792","10.1107/S010827019501434X","","","0.71069","MoKα","","0.123","0.062","","0.116","0.08","","","","1.057","1.115","1.115","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004794","9.648","0.002","21.24","0.01","5.925","0.003","94.23","0.04","106.93","0.03","86.66","0.03","1157.5","0.9","293","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H11 N O2 -","- C15 H11 N O2 -","- C60 H44 N4 O8 -","4","2","NA1203","Honda, T.; Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A.","7-Amino-3-phenylcoumarin","Acta Crystallographica Section C","1996","52","4","899","901","10.1107/S0108270195014818","","","1.54184","CuKα","","","0.058","","","0.075","","","","","3.45","3.45","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004795","8.286","0.002","6.824","0.004","11.755","0.004","110.9","0.04","92.05","0.02","92.37","0.04","619.5","0.5","293","","293","","","","","","","","","4","P -1","-P 1","2","","2,8-dimethyl-5,11-dipropyl-4,5,6,10,11,12-hexahydro-imidazo[4,5-h]- imidazo[4,5-c][1,6]diazecine","","- C18 H42 N6 O6 -","- C18 H42 N6 O6 -","- C18 H42 N6 O6 -","1","0.5","NS1004","Mendoza-Díaz, G.; Driessen, W. L.; Reedijk, J.","2,8-Dimethyl-5,11-dipropyl-1,4,5,6,7,10,11,12-octahydroimidazo[4,5-<i>h</i>]imidazo[4,5-<i>c</i>][1,6]diazecine Hexahydrate","Acta Crystallographica Section C","1996","52","4","960","962","10.1107/S0108270195011425","","","0.71073","MoKα","","0.132","0.054","","0.065","0.058","","","","1.781","2.469","2.469","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004797","6.847","0.001","10.429","0.002","13.655","0.002","90","","90","","90","","975.1","0.3","293","","","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C3 H9 Br2.116 Cd Cl0.884 O S -","- C3 H9 Cd Cl3 O S -","- C12 H36 Cd4 Cl12 O4 S4 -","4","0.5","PA1189","De Brauer, C.; Kolinsky, C.; Jannin, M.; Puget, R.","Trimethyloxosulfonium Salts. IX. Study of some Mixed Compounds, (CH~3~)~3~SOCdCl~3{-~<i>x</i>}Br~<i>x~</i>","Acta Crystallographica Section C","1996","52","4","812","817","10.1107/S0108270195011565","","","0.71073","MoKα","","","0.0113","","","0.0133","","","","","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004798","6.825","0.001","10.415","0.002","13.63","0.002","90","","90","","90","","968.9","0.3","293","","","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C3 H9 Br1.787 Cd Cl1.213 O S -","- C3 H9 Cd Cl3 O S -","- C12 H36 Cd4 Cl12 O4 S4 -","4","0.5","PA1189","De Brauer, C.; Kolinsky, C.; Jannin, M.; Puget, R.","Trimethyloxosulfonium Salts. IX. Study of some Mixed Compounds, (CH~3~)~3~SOCdCl~3{-~<i>x</i>}Br~<i>x~</i>","Acta Crystallographica Section C","1996","52","4","812","817","10.1107/S0108270195011565","","","0.71073","MoKα","","","0.015","","","0.017","","","","","1.29","1.29","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004799","6.782","0.001","10.335","0.002","13.572","0.002","90","","90","","90","","951.3","0.3","293","","","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C3 H9 Br1.183 Cd Cl1.817 O S -","- C3 H9 Cd Cl3 O S -","- C12 H36 Cd4 Cl12 O4 S4 -","4","0.5","PA1189","De Brauer, C.; Kolinsky, C.; Jannin, M.; Puget, R.","Trimethyloxosulfonium Salts. IX. Study of some Mixed Compounds, (CH~3~)~3~SOCdCl~3{-~<i>x</i>}Br~<i>x~</i>","Acta Crystallographica Section C","1996","52","4","812","817","10.1107/S0108270195011565","","","0.71073","MoKα","","","0.0109","","","0.0126","","","","","0.82","0.82","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004800","6.765","0.001","10.304","0.002","13.544","0.002","90","","90","","90","","944.1","0.3","293","","","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C3 H9 Br0.962 Cd Cl2.038 O S -","- C3 H9 Cd Cl3 O S -","- C12 H36 Cd4 Cl12 O4 S4 -","4","0.5","PA1189","De Brauer, C.; Kolinsky, C.; Jannin, M.; Puget, R.","Trimethyloxosulfonium Salts. IX. Study of some Mixed Compounds, (CH~3~)~3~SOCdCl~3{-~<i>x</i>}Br~<i>x~</i>","Acta Crystallographica Section C","1996","52","4","812","817","10.1107/S0108270195011565","","","0.71073","MoKα","","","0.0107","","","0.012","","","","","0.88","0.88","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004801","6.744","0.001","10.253","0.002","13.517","0.002","90","","90","","90","","934.6","0.3","293","","","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C3 H9 Br0.607 Cd Cl2.393 O S -","- C3 H9 Cd Cl3 O S -","- C12 H36 Cd4 Cl12 O4 S4 -","4","0.5","PA1189","De Brauer, C.; Kolinsky, C.; Jannin, M.; Puget, R.","Trimethyloxosulfonium Salts. IX. Study of some Mixed Compounds, (CH~3~)~3~SOCdCl~3{-~<i>x</i>}Br~<i>x~</i>","Acta Crystallographica Section C","1996","52","4","812","817","10.1107/S0108270195011565","","","0.71073","MoKα","","","0.01","","","0.0113","","","","","0.84","0.84","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004802","6.716","0.001","10.192","0.002","13.476","0.002","90","","90","","90","","922.4","0.3","293","","","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C3 H9 Br0.286 Cd Cl2.714 O S -","- C3 H9 Cd Cl3 O S -","- C12 H36 Cd4 Cl12 O4 S4 -","4","0.5","PA1189","De Brauer, C.; Kolinsky, C.; Jannin, M.; Puget, R.","Trimethyloxosulfonium Salts. IX. Study of some Mixed Compounds, (CH~3~)~3~SOCdCl~3{-~<i>x</i>}Br~<i>x~</i>","Acta Crystallographica Section C","1996","52","4","812","817","10.1107/S0108270195011565","","","0.71073","MoKα","","","0.0106","","","0.013","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004803","11.513","0.002","9.806","0.003","14.78","0.004","90","","91.9","0.02","90","","1667.7","0.7","294","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H15 N O S3 -","- C17 H15 N O S3 -","- C68 H60 N4 O4 S12 -","4","1","PA1196","Morgant, G.; Labouze, X.; Viossat, B.; Lancelot, J.-C.; Nguyen Huy Dung","2-(2-Aminophénylthio)-2-(2-thiényl)éthyl 2-Thiényl Cétone","Acta Crystallographica Section C","1996","52","4","923","925","10.1107/S0108270195011553","","","0.71073","MoKα","","","0.047","","","0.044","","","","","0.99","0.99","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004804","18.285","0.002","7.726","0.001","16.927","0.002","90","","102.15","0.01","90","","2337.7","0.5","293","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C15 H10 O4 -","- C15 H10 O4 -","- C120 H80 O32 -","8","1","PA1197","Molins, E.; Miravitlles, C.; Wallet, J.-C.; Gaydou, E. M.","2',6'-Dihydroxyflavone and a New Polymorph of 2'-Hydroxyflavonol","Acta Crystallographica Section C","1996","52","4","925","929","10.1107/S0108270195013679","","","0.71073","MoKα","","","0.0424","","","0.129","","","","","0.786","0.786","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004805","6.033","0.001","8.209","0.003","23.091","0.005","90","","93.55","0.01","90","","1141.4","0.5","294","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 O4 -","- C15 H10 O4 -","- C60 H40 O16 -","4","1","PA1197","Molins, E.; Miravitlles, C.; Wallet, J.-C.; Gaydou, E. M.","2',6'-Dihydroxyflavone and a New Polymorph of 2'-Hydroxyflavonol","Acta Crystallographica Section C","1996","52","4","925","929","10.1107/S0108270195013679","","","0.71073","MoKα","","","0.04","","","0.05","","","","","1.58","1.58","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004806","11.507","0.006","12.179","0.001","7.928","0.01","90","","90.03","0.03","90","","1111.1","1.5","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 N4 O2 -","- C10 H12 N4 O2 -","- C40 H48 N16 O8 -","4","1","PA1204","Fettouhi, M.; Boukhari, A.; El Otmani, B.; Essassi, E. M.","7-Ethoxycarbonylmethyl-5-methyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidine","Acta Crystallographica Section C","1996","52","4","1031","1032","10.1107/S0108270195013680","","","0.71073","MoKα","","","0.041","","","0.059","","","","","1.55","1.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004807","5.892","0.003","8.48","0.003","11.509","0.009","90","","90","","90","","575","0.6","120","","120","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","5-Amino-1,2-dimethylimidazole","5-Amino-1,2-dimethylimidazole","","- C5 H9 N3 -","- C5 H9 N3 -","- C20 H36 N12 -","4","1","PA1207","Jones, R. H.; Lothian, A. P.; Ramsden, C. A.","5-Amino-1,2-dimethylimidazole","Acta Crystallographica Section C","1996","52","4","982","984","10.1107/S0108270195011711","","","0.71069","MoKα","","0.0862","0.0365","","0.0723","0.0569","","","","0.623","0.708","0.708","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004808","5.931","0.002","20.811","0.003","12.479","0.001","90","","98.68","0.03","90","","1522.6","0.6","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H40 N4 O2 -","- C36 H38 N4 O2 -","- C72 H76 N8 O4 -","2","0.5","PT1018","Gunasekaran, K.; Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Karunakaran, S.; Kandaswamy, M.","2,2'-Piperazin-1,4-diyldimethylenebis[6-(benzyliminomethyl)-4-methylphenol]","Acta Crystallographica Section C","1996","52","4","1027","1028","10.1107/S0108270195010420","","","1.5418","CuKα","","","0.05","","","0.06","","","","","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004809","8.232","0.002","11.599","0.003","12.996","0.004","90","","105.85","0.02","90","","1193.7","0.6","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 B F4 N3 -","- C10 H12 B F4 N3 -","- C40 H48 B4 F16 N12 -","4","1","PT1023","Jones, R. A.; Powell, A. K.; Whitmore, A. P.","Identification of the <i>N</i>-Alkylation Product of 3-(2-Pyrrolyl)pyridazine","Acta Crystallographica Section C","1996","52","4","1002","1003","10.1107/S0108270195015307","","","0.71073","MoKα","","","0.061","","","0.105","","","","","1.17","1.17","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004810","4.829","0.001","5.843","0.001","13.61","0.002","83.39","0.01","86.16","0.01","82.63","0.02","377.78","0.12","293","","","","","","","","","","","4","P 1","P 1","1","","","","- C17 H22 N2 O2 -","- C17 H22 N2 O2 -","- C17 H22 N2 O2 -","1","1","PT1033","Aakeröy, C. B.; Nieuwenhuyzen, M.","4-Methylbenzylammonium 4-Methylbenzylcarbamate","Acta Crystallographica Section C","1996","52","4","957","960","10.1107/S0108270195013849","","","0.71073","MoKα","","","0.0658","","","0.1714","","","","","1.039","1.039","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004811","14.663","0.002","16.773","0.003","24.441","0.003","90","","97.3","0.01","90","","5962.4","1.5","296","1","296","1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C49 H66 As6 Cl3 F3 O3 Ru2 S -","- C49 H66 As6 Cl3 F3 O3 Ru2 S -","- C196 H264 As24 Cl12 F12 O12 Ru8 S4 -","4","1","TA1055","Heath, G. A.; Hockless, D. C. R.; Yeomans, B. D.","Two `Ruthenium-Blue' Precursors: Tri-μ-chloro-hexakis(dimethylphenylarsine)diruthenium(II) Trifluoromethanesulfonate and Tri-μ-bromo-hexakis(trimethylarsine)diruthenium(II) Trifluoromethanesulfonate","Acta Crystallographica Section C","1996","52","4","854","858","10.1107/S0108270195012534","","","0.7107","MoKα","","","0.054","","","0.055","","","","","3.03","3.03","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004812","10.67","0.004","14.742","0.004","26.253","0.003","90","","91.14","0.02","90","","4129","2","296","1","296","1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C19 H54 As6 Br3 F3 O3 Ru2 S -","- C19 H54 As6 Br3 F3 O3 Ru2 S -","- C76 H216 As24 Br12 F12 O12 Ru8 S4 -","4","1","TA1055","Heath, G. A.; Hockless, D. C. R.; Yeomans, B. D.","Two `Ruthenium-Blue' Precursors: Tri-μ-chloro-hexakis(dimethylphenylarsine)diruthenium(II) Trifluoromethanesulfonate and Tri-μ-bromo-hexakis(trimethylarsine)diruthenium(II) Trifluoromethanesulfonate","Acta Crystallographica Section C","1996","52","4","854","858","10.1107/S0108270195012534","","","0.7107","MoKα","","","0.034","","","0.025","","","","","1.46","1.46","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004813","10.74","0.002","35.173","0.005","10.057","0.002","90","","90","","90","","3799.1","1.2","296","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C40 H44 N4 O8 -","- C40 H44 N4 O8 -","- C160 H176 N16 O32 -","4","1","TA1063","Iijima, K.; Irikawa, H.","Trichotomine Dimethyl Ester","Acta Crystallographica Section C","1996","52","4","1003","1006","10.1107/S0108270195015344","","","1.54178","CuKα","","","0.0493","","","0.0514","","","","","1","1","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004814","7.8849","0.0012","8.2625","0.0015","9.975","0.002","86.11","0.02","66.88","0.02","65.741","0.013","541.5","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","7-nitro-8-hydroxyquinoline-5-sulfonic acid monohydrate","","- C9 H8 N2 O7 S -","- C9 H8 N2 O7 S -","- C18 H16 N4 O14 S2 -","2","1","VJ1030","Balasubramanian, T. P.; Thomas Muthiah, P.","8-Hydroxy-7-nitroquinoline-5-sulfonic Acid Monohydrate","Acta Crystallographica Section C","1996","52","4","1017","1019","10.1107/S010827019501170X","","","0.71073","MoKα","","0.0356","0.0302","","0.0818","0.0783","","","","1.084","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004815","10.518","0.002","12.932","0.002","15.048","0.002","90","","97.99","0.02","90","","2026.9","0.6","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 N2 O7 -","- C23 H22 N2 O7 -","- C92 H88 N8 O28 -","4","1","VJ1032","","4-[(1-Cyclohexenyl)nitromethyl]-2-(3,4-methylenedioxyphenyl)-3-nitro- 3,4-dihydro-2H-1-benzopyran\δag","Acta Crystallographica C","1996","52","","1036","1038","10.1107/S0108270195013515","","","0.71073","MoKα","","","0.038","","","0.095","","","","","1.172","1.172","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004816","27.253","0.003","6.701","0.005","19.306","0.003","90","","119.782","0.009","90","","3060","2","294.2","","294.2","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H22 N2 S2 -","- C14 H22 N2 S2 -","- C112 H176 N16 S16 -","8","1","VJ1034","Hussain, Z.; Fleming, F. F.; Norman, R. E.; Chang, S.-C.","3-Cyano-1-[4-(1,3-dithian-2-yl)butyl]-1,4,5,6-tetrahydropyridine","Acta Crystallographica Section C","1996","52","4","1010","1012","10.1107/S010827019501345X","","","0.7107","MoKα","","","0.0474","","","0.0578","","","","","1.868","1.868","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004817","8.2498","0.0009","15.046","0.002","16.45","0.001","90","","90","","90","","2041.9","0.4","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H29 Ca Cl O16 -","- C12 H29 Ca Cl O16 -","- C48 H116 Ca4 Cl4 O64 -","4","1","AB1260","Wieczorek, M. W.; Błaszczyk, J.; Król, B. W.","Effects of Cation Interactions on Sugar Anion Conformation in Complexes of Lactobionate and Gluconate with Calcium, Sodium or Potassium","Acta Crystallographica Section C","1996","52","5","1193","1198","10.1107/S0108270195011930","","","1.54184","CuKα","","","0.0515","","","0.0595","","","","","0.788","0.788","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004818","8.7037","0.0009","8.7037","0.0009","21.055","0.002","90","","90","","90","","1595","0.3","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H21 K O12 -","- C12 H21 K O12 -","- C48 H84 K4 O48 -","4","1","AB1260","Wieczorek, M. W.; Błaszczyk, J.; Król, B. W.","Effects of Cation Interactions on Sugar Anion Conformation in Complexes of Lactobionate and Gluconate with Calcium, Sodium or Potassium","Acta Crystallographica Section C","1996","52","5","1193","1198","10.1107/S0108270195011930","","","1.54184","CuKα","","","0.0409","","","0.0492","","","","","0.823","0.823","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004819","9.2358","0.0009","10.4021","0.0006","16.7994","0.0005","90","","90","","90","","1613.95","0.19","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H23 Na O13 -","- C12 H23 Na O13 -","- C48 H92 Na4 O52 -","4","1","AB1260","Wieczorek, M. W.; Błaszczyk, J.; Król, B. W.","Effects of Cation Interactions on Sugar Anion Conformation in Complexes of Lactobionate and Gluconate with Calcium, Sodium or Potassium","Acta Crystallographica Section C","1996","52","5","1193","1198","10.1107/S0108270195011930","","","1.54184","CuKα","","","0.032","","","0.0574","","","","","1.358","1.358","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004820","12.4263","0.0007","7.6563","0.0009","11.094","0.001","90","","102.073","0.006","90","","1032.13","0.17","293","","","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C12 H32 Ca O19 -","- C12 H32 Ca O19 -","- C24 H64 Ca2 O38 -","2","0.5","AB1260","Wieczorek, M. W.; Błaszczyk, J.; Król, B. W.","Effects of Cation Interactions on Sugar Anion Conformation in Complexes of Lactobionate and Gluconate with Calcium, Sodium or Potassium","Acta Crystallographica Section C","1996","52","5","1193","1198","10.1107/S0108270195011930","","","1.54184","CuKα","","","0.0264","","","0.0425","","","","","1.765","1.765","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004821","8.4502","0.0009","12.616","0.002","18.219","0.003","90","","92.304","0.009","90","","1940.7","0.5","295","","295","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 Cl2 O2 Pt S2 -","- C16.12 H20.1 Cl2 O2 Pt S2 -","- C64.48 H80.4 Cl8 O8 Pt4 S8 -","4","1","AB1300","Ebbighausen, J.; Farrell, N.; Lövqvist, K.; Oskarsson, Å.","<i>cis</i>-(<i>R</i>,<i>S</i>)-Bis(benzyl methyl sulfoxide)dichloroplatinum(II)","Acta Crystallographica Section C","1996","52","5","1091","1093","10.1107/S0108270195015733","","","0.7107","MoKα","","","0.0529","","","0.0521","","","","","1.776","1.776","","","","","has coordinates,has disorder","192023","2020-10-21","18:00:00",""
"2004822","16.051","0.002","4.6538","0.001","9.9373","0.0012","90","","106.484","0.009","90","","711.8","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DL-GLUTAMINE","DL-GLUTAMINE","","- C5 H10 N2 O3 -","- C5 H10 N2 O3 -","- C20 H40 N8 O12 -","4","1","AB1304","Suresh, S.; Padmanabhan, S.; Vijayan, M.","<small>DL</small>-Glutamine","Acta Crystallographica Section C","1996","52","5","1313","1316","10.1107/S0108270195013771","","","0.71068","MoKα","","0.0619","0.0406","","0.1304","0.1185","","","","1.108","1.153","1.153","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004823","8.681","0.003","11.772","0.002","23.73","0.006","90","","95.8","0.2","90","","2412.6","1.4","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H52 N4 O16 Zn2 -","- C48 H52 N4 O16 Zn2 -","- C96 H104 N8 O32 Zn4 -","2","0.5","AB1306","Hökelek, T.; Necefouglu, H.","Bis(μ-4-hydroxybenzoato-<i>O</i>:<i>O</i>')bis[(<i>N</i>,<i>N</i>-diethylnicotinamide-<i>N</i>^1^)(4-hydroxybenzoato-<i>O</i>)zinc(II)] Dihydrate","Acta Crystallographica Section C","1996","52","5","1128","1131","10.1107/S0108270195015976","","","0.71069","MoKα","","","0.0328","","","0.0396","","","","","1.34","1.34","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004824","10.882","0.003","13.295","0.004","10.824","0.002","104.89","0.02","104.95","0.02","68.68","0.02","1386.1","0.7","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H19 Ag3 Cd1.5 N11 O -","- C36 H38 Ag6 Cd3 N22 O2 -","- C36 H38 Ag6 Cd3 N22 O2 -","1","0.5","AB1315","Soma, T.; Iwamoto, T.","Supramolecular Structure of a Cadmium‒Silver Complex Forming a Two-Dimensional Network Embracing One-Dimensional Chains in a Layered Crystal Structure","Acta Crystallographica Section C","1996","52","5","1200","1203","10.1107/S0108270195016118","","","0.71069","MoKα","","","0.0568","","","0.0476","","","","","1.546","1.546","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004825","5.305","0.001","9.486","0.002","11.437","0.003","94.1","0.2","93.8","0.2","93.6","0.2","571.5","0.3","273","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H10 N2 O3 -","- C13 H10 N2 O3 -","- C26 H20 N4 O6 -","2","1","AB1319","Durruthy Carbonell, O.; Hernandez, R. A.; Roque Infante, E. M.; Au-Alvarez, O.","Structure of <i>N</i>-(2-furylmethyl)-α-cyano-2-furanacrylamide. Addendum","Acta Crystallographica Section C","1996","52","5","1318","1318","10.1107/S010827019501612X","","","0.71073","MoKα","","","0.0364","","","0.1003","","","","","1.095","1.095","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2004826","9.242","0.007","12.304","0.008","18.954","0.009","90","","92.74","0.06","90","","2153","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis[dimethyl(2-hydroxyethyl)ammonium] bis[μ-acetato(O,O')- acetato(O,O')-μ-(2-dimethylaminoethanolato-N, μ-O)-μ~3~-oxo-tetraoxo- diuranate(VI)]","","- C24 H56 N4 O22 U4 -","- C24 H56 N4 O22 U4 -","- C48 H112 N8 O44 U8 -","2","0.5","AB1337","Turpeinen, U.; Hämäläinen, R.; Mutikainen, I.; Orama, O.","Bis[(2-hydroxyethyl)dimethylammonium] Bis[μ-acetato-<i>O</i>:<i>O</i>'-acetato-<i>O</i>,<i>O</i>'-μ-(2-dimethylaminoethanolato-<i>N</i>,μ-<i>O</i>)-μ~3~-oxo-tetraoxodiuranate(VI)]","Acta Crystallographica Section C","1996","52","5","1169","1171","10.1107/S0108270196000716","","","0.71069","MoKα","","0.0922","0.0501","","0.0871","0.0834","","","","1.17","1.395","1.395","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004827","26.618","0.009","8.95","0.004","10.889","0.004","90","","90","","90","","2594.1","1.7","293","2","293","2","","","","","","","","8","P b a m","-P 2 2ab","55","","","","- C17 H27 Cl Cu F6 N3 O4 P -","- C17 H27 Cl Cu F6 N3 O6 P -","- C68 H108 Cl4 Cu4 F24 N12 O24 P4 -","4","0.5","AB1348","Alcock, N. W.; Busch, D. H.; Vance, A. L.","A Copper(II) Complex of a Macrocyclic Schiff Base Ligand with a Polyether Bridge","Acta Crystallographica Section C","1996","52","5","1134","1136","10.1107/S0108270196001278","","","0.71073","MoKα","","0.0794","0.0584","","0.1768","0.1554","","","","1.016","1.033","1.033","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004828","12.083","0.003","12.267","0.003","9.967","0.001","90","","89.98","0.02","90","","1477.3","0.5","296","","296","","","","","","","","","5","P 1 21 1","P 2yb","4","","[(R)-1,2-diallyoxycarbonylethyl][bis(dimethylglyoximato)] [(R)-1-phenylethylamine]cobalt(III)","","- C26 H38 Co N5 O8 -","- C26 H38 Co N5 O8 -","- C52 H76 Co2 N10 O16 -","2","1","AS1195","Sato, H.; Sakai, Y.; Ohashi, Y.; Arai, Y.; Ohgo, Y.","[(<i>R</i>)-1,2-Bis(allyloxycarbonyl)ethyl]bis(dimethylglyoximato-<i>N</i>,<i>N</i>')[(<i>R</i>)-1-phenylethylamine]cobalt(III)","Acta Crystallographica Section C","1996","52","5","1086","1089","10.1107/S0108270195014399","","","0.71073","MoKα","","0.045","0.037","","0.102","0.097","","","","1.043","1.058","1.058","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004829","11.934","0.002","16.344","0.004","24.17","0.002","90","","90","","90","","4714.3","1.5","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","N,N-1,3-Propylenebis(salicylaldimine)bispyridinecobalt(III) tetraphenylborate pyridine solvate.","","- C56 H51 B Co N5 O2 -","- C56 H51 B Co N5 O2 -","- C224 H204 B4 Co4 N20 O8 -","4","1","AS1219","Zhu, D.-R.; You, X.-Z.; Shi, X.-H.; Fun, H.-K.; Sivakumar, K.","[<i>N</i>,<i>N</i>'-1,3-Propylenebis(salicylaldimine)]bis(pyridine)cobalt(III) Tetraphenylborate Pyridine Solvate","Acta Crystallographica Section C","1996","52","5","1146","1148","10.1107/S0108270196000297","","","0.71073","MoKα","","0.0735","0.0453","","0.1184","0.1021","","","","0.932","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004830","12.3735","0.0004","11.4382","0.0004","22.0706","0.0011","90","","97.48","0.003","90","","3097.1","0.2","294","","","","","","","","","","","5","P 1 21/c 1","","","","","","- C31 H28 Cl4 P2 Ru -","- C31 H28 Cl3.986 P2 Ru -","- C124 H112 Cl15.944 P8 Ru4 -","4","1","BK1121","Pearson, W. H.; Shade, J. E.; Brown, J. E.; Bitterwolf, T. E.","Two Monomeric Ruthenium Complexes Containing Bidentate Bis(diphenylphosphino) Ligands","Acta Crystallographica Section C","1996","52","5","1106","1110","10.1107/S0108270195011802","","","0.71073","MoKα","","","0.029","","","0.036","","","","","1.956","1.956","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2004831","15.592","0.004","10.796","0.002","19.676","0.006","90","","109.01","0.01","90","","3131.4","1.4","294","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H30 Cl4 P2 Ru -","- C32 H30 Cl4 P2 Ru -","- C128 H120 Cl16 P8 Ru4 -","4","1","BK1121","Pearson, W. H.; Shade, J. E.; Brown, J. E.; Bitterwolf, T. E.","Two Monomeric Ruthenium Complexes Containing Bidentate Bis(diphenylphosphino) Ligands","Acta Crystallographica Section C","1996","52","5","1106","1110","10.1107/S0108270195011802","","","0.71073","MoKα","","","0.031","","","0.035","","","","","2.562","2.562","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2004832","21.526","0.006","6.447","0.001","12.479","0.002","90","","112.54","0.02","90","","1599.5","0.6","296","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H20 B Co F4 N6 O4 -","- C8 H20 B Co F4 N6 O4 -","- C32 H80 B4 Co4 F16 N24 O16 -","4","0.5","BK1127","Xu, L.; Xu, D.; Xu, Y.; Gu, J.","Diamminebis[dimethylglyoximato(1‒)]cobalt(III) Fluoborate and Perchlorate","Acta Crystallographica Section C","1996","52","5","1119","1122","10.1107/S010827019501568X","","","0.71073","MoKα","","","0.035","","","0.049","","","","","1.48","1.48","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004833","21.56","0.01","6.438","0.001","12.51","0.006","90","","111.87","0.04","90","","1611.5","1.2","296","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H20 Cl Co N6 O8 -","- C8 H20 Cl Co N6 O8 -","- C32 H80 Cl4 Co4 N24 O32 -","4","0.5","BK1127","Xu, L.; Xu, D.; Xu, Y.; Gu, J.","Diamminebis[dimethylglyoximato(1‒)]cobalt(III) Fluoborate and Perchlorate","Acta Crystallographica Section C","1996","52","5","1119","1122","10.1107/S010827019501568X","","","0.71073","MoKα","","","0.049","","","0.055","","","","","1.81","1.81","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004834","13.0354","0.0008","6.3471","0.0005","15.8833","0.0014","90","","107.217","0.006","90","","1255.25","0.17","168","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H24 Cl2 S2 -","- C30 H24 Cl2 S2 -","- C60 H48 Cl4 S4 -","2","0.5","BK1148","Freeman, F.; Lu, H.; Ziller, J. W.","(1<i>Z</i>,3<i>Z</i>)-1,4-Diphenyl-1,4-bis(3-chlorophenylmethylthio)buta-1,3-diene","Acta Crystallographica Section C","1996","52","5","1207","1209","10.1107/S0108270195012108","","","0.71073","MoKα","","","0.043","","","0.064","","","","","1.61","1.61","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004835","8.2","0.008","13.326","0.009","32.093","0.006","90","","90","","90","","3507","4","294","","","","","","","","","","","5","P b c a","","","","","","- C18 H17 N O5 S -","- C18 H17 N O5 S -","- C144 H136 N8 O40 S8 -","8","1","BK1150","Kumaradhas, P.; Nirmala, K. A.","<i>cis</i>-(±)-3-Acetoxy-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine 1-Oxide","Acta Crystallographica Section C","1996","52","5","1259","1261","10.1107/S0108270195015411","","","0.7093","MoKα","","","0.0455","","","0.1374","","","","","1.205","1.205","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004836","8.752","0.002","27.084","0.005","17.973","0.002","90","","90","","90","","4260.3","1.3","295","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C16 H38 Cl N O4 -","- C16 H38 Cl N O4 -","- C128 H304 Cl8 N8 O32 -","8","1","BK1156","Miguel, O. G.; Pizzolatti, M. G.; Yunes, R. A.; Vencato, I.; Calixto, J. B.; Santos, A. R. S.; Contin, A.; Moreira, E. A.","<i>cis</i>-8,10-Di-<i>n</i>-propyllobelidiol Hydrochloride Dihydrate","Acta Crystallographica Section C","1996","52","5","1223","1225","10.1107/S0108270195014636","","","0.7093","MoKα","","","0.0609","","","0.067","","","","","4.45","4.45","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004837","14.891","0.002","7.3102","0.0011","16.1682","0.001","90","","92.38","0.007","90","","1758.5","0.4","295","","295","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","4,4-Dibenzyl-1,4-dihydroisoquinoline","4,4-Dibenzyl-1,4-dihydroisoquinoline","","- C23 H21 N -","- C23 H21 N -","- C92 H84 N4 -","4","1","BK1166","Minter, D. E.; Hinkle, K. W.; Krawiec, M.; Watson, W. H.","4,4-Dibenzyl-1,4-dihydroisoquinoline","Acta Crystallographica Section C","1996","52","5","1236","1238","10.1107/S010827019501599X","","","1.54178","CuKα","","0.0603","0.0603","","0.1022","0.1022","","","","2.26","2.26","2.26","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004838","8.366","0.001","23.193","0.002","6.854","0.001","90","","90","","90","","1329.9","0.3","294.2","","294.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 N2 S2 -","- C13 H20 N2 S2 -","- C52 H80 N8 S8 -","4","1","BK1172","Hussain, Z.; Fleming, F. F.; Norman, R. E.; Chang, S.-C.","(9<i>S</i>,9a<i>R</i>)-1,3,4,6,7,8,9,9a-Octahydro-2<i>H</i>-quinolizine-1-spiro-2'-(1',3'-dithiane)-9-carbonitrile","Acta Crystallographica Section C","1996","52","5","1296","1298","10.1107/S0108270195014016","","","0.7107","MoKα","","","0.0316","","","0.0278","","","","","1.646","1.646","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004839","9.045","0.001","29.148","0.003","8.6766","0.0003","90","","90","","90","","2287.5","0.4","163","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H34 N2 O5 -","- C23 H34 N2 O5 -","- C92 H136 N8 O20 -","4","1","BK1181","Khalil, S.; Hossain, M. B.; van der Helm, D.; Alam, M.; Sanduja, R.","A Pyrazoline Derivative of Eunicin Acetate","Acta Crystallographica Section C","1996","52","5","1272","1274","10.1107/S0108270195016003","","","1.54184","CuKα","","","0.045","","","0.048","","","","","1.5","1.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004840","11.276","0.002","16.599","0.003","7.516","0.002","99.29","0.02","101.75","0.02","98.76","0.01","1334","0.5","296","","296","","","","","","","","","4","P -1","-P 1","2","Pamoic acid . 2pyridine","","","- C33 H26 N2 O6 -","- C33 H26 N2 O6 -","- C66 H52 N4 O12 -","2","1","BK1191","Blackburn, A. C.; Dobson, A. J.; Gerkin, R. E.","Bis(pyridinium) Pamoate","Acta Crystallographica Section C","1996","52","5","1269","1272","10.1107/S0108270195015691","","","0.71073","MoKα","","","0.045","","","0.053","","","","","1.8","1.8","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004841","7.428","0.002","17.376","0.002","7.632","0.002","90","","116.67","0.01","90","","880.3","0.4","296.2","","296","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","copper(II) 4-aminobenzenesulfonate tetrahydrate","","- C12 H20 Cu N2 O10 S2 -","- C12 H20 Cu N2 O10 S2 -","- C24 H40 Cu2 N4 O20 S4 -","2","0.5","BK1192","Gunderman, B. J.; Squattrito, P. J.; Dubey, S. N.","Copper and Manganese Sulfanilate Hydrates","Acta Crystallographica Section C","1996","52","5","1131","1134","10.1107/S0108270195015150","","","0.7107","MoKα","","0.0348","0.025","","0.0288","0.028","","","","","2.46","2.46","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004842","5.91","0.003","7.103","0.003","18.79","0.002","90","","94.77","0.02","90","","786","0.5","296.2","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","manganese(II) 4-aminobenzenesulfonate dihydrate","","- C12 H16 Mn N2 O8 S2 -","- C12 H16 Mn N2 O8 S2 -","- C24 H32 Mn2 N4 O16 S4 -","2","0.5","BK1192","Gunderman, B. J.; Squattrito, P. J.; Dubey, S. N.","Copper and Manganese Sulfanilate Hydrates","Acta Crystallographica Section C","1996","52","5","1131","1134","10.1107/S0108270195015150","","","0.7107","MoKα","","0.052","0.028","","0.0384","0.027","","","","","1.69","1.69","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004843","8.5033","0.0008","8.8856","0.0006","10.773","0.001","101.29","0.01","97.7","0.01","118.42","0.01","677.24","0.14","299","","","","","","","","","","","3","P 1","P 1","1","","azuleno[4,5-b]furan-2(3H)-one, 3a,4,5,7,8,9,9a,9b-octahydro-9-hydroxy- 3,6,9-trimethyl-[3S-(3α,3aα,9α,9aα,9bβ)]","","- C15 H22 O3 -","- C15 H22 O3 -","- C30 H44 O6 -","2","2","BK1193","Castañeda-Acosta, J.; Fischer, N. H.; Fronczek, F. R.","The Guaianolide 11β<i>H</i>,13-Dihydromicheliolide","Acta Crystallographica Section C","1996","52","5","1263","1266","10.1107/S0108270195015435","","","0.71073","Mo-Kα","","","0.04","","","0.048","","","","","2.72","2.72","","","","","has coordinates","208347","2020-10-21","18:00:00",""
"2004844","8.366","0.002","9.43","0.002","9.642","0.002","93.62","0.03","103.22","0.03","91.24","0.03","738.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","tetrahydrogen 1,2-bis(1,4,7-triaza-1-cyclononyl)ethane tetrachlorocad mate'","","- C14 H36 Cd2 Cl8 N6 -","- C14 H36 Cd2 Cl8 N6 -","- C14 H36 Cd2 Cl8 N6 -","1","0.5","BK1194","Zompa, L. J.; Haidar, R.","Tetrahydrogen 1,2-Bis(1,4,7-triaza-1-cyclononyl)ethane Tetrachlorocadmate","Acta Crystallographica Section C","1996","52","5","1188","1190","10.1107/S0108270195015423","","","0.71073","MoKα","","0.0676","0.0487","","0.1425","0.1291","","","","1.084","1.133","1.133","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004845","10.055","0.002","14.974","0.004","17.825","0.005","90","","90","","90","","2683.8","1.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Hippuryl-L-Histidyl-L-Leucine","","- C21 H37 N5 O10 -","- C21 H37 N5 O10 -","- C84 H148 N20 O40 -","4","1","BK1197","Vrielink, A.; Obel-Jorgensen, A.; Codding, P. W.","Hippuryl-<small>L</small>-histidyl-<small>L</small>-leucine, a Substrate for Angiotensin Converting Enzyme","Acta Crystallographica Section C","1996","52","5","1300","1302","10.1107/S0108270195016180","","","0.71069","MoKα","","0.1192","0.0671","","0.1885","0.1521","","","","0.986","0.986","0.986","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004846","12.0939","0.0007","15.464","0.004","16.854","0.002","90","","105.295","0.006","90","","3040.4","0.9","20","","20","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","bis(pentamethylcyclopentadienyl)tetra(μ-iodo)dimolybdenum(III,IV) tetraiodoferrate(III), inclusion complex with bis(pentamethylcyclopentadienyl)di(μ-iodo)(μ-oxo)diiododimolybdenum(IV)","","- C40 H60 Fe I12 Mo4 O -","- C40 H60 Fe I12 Mo4 O -","- C80 H120 Fe2 I24 Mo8 O2 -","2","0.5","BK1202","Gordon, J. C.; Fanwick, P. E.; Poli, R.","[(η^5^-C~5~Me~5~)~2~Mo~2~(μ-I)~4~]^+^[FeI~4~]^{-^}.[(η^5^-C~5~Me~5~)~2~Mo~2~I~2~(μ-I)~2~(μ-O)]","Acta Crystallographica Section C","1996","52","5","1098","1101","10.1107/S0108270195016283","","","0.71073","MoKα","","0.048","0.048","","","0.063","","","","","1.619","1.619","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004847","7.909","0.003","12.608","0.009","15.303","0.011","112.13","0.04","104.58","0.05","91.52","0.04","1355.4","1.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","(1RS,2SR,6SR,7SR,8SR)1-acetoxy-3-oxatricyclo[6.5.0.0^2,7^]tridecan-6,7-diol","","- C14 H22 O5 -","- C14 H22 O5 -","- C56 H88 O20 -","4","2","BM1024","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mercier-Girardot, S.; Caubère, P.","Structural Aspects of the Transposition Reaction of Oxatricyclo[6.5.0.0^2,7^]tridecane-6,7-diol Monomesylate","Acta Crystallographica Section C","1996","52","5","1243","1248","10.1107/S0108270195014417","","","1.54178","CuKα","","0.0714","0.0343","","0.098","0.0845","","","","0.932","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004848","14.815","0.002","14.264","0.002","10.55","0.002","90","","90","","90","","2229.4","0.6","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(1SR,2SR,6RS,7RS) 2-acetoxy-10-oxatricyclo[5.3.1.0^2,6^]undecan-11-one","","- C12 H16 O4 -","- C12 H16 O4 -","- C96 H128 O32 -","8","1","BM1024","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mercier-Girardot, S.; Caubère, P.","Structural Aspects of the Transposition Reaction of Oxatricyclo[6.5.0.0^2,7^]tridecane-6,7-diol Monomesylate","Acta Crystallographica Section C","1996","52","5","1243","1248","10.1107/S0108270195014417","","","1.54178","CuKα","","0.059","0.0493","","0.1309","0.1076","","","","1.123","1.119","1.119","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004849","5.177","0.002","6.41","0.001","11.862","0.002","82.05","0.02","79.38","0.02","76.88","0.02","374.88","0.17","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C8 H12 Cu N6 O12 -","- C8 H12 Cu N6 O12 -","- C8 H12 Cu N6 O12 -","1","0.5","BM1036","Tamaki, K.; Okabe, N.","Redetermination of a Copper(II) Complex of Violuric Acid","Acta Crystallographica Section C","1996","52","5","1125","1127","10.1107/S0108270195015496","","","0.7107","MoKα","","","0.051","","","0.052","","","","","1.53","1.53","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004850","9.33","0.001","9.339","0.001","12.805","0.001","82.51","0.01","77.38","0.01","84.75","0.01","1077.2","0.19","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H18 Cr N3 O4 S3 -","- C18 H18 Cr N3 O4 S3 -","- C36 H36 Cr2 N6 O8 S6 -","2","1","BM1038","Wen, T.-B.; Shi, J.-C.; Liu, Q.-T.; Kang, B.-S.; Wu, B.-M.; Mak, T. C. W.","Tris(2-sulfidopyridine <i>N</i>-oxide-<i>O</i>,<i>S</i>)chromium(III) Acetone Solvate (1/1)","Acta Crystallographica Section C","1996","52","5","1204","1206","10.1107/S0108270195014958","","","0.71073","MoKα","","","0.044","","","0.058","","","","","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004851","8.925","0.005","10.301","0.003","8.179","0.004","94.06","0.03","115.89","0.04","98.45","0.03","661.4","0.6","153","","153","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H11 N O4 S -","- C14 H11 N O4 S -","- C28 H22 N2 O8 S2 -","2","1","BM1042","Brigas, A. F.; Johnstone, R. A. W.","3-(4-Methoxyphenoxy)-1,2-benzisothiazole 1,1-Dioxide: its Relation to Mechanistic Behaviour in Catalytic Transfer Hydrogenolysis","Acta Crystallographica Section C","1996","52","5","1293","1296","10.1107/S0108270195016507","","","0.7107","MoKα","","","0.0358","","","0.0423","","","","","1.609","1.609","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004852","12.709","0.002","12.709","0.002","28.667","0.006","90","","90","","120","","4009.9","1.2","293","2","293","2","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","Tetramethylammonium trithiobenzoatotin(II)","","- C25 H27 N O3 S3 Sn -","- C25 H26.97 N O3 S3 Sn -","- C150 H161.82 N6 O18 S18 Sn6 -","6","0.333333","BM1045","Vittal, J. J.; Dean, P. A. W.","Tetramethylammonium Tris(thiobenzoato-<i>O</i>,<i>S</i>)tin(II)","Acta Crystallographica Section C","1996","52","5","1180","1182","10.1107/S0108270196000583","","","0.71073","MoKα","","0.0266","0.0251","","0.0635","0.0626","","","","1.056","1.07","1.07","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2004853","7.512","0.002","11.599","0.002","12.928","0.003","90","","102.14","0.03","90","","1101.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","none","Catena-[Triamminezinc(II)-tri-μ-cyano-cyano-dicuprate(I)]","","- C4 H9 Cu2 N7 Zn -","- C4 H9 Cu2 N7 Zn -","- C16 H36 Cu8 N28 Zn4 -","4","1","BR1113","Černák, J.; Kappenstein, C.; Zák, Z.; Chomič, J.","Copper‒Zinc Oxide Catalysts. III. Structure of [Zn(NH~3~)~3~][Cu(CN)~2~]~2~","Acta Crystallographica Section C","1996","52","5","1067","1070","10.1107/S0108270195015654","","","0.71073","MoKα","","0.0901","0.0297","","0.0944","0.0785","","","","0.945","1.081","1.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004854","5.034","0.002","13.281","0.002","11.507","0.003","90","","92.04","0.03","90","","768.8","0.4","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Mercury(II) Selenite Hemihydrate","Mercury(II) Selenite - Water (2/1)","","- H2 Hg2 O7 Se2 -","- Hg2 O7 Se2 -","- Hg8 O28 Se8 -","4","1","BR1119","Koskenlinna, M.; Valkonen, J.","Mercury(II) Selenite Hemihydrate","Acta Crystallographica Section C","1996","52","5","1070","1072","10.1107/S0108270195016428","","","0.71073","Mo_Kα","","","0.036","","","0.04","","","","","0.855","0.855","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004855","6.456","0.001","4.969","0.001","14.658","0.002","90","","101.82","0.01","90","","460.26","0.13","294","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","amminemercury(II) selenite","monoamminemercury(II) selenate(IV)","","- H3 Hg N O3 Se -","- Hg N O3 Se -","- Hg4 N4 O12 Se4 -","4","1","BR1136","Koskenlinna, M.; Valkonen, J.; Fröhlich, R.","Amminemercury(II) Selenite","Acta Crystallographica Section C","1996","52","5","1072","1074","10.1107/S0108270195016568","","","0.71073","Mo_Kα","","","0.029","","","0.036","","","","","1.192","1.192","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004856","24.282","0.005","9.544","0.002","7.412","0.0015","90","","106.6","0.03","90","","1646.1","0.6","128","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C7 H15 O3.5 -","- C7 H15 O3.5 -","- C56 H120 O28 -","8","1","CF1021","Murray, R. W.; Singh, M.; Rath, N. P.","Chiral α-Hydroxy Acids: Racemic 2-Hydroxy-2,3,3-trimethylbutanoic Acid and 2-Hydroxy-2-trimethylsilylpropanoic Acid","Acta Crystallographica Section C","1996","52","5","1282","1285","10.1107/S0108270195015769","","","0.71073","MoKα","","0.1571","0.0726","","0.1879","0.1573","","","","0.846","1.086","1.086","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004857","13.141","0.003","13.741","0.003","11.551","0.002","90","","112.36","0.03","90","","1928.9","0.8","298","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H14 O3 Si -","- C6 H14 O3 Si -","- C48 H112 O24 Si8 -","8","2","CF1021","Murray, R. W.; Singh, M.; Rath, N. P.","Chiral α-Hydroxy Acids: Racemic 2-Hydroxy-2,3,3-trimethylbutanoic Acid and 2-Hydroxy-2-trimethylsilylpropanoic Acid","Acta Crystallographica Section C","1996","52","5","1282","1285","10.1107/S0108270195015769","","","0.71073","MoKα","","0.1327","0.0799","","0.3425","0.2416","","","","1.018","1.239","1.239","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004858","13.314","0.005","10.077","0.005","36.51","0.01","90","","94.85","0.03","90","","4881","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Tris(triphenylphosphine)copper(I) chloride, tetrahydrofuran solvate","Chlorotris(triphenylphosphine)copper(I)-Tetrahydrofuran (1/1)","","- C58 H53 Cl Cu O P3 -","- C58 H53 Cl Cu O P3 -","- C232 H212 Cl4 Cu4 O4 P12 -","4","1","CF1023","Carlson, T. F.; Fackler, Jnr, J. P.; Kresinski, R. A.","Chlorotris(triphenylphosphine)copper(I) Tetrahydrofuran Solvate","Acta Crystallographica Section C","1996","52","5","1117","1119","10.1107/S0108270195012819","","","0.71073","MoKα","","0.1214","0.0609","","0.1372","0.1","","","","0.945","1.14","1.14","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2004859","7.402","0.005","13.172","0.006","13.686","0.006","82.9","0.04","77.85","0.04","86.53","0.04","1293.7","1.2","287","2","287","2","","","","","","","","5","P -1","-P 1","2","","calcium bis(9,10-dihydro-9-oxo-10-acridineacetate) dihydrate","","- C30 H24 Ca N2 O8 -","- C30 H24 Ca N2 O8 -","- C60 H48 Ca2 N4 O16 -","2","1","CF1027","Miernik, D.; Lis, T.","Isomorphous Polymeric Complexes of Ca^2+^ and Pb^2+^ with 9,10-Dihydro-9-oxo-10-acridineacetate (CMA^{-^}) Ligands: [<i>M</i>(CMA)~2~(H~2~O)~2~]","Acta Crystallographica Section C","1996","52","5","1171","1174","10.1107/S0108270195015757","","","1.5418","CuKα","","","0.0307","","","0.0847","","","","","1.066","1.066","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004860","7.637","0.005","13.174","0.007","13.749","0.005","82.35","0.04","78","0.04","85.04","0.05","1338.5","1.3","300","2","300","2","","","","","","","","5","P -1","-P 1","2","","lead(II) bis(9,10-dihydro-9-oxo-10-acridineacetate) dihydrate","","- C30 H24 N2 O8 Pb -","- C30 H20 N2 O8 Pb -","- C60 H40 N4 O16 Pb2 -","2","1","CF1027","Miernik, D.; Lis, T.","Isomorphous Polymeric Complexes of Ca^2+^ and Pb^2+^ with 9,10-Dihydro-9-oxo-10-acridineacetate (CMA^{-^}) Ligands: [<i>M</i>(CMA)~2~(H~2~O)~2~]","Acta Crystallographica Section C","1996","52","5","1171","1174","10.1107/S0108270195015757","","","0.71069","MoKα","","","0.0284","","","0.0724","","","","","1.063","1.063","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004861","5.466","0.001","6.128","0.001","39.841","0.009","90","","90","","90","","1334.5","0.4","292","2","292","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Dinaphtho[2,1-b.2',3'-d]furan-8-13-dione","","- C20 H10 O3 -","- C20 H10 O3 -","- C80 H40 O12 -","4","1","CF1045","Farrugia, L. J.; Scott, C. F.; Peacock, R. D.","A Naphthofuranoquinone","Acta Crystallographica Section C","1996","52","5","1310","1311","10.1107/S010827019501660X","","","0.71073","MoKα","","0.076","0.0428","","0.14","0.1016","","","","1.088","1.051","1.051","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004862","4.922","0.0005","7.7525","0.0006","16.3663","0.0011","90","","90","","90","","624.5","0.09","294","1","294","1","","","","","","","","3","P 21 c n","P -2n 2a","33","Furan-2,5-dimethanol","Furan-2,5-dimethanol","","- C6 H8 O3 -","- C6 H8 O3 -","- C24 H32 O12 -","4","1","CF1049","Glidewell, C.; Zakaria, C. M.; Ferguson, G.","Multiple Hydrogen-Bonding Modes in Furan-2,5-dimethanol and Furan-2,5-diylbis(diphenylmethanol)","Acta Crystallographica Section C","1996","52","5","1305","1309","10.1107/S0108270195014521","","","0.7107","MoKα","","0.0445","0.0301","","0.0834","0.0783","","","","1.045","1.113","1.113","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004863","9.1669","0.0012","24.06","0.003","41.768","0.004","90","","90","","90","","9212.2","1.9","294","1","294","1","","","","","","","","3","F 2 d d","F -2d 2","43","furan-2,5-diylbis(diphenylmethanol)","furan-2,5-diylbis(diphenylmethanol)","","- C30 H24 O3 -","- C30 H24 O3 -","- C480 H384 O48 -","16","1","CF1049","Glidewell, C.; Zakaria, C. M.; Ferguson, G.","Multiple Hydrogen-Bonding Modes in Furan-2,5-dimethanol and Furan-2,5-diylbis(diphenylmethanol)","Acta Crystallographica Section C","1996","52","5","1305","1309","10.1107/S0108270195014521","","","0.7107","MoKα","","0.0982","0.0394","","0.0989","0.0874","","","","0.93","1.231","1.231","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004864","9.84","0.007","16.198","0.012","5.69","0.004","90","","90","","90","","906.9","1.1","210","2","210","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","2,6-dichloro-3,5-dimethoxy-2,5-cyclohexadiene-1,4-dione","","- C8 H6 Cl2 O4 -","- C8 H6 Cl2 O4 -","- C32 H24 Cl8 O16 -","4","0.5","CF1054","Mukherjee, S.; Bisht, K. S.; Parmar, V. S.; Errington, W.","3,5-Dichloro-2,6-dimethoxycyclohexa-2,5-diene-1,4-dione","Acta Crystallographica Section C","1996","52","5","1211","1213","10.1107/S0108270195015745","","","0.71073","MoKα","","0.0361","0.0342","","0.0895","0.0875","","","","1.07","1.086","1.086","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004865","14.157","0.009","9.891","0.006","9.312","0.006","90","","106.85","0.05","90","","1247.9","1.4","210","2","210","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[3-(4-chlorophenyl)-5-thiomethyl-4,5-dihydroisoxazol-5-yl]acetonitrile","","- C12 H11 Cl N2 O S -","- C12 H11 Cl N2 O S -","- C48 H44 Cl4 N8 O4 S4 -","4","1","CF1060","Kumar, N.; Vats, A.; Parmar, V. S.; Errington, W.","[3-(4-Chlorophenyl)-5-methylthio-4,5-dihydro-5-isoxazolyl]acetonitrile","Acta Crystallographica Section C","1996","52","5","1239","1241","10.1107/S0108270195016076","","","0.71073","MoKα","","0.0402","0.0304","","0.0897","0.0746","","","","1.041","1.054","1.054","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2004866","11.952","0.002","6.255","0.001","11.708","0.002","90","","90","","90","","875.3","0.3","292","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C7 H5 N5 O3 -","- C7 H5 N5 O3 -","- C28 H20 N20 O12 -","4","0.5","CR1142","Caracelli, I.; Stamato, F. M. L. G.; Mester, B.; Paulino, M.; Cerecetto, H.","A New Analogue of Nifurtimox","Acta Crystallographica Section C","1996","52","5","1281","1282","10.1107/S0108270195015824","","","0.71073","MoKα","","","0.0417","","","0.0449","","","","","1.68","1.68","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004867","10.234","0.004","6.023","0.002","18.478","0.007","90","","94.55","0.02","90","","1135.4","0.7","295","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H16 Cl10 Cu5 O2 -","- C6 H18 Cl10 Cu5 O2 -","- C12 H36 Cl20 Cu10 O4 -","2","0.5","CR1198","Pon, G.; Willett, R. D.","Redetermination of [Cu~5~Cl~10~(<i>n</i>-C~3~H~7~OH)~2~]","Acta Crystallographica Section C","1996","52","5","1122","1123","10.1107/S0108270195012418","","","1.54178","CuKα","","","0.0682","","","0.0874","","","","","1.43","1.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004868","5.76","0.001","11.043","0.002","18.974","0.001","90","","90","","90","","1206.9","0.3","289","2","289","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,5-anhydro-2,3-dideoxy-2-(guanin-9-yl)-D-arabino-hexitol","","- C11 H15 N5 O4 -","- C11 H15 N5 O4 -","- C44 H60 N20 O16 -","4","1","DE1015","Declercq, R.; Herdewijn, P.; Van Meervelt, L.","1,5-Anhydro-2,3-dideoxy-2-(guanin-9-yl)-<small>D</small>-<i>arabino</i>-hexitol","Acta Crystallographica Section C","1996","52","5","1213","1215","10.1107/S0108270195015101","","","1.54178","CuKα","","0.0366","0.0359","","0.0968","0.0961","","","","1.086","1.096","1.096","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004869","10.1856","0.0001","10.8535","0.0001","23.1658","0.0002","90","","94.77","0.01","90","","2552.1","0.06","300","1","300","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Phenyl) (pyrrolidino) (dicyclohexylamino) phosphiniminocyclotrithiazene","","- C22 H35 N6 P S3 -","- C22 H35 N6 P S3 -","- C88 H140 N24 P4 S12 -","4","1","DE1019","Janaswamy, S.; Sreenivasa Murthy, G.; Mohan, T.; Sudheendra Rao, M. N.","<i>S</i>-[(Dicyclohexylamino)(phenyl)(1-pyrrolidinyl)phosphinimino]cyclotrithiazene","Acta Crystallographica Section C","1996","52","5","1250","1252","10.1107/S0108270195015381","","","0.71069","MoKα","","0.0551","0.0551","","0.147","0.147","","","","1.093","1.093","1.093","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004870","25.234","0.003","5.017","0.004","12.588","0.005","90","","108.83","0.02","90","","1508.3","1.4","296","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C4 H6 Co0.5 N3 O6 -","- C4 H6 Co0.5 N3 O6 -","- C32 H48 Co4 N24 O48 -","8","1","DE1024","Tamaki, K.; Okabe, N.","Diaquabis(5-isonitrosobarbiturato)cobalt(II) Dihydrate","Acta Crystallographica Section C","1996","52","5","1124","1125","10.1107/S0108270195015903","","","0.71069","MoKα","","","0.046","","","0.05","","","","","1.5","1.5","","","","","has coordinates","198476","2020-10-21","18:00:00",""
"2004871","10.197","0.002","9.086","0.002","17.807","0.005","90","","90","","90","","1649.8","0.7","291","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 B N2 P -","- C17 H22 B N2 P -","- C68 H88 B4 N8 P4 -","4","1","DU1093","Brunel, J. M.; Buono, G.; Baldy, A.; Feneau-Dupont, J.; Declercq, J.-P.","(2<i>R</i>,5<i>S</i>)-2,3-Diphenyl-1,3,2-diazaphosphabicyclo[3.3.0]octane‒Borane","Acta Crystallographica Section C","1996","52","5","1316","1317","10.1107/S0108270195013631","","","1.5418","CuKα","","","0.05","","","0.061","","","","","0.47","0.47","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004872","15.32","0.003","7.915","0.001","8.763","0.001","90","","90","","93.5","0.1","1060.6","0.3","293","2","293","2","","","","","","","","5","P 1 1 21/b","-P 2bc","14","","m-Anisidinium Dihydrogenmonoarsenate","","- C7 H12 As N O5 -","- C7 H12 As N O5 -","- C28 H48 As4 N4 O20 -","4","1","DU1130","Abdellahi, M. O.; Jouini, T.","<i>m</i>-Anisidinium Dihydrogenmonoarsenate","Acta Crystallographica Section C","1996","52","5","1198","1200","10.1107/S0108270195012947","","","0.712","MoKα","","0.0707","0.0507","","0.1525","0.1359","","","","1.304","1.331","1.331","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004873","8.786","0.002","9.382","0.002","12.703","0.003","94.89","0.02","103.18","0.02","93.4","0.02","1012.5","0.4","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 N4 O S -","- C22 H22 N4 O S -","- C44 H44 N8 O2 S2 -","2","1","DU1140","Toledano, P.; Ait Itto, M. Y.; Hasnaoui, A.","3-Mésityl-6-méthyl-7-méthylthio-4-phényl-6<i>H</i>-isoxazolo[5,4-<i>e</i>][1,2,4]triazépine","Acta Crystallographica Section C","1996","52","5","1230","1232","10.1107/S0108270195012741","","","0.71069","MoKα","","","0.0558","","","0.0568","","","","","4.47","4.47","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004874","11.095","0.003","10.098","0.003","11.607","0.004","90","","91.34","0.03","90","","1300.1","0.7","295","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H11 B F4 Fe O3 -","- C10 H11 B F4 Fe O3 -","- C40 H44 B4 F16 Fe4 O12 -","4","1","FG1014","Rheingold, A. L.; Haggerty, B. S.; Ma, H.; Ernst, R. D.","Tricarbonyl(η^5^-2,4-dimethylpentadienyl)iron Tetrafluoroborate","Acta Crystallographica Section C","1996","52","5","1110","1112","10.1107/S010827019501465X","","","0.71073","MoKα","","","0.0742","","","0.0773","","","","","1.6","1.6","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004875","9.474","0.001","9.529","0.002","12.16","0.002","99.98","0.01","97.16","0.01","115.92","0.01","947.2","0.3","296","","","","","","","","","","","4","P -1","-P 1","2","","","","- C22.5 H22.5 Ga N1.5 -","- C22.5 H23 Ga N1.5 -","- C45 H46 Ga2 N3 -","2","1","FG1063","Sun, H.-S.; Wang, X.-M.; Sun, X.-Z.; You, X.-Z.; Wang, J.-Z.","(Acridine)trimethylgallium‒Acridine (2/1)","Acta Crystallographica Section C","1996","52","5","1184","1186","10.1107/S0108270195014661","","","0.71073","MoKα","","","0.0385","","","0.0393","","","","","1.534","1.534","","","","","has coordinates","176342","2020-10-21","18:00:00",""
"2004876","13.131","0.003","7.541","0.001","14.758","0.003","90","","96.03","0.02","90","","1453.3","0.5","170","","170","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 S5 -","- C12 H14 S5 -","- C48 H56 S20 -","4","1","FG1108","Parvez, M.; Mesher, S. T. E.; Clark, P. D.","2,3,6,7-Tetrakis(methylthio)benzo[<i>b</i>]thiophene","Acta Crystallographica Section C","1996","52","5","1248","1250","10.1107/S0108270195015630","","","0.71069","MoKα","","","0.0638","","","0.0641","","","","","2.838","2.838","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004877","17.892","0.001","11.115","0.003","18.279","0.001","90","","114.431","0.004","90","","3309.6","0.9","294","","294","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","mer-Dihydrido(iodo){bis[dimethyl(diphenylphosphino\-methyl)silyl]\- amine}\-iridium(III)","","- C30 H39 I Ir N P2 Si2 -","- C30 H39 I Ir N P2 Si2 -","- C120 H156 I4 Ir4 N4 P8 Si8 -","4","1","FG1124","Fryzuk, M. D.; MacNeil, P. A.; Rettig, S. J.; Stephan, M.","<i>mer</i>-{Bis[dimethyl(diphenylphosphinomethyl)silyl]amine-<i>N</i>,<i>P</i>,<i>P</i>'}dihydrido(iodo)iridium(III)","Acta Crystallographica Section C","1996","52","5","1115","1117","10.1107/S0108270195016544","","","0.7107","MoKα","","","0.027","","","0.022","","","","","1.32","1.32","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004878","9.809","0.004","10.011","0.004","21.975","0.008","91.77","0.01","91.62","0.01","113.03","0.02","1983.1","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[Bis(benzimidazol-2ylethyl)sulfide] Nickel(II)nitrate","","","- C36 H36 N10 Ni O6 S2 -","- C36 H36 N10 Ni O6 S2 -","- C72 H72 N20 Ni2 O12 S4 -","2","1","FG1136","Pandiyan, T.; Panneerselvam, K.; Soriano-García, M.; Durán de Bazúa, C.; Holt, E. M.","Bis[bis(2-benzimidazol-2-ylethyl) sulfide]nickel(II) Dinitrate","Acta Crystallographica Section C","1996","52","5","1137","1139","10.1107/S0108270195016398","","","0.71073","MoKα","","0.0829","0.0533","","0.1364","0.1181","","","","1.073","1.156","1.156","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004879","9.1293","0.0007","7.2499","0.0006","10.0753","0.0008","90","","100.793","0.006","90","","655.05","0.09","296","","296","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","Octahydrochrysene","1,2,3,4,7,8,9,10-octahydrochrysene","","- C18 H20 -","- C18 H20 -","- C36 H40 -","2","0.5","FG1138","Burd, C. J.; Dobson, A. J.; Gerkin, R. E.","Redetermination of Octahydrochrysene","Acta Crystallographica Section C","1996","52","5","1241","1243","10.1107/S0108270195015460","","","0.71073","MoKα","","","0.045","","","0.053","","","","","1.76","1.76","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004880","8.539","0.002","5.229","0.006","10.268","0.003","90","","97.2","0.02","90","","454.9","0.5","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","1-(2-deoxy-α-D-erythro-pentopyranosyl) 1-(R),2-(R),4-triazolidine-3,5-dione","","- C7 H11 N3 O5 -","- C7 H11 N3 O5 -","- C14 H22 N6 O10 -","2","1","FG1140","Robinson, P. D.; Meyers, C. Y.; Kolb, V. M.; Colloton, P. A.","First Example of a Crystalline Urazole Nucleoside: (1<i>R</i>,2<i>R</i>)-Urazole-α-<small>D</small>-pyranosyl-2-deoxyriboside","Acta Crystallographica Section C","1996","52","5","1215","1218","10.1107/S0108270195015873","","","0.71069","MoKα","","","0.027","","","0.029","","","","","1.23","1.23","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004881","15.822","0.004","12.66","0.004","16.657","0.002","90","","91.7","0.02","90","","3335","1.4","294.2","","294.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H46 Mo2 N2 O4 -","- C34 H46 Mo2 N2 O4 -","- C136 H184 Mo8 N8 O16 -","4","1","FG1147","Legzdins, P.; Lundmark, P. J.; Rettig, S. J.","Bis-μ-hydroxo-bis[(benzyl)(nitrosyl-<i>N</i>)(η^5^-pentamethylcyclopentadienyl)molybdenum]","Acta Crystallographica Section C","1996","52","5","1113","1115","10.1107/S0108270196001096","","","0.7107","MoKα","","","0.04","","","0.0399","","","","","2.01","2.01","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004882","8.444","0.002","5.015","0.002","12.5573","0.0009","90","","100.345","0.009","90","","523.1","0.2","290","","290","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C4 H4 N4 -","- C4 H4 N4 -","- C16 H16 N16 -","4","1","HA1153","Frampton, C. S.","1,1-Diamino-2,2-dicyanoethene","Acta Crystallographica Section C","1996","52","5","1218","1220","10.1107/S0108270195015721","","","0.7107","MoKα","","0.0474","0.032","","0.0403","0.039","","","","","2.59","2.59","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004883","12.049","0.003","17.018","0.003","17.071","0.003","90","","90","","90","","3500.4","1.2","293","","","","","","","","","","","6","P c a b","-P 2bc 2ac","61","","","","- C10 H31 Br2 Cr N4 O3 -","- C10 H30 Br2 Cr N4 O3 -","- C80 H240 Br16 Cr8 N32 O24 -","8","1","HU1105","Palmer, R. A.; Potter, B. S.; Tanriverdi, S.; Lisgarten, J. N.; Flint, C. D.; Gazi, D. M.","Structures of Chromium(III) Cyclam Complexes. 6. <i>trans</i>-Aquahydroxy(1,4,8,11-tetraazacyclotetradecane)chromium(III) Dibromide Hydrate","Acta Crystallographica Section C","1996","52","5","1177","1180","10.1107/S0108270195012996","","","1.54178","CuKα","","","0.0629","","","0.1485","","","","","1.063","1.063","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004884","10.38719","0.00008","6.03925","0.00002","15.29563","0.00007","90","","102.825","0.0004","90","","935.572","0.009","4","","","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","Trirubidiumhydrogendiselenide","","- H O8 Rb3 Se2 -","- H2 O8 Rb3 Se2 -","- H8 O32 Rb12 Se8 -","4","0.5","JZ1057","Melzer, R.; Sonntag, R.; Knight, K. S.","Rb~3~H(SeO~4~)~2~ at 4K by Neutron Powder Diffraction","Acta Crystallographica Section C","1996","52","5","1061","1063","10.1107/S0108270195011085","","","","","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004885","9.69","0.003","21.62","0.004","12.835","0.003","90","","106.26","0.03","90","","2581.4","1.2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,3,5-Trideoxy-1,3,5-tris(trimethylammonio)-cis-inositol triiodide sesquihydrate","","- C15 H39 I3 N3 O4.5 -","- C15 H37 I3 N3 O4.5 -","- C60 H148 I12 N12 O18 -","4","1","JZ1076","Schmalle, H. W.; Hegetschweiler, K.","Hydrogen Bonding <i>versus</i> van der Waals Repulsion in 1,3,5-Trideoxy-1,3,5-tris(trimethylammonio)-<i>cis</i>-inositol Triiodide Sesquihydrate, C~15~H~36~N~3~O~3~^3+^.3I^{-^}.1.5H~2~O","Acta Crystallographica Section C","1996","52","5","1288","1293","10.1107/S0108270195013497","","","0.71073","MoKα","","0.0868","0.0472","","0.1637","0.115","","","","1.285","1.149","1.149","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004886","10.719","0.007","14.198","0.005","9.773","0.003","90.05","0.03","96.31","0.04","89.32","0.04","1478.2","1.2","","","","","","","","","","","","8","P -1","-P 1","2","","[{1,1'-bis(methylphenylphosphino)ferrocene}(pentane-2,4-dionato)palladium] tetrafluoroborate","","- C29 H31 B F4 Fe O2 P2 Pd -","- C29 H31 B F4 Fe O2 P2 Pd -","- C58 H62 B2 F8 Fe2 O4 P4 Pd2 -","2","1","JZ1104","Herberich, G. E.; Moss, S.; Schultz, A.","[1,1'-Bis(methylphenylphosphino)ferrocene-<i>P</i>,<i>P</i>'](pentane-2,4-dionato-<i>O</i>,<i>O</i>')palladium Tetrafluoroborate","Acta Crystallographica Section C","1996","52","5","1080","1082","10.1107/S0108270195016775","","","0.71073","MoKα","","","0.04","","","0.049","","","","","1.366","1.366","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2004887","37.086","0.009","16.045","0.005","12.128","0.005","90","","101.425","0.015","90","","7074","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(1,10-phenanthroline)ruthenium(II) dihexafluorophosphate","","- C36 H24 F12 N6 P2 Ru -","- C36 H24 F12 N6 P2 Ru -","- C288 H192 F96 N48 P16 Ru8 -","8","1","JZ1107","Breu, J.; Stoll, A. J.","Tris(1,10-phenanthroline)ruthenium(II) Bis(hexafluorophosphate)","Acta Crystallographica Section C","1996","52","5","1174","1177","10.1107/S0108270195017057","","","0.71069","MoKα","","0.0715","0.0435","","0.1142","0.1039","","","","0.914","1.034","1.034","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004888","13.103","0.004","7.734","0.001","13.392","0.004","90","","119.09","0.01","90","","1185.9","0.5","198","2","198","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[tert-Butyl(methyl)ether-O]-lithium phenylmethanide","","- C12 H19 Li O -","- C12 H19 Li O -","- C48 H76 Li4 O4 -","4","1","JZ1111","Müller, G.; Lutz, M.; Waldkircher, M.","Benzyllithium <i>tert</i>-Butyl Methyl Etherate","Acta Crystallographica Section C","1996","52","5","1182","1184","10.1107/S0108270196000923","","","0.71069","MoKα","","0.1607","0.0526","","0.1379","0.1058","","","","1.006","1.128","1.128","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004889","20.756","0.001","6.16","0.001","21.475","0.001","90","","97.32","0.01","90","","2723.4","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H28 N2 Ni O2 -","- C36 H28 N2 Ni O2 -","- C144 H112 N8 Ni4 O8 -","4","0.5","KA1135","Elerman, Y.; Kabak, M.; Tahir, M. N.","Bis(<i>N</i>-benzyl-2-hydroxy-1-naphthaldiminato)nickel(II)","Acta Crystallographica Section C","1996","52","5","1154","1156","10.1107/S0108270195016015","","","0.71073","MoKα","","0.123","0.045","","0.211","0.075","","","","2.42","1.18","1.18","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004890","15.187","0.005","12.883","0.003","11.468","0.003","90","","90","","90","","2243.8","1.1","293","","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","4,5-ethylenedioxy-1,3-dimethyl-dihydrouric acid","cis-4,5-ethylenedioxy-1,3-dimethyltetrahydropurine-2,6,8-trione","","- C9 H12 N4 O5 -","- C9 H12 N4 O5 -","- C72 H96 N32 O40 -","8","2","KA1144","Poje, N.; Poje, M.; Vickovic, I.","<i>cis</i>-Perhydro-1,3-dimethyl-4,5-(epoxyethanoxy)purine-2,6,8-trione","Acta Crystallographica Section C","1996","52","5","1311","1313","10.1107/S0108270195011322","","","1.54178","CuKα","","0.0465","0.0426","","0.0725","0.0711","","","","0.982","1.013","1.013","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004891","12.461","0.006","6.454","0.004","13.621","0.005","90","","107.57","0.01","90","","1044.3","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-hydroxyantipyrine","","- C11 H12 N2 O2 -","- C11 H12 N2 O2 -","- C44 H48 N8 O8 -","4","1","KA1148","Panneerselvam, K.; Jayanthi, N.; Rudiño-Piñera, E.; Soriano-García, M.","4-Hydroxyantipyrine","Acta Crystallographica Section C","1996","52","5","1257","1258","10.1107/S0108270195015459","","","1.54178","CuKα","","0.0506","0.047","","0.1226","0.1177","","","","1.073","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004892","14.819","0.001","10.765","0.001","20.673","0.002","90","","92.28","","90","","3295.3","0.5","158","2","158","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Hexakis(N,N-dimethylformamide)-nickel(II) Diperchlorate","","- C18 H42 Cl2 N6 Ni O14 -","- C18 H42 Cl2 N6 Ni O14 -","- C72 H168 Cl8 N24 Ni4 O56 -","4","1","KA1163","McKee, V.; Metcalfe, T.; Wikaira, J.","Hexakis(<i>N</i>,<i>N</i>-dimethylformamide)nickel(II) Diperchlorate","Acta Crystallographica Section C","1996","52","5","1139","1141","10.1107/S010827019501523X","","","0.71073","MoKα","","0.0588","0.0407","","0.1109","0.0931","","","","1.035","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004893","13.926","0.002","32.8","0.004","6.283","0.004","90","","90","","90","","2869.9","1.9","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H48 O5 -","- C30 H48 O5 -","- C120 H192 O20 -","4","1","KA1164","Böcskei, Z.; Szendi, Z.; Sweet, F.","A Side-Chain Substituted Cholesterol Analog","Acta Crystallographica Section C","1996","52","5","1302","1304","10.1107/S0108270195016295","","","1.5418","CuKα","","0.2176","0.0705","","0.3207","0.1907","","","","1.051","1.2","1.2","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004894","21.64","0.002","7.866","0.001","6.72","0.01","90","0.01","96.16","0.01","90","0.009","1137.3","1.7","293","","293","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","ethyl p-methoxycinnamate","","","- C12 H14 O3 -","- C12 H14 O3 -","- C48 H56 O12 -","4","1","KA1167","Luger, P.; Weber, M.; Dung, N. X.; Tuyet, N. T. B.","Ethyl <i>p</i>-Methoxycinnamate from <i>Kaempferia galanga L</i>. in Vietnam","Acta Crystallographica Section C","1996","52","5","1255","1257","10.1107/S0108270195016027","","","1.5418","CuKαradiation,Nifiltered","","0.053","0.039","","0.044","0.034","","","","0.497","0.418","0.418","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004895","20.054","0.004","13.005","0.003","9.611","0.002","90","","90","","90","","2506.6","0.9","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","bis[(benzoato-O,O')bis(nicotinamide-N)]copper(II)","","- C26 H22 Cu N4 O6 -","- C26 H22 Cu N4 O6 -","- C104 H88 Cu4 N16 O24 -","4","0.5","KA1172","Leban, I.; Segedin, P.; Gruber, K.","Bis(benzoato-<i>O</i>,<i>O</i>')bis(nicotinamide-<i>N</i>)copper(II)","Acta Crystallographica Section C","1996","52","5","1096","1098","10.1107/S0108270195017240","","","0.71073","MoKα","","0.1098","0.0531","","0.1785","0.1224","","","","1.074","1.063","1.063","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2004896","12.464","0.003","14.934","0.003","17.46","0.003","90","","90","","90","","3250","1.2","293","","293","","","","","","","","","7","C 2 2 21","C 2c 2","20","","bis[bis(4-methylthiazolinylidene)gold(I)] tetrachlorozincate dichloromethane","","- C8.5 H11 Au Cl3 N2 S2 Zn0.5 -","- C10 H8 Au Cl2 N2 S2 Zn0.5 -","- C80 H64 Au8 Cl16 N16 S16 Zn4 -","8","1","KH1025","Kruger, G. J.; Olivier, P. J.; Otte, R.; Raubenheimer, H. G.","Bis[bis(4-methylthiazolin-2-ylidene)gold(I)] Tetrachlorozincate Dichloromethane","Acta Crystallographica Section C","1996","52","5","1159","1161","10.1107/S0108270195015514","","","0.7093","MoKα","","0.078","0.05","","0.055","0.054","","","","3.587","4.045","4.045","","","","","has coordinates","188742","2020-10-21","18:00:00",""
"2004897","9.46","0.002","19.572","0.004","20.017","0.006","90","","92.58","0.02","90","","3702.4","1.6","300","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H34 Ag Cl N2 P2 S2 -","- C38 H34 Ag Cl N2 P2 S2 -","- C152 H136 Ag4 Cl4 N8 P8 S8 -","4","1","KH1051","Long, D.-L.; Xin, X.-Q.; Huang, X.-Y.; Kang, B.-S.","Chloro(ethanedithioamide-<i>S</i>)bis(triphenylphosphine)silver(I)","Acta Crystallographica Section C","1996","52","5","1161","1163","10.1107/S0108270195013813","","","0.71073","MoKα","","","0.037","","","0.049","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004898","8.215","0.001","17.387","0.002","10.042","0.001","90","","101.92","0.01","90","","1403.4","0.3","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 Li N2 O4 -","- C12 H19 Li N2 O4 -","- C48 H76 Li4 N8 O16 -","4","1","KH1058","Näther, C.; John, A.; Ruppert, K.; Bock, H.","Bis(<i>N</i>,<i>N</i>-dimethylformamide)(pyrocatecholato-<i>O</i>,<i>O</i>')lithium","Acta Crystallographica Section C","1996","52","5","1166","1168","10.1107/S010827019501571X","","","0.71073","MoKα","","0.101","0.0453","","0.0894","0.0788","","","","0.974","1.136","1.136","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004899","9.358","0.001","13.408","0.001","13.755","0.001","90","","90","","90","","1725.9","0.3","298","3","","","","","","","","","","5","P m c n","-P 2n -21","","","","","- C12 H24 Cu N6 S2 -","- C6.5 H12 Cu0.5 N3.5 S1.5 -","- C26 H48 Cu2 N14 S6 -","4","0.5","KH1068","Lu, T.-H.; Tahirov, T. H.; Liu, Y.-L.; Chung, C.-S.; Huang, C.-C.; Hong, Y.-S.","(Isothiocyanato)[(1<i>RS</i>,4<i>RS</i>,8<i>SR</i>,11<i>SR</i>)-1,4,8,11-tetraazacyclotetradecane]copper(II) Thiocyanate, [Cu(NCS)(cyclam)](SCN)","Acta Crystallographica Section C","1996","52","5","1093","1095","10.1107/S0108270195016519","","","0.71073","MoKα","","","0.041","","","0.048","","","","","1.53","1.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004900","6.374","0.001","9.917","0.002","26.743","0.003","90","","90","","90","","1690.5","0.5","293","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C7 H12 O5 -","- C7 H12 O5 -","- C56 H96 O40 -","8","1","LI1141","Zukerman-Schpector, J.; Caracelli, I.; Varanda, N. A.; Brockson, U.","Synthesis and Relative Configuration of (±)-(1α,2β,3β,4α)-1,2,3,4-Cyclopentanetetrol 1-Acetate","Acta Crystallographica Section C","1996","52","5","1298","1299","10.1107/S0108270195015812","","","0.71073","MoKα","","0.0711","0.0472","","0.3476","0.1185","","","","1.082","1.068","1.068","","","","","has coordinates","190596","2020-10-21","18:00:00",""
"2004901","25.99","0.002","7.078","0.001","13.203","0.001","90","","103.82","0.05","90","","2358.5","0.7","296","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis-(N-4-chlorobenzilydene 2-mercaptoaniline)nickel(II)","","- C26 H18 Cl2 N2 Ni S2 -","- C26 H18 Cl2 N2 Ni S2 -","- C104 H72 Cl8 N8 Ni4 S8 -","4","0.5","MU1204","Ercan, F.; Ülkü, D.; Ancin, N.; Oztas, S. G.; Tüzün, M.","Bis[<i>N</i>-(4-chlorobenzylidene)-2-mercaptoanilinato]nickel(II)","Acta Crystallographica Section C","1996","52","5","1141","1143","10.1107/S0108270195014594","","","0.71073","MoKα","","","0.047","","","0.05","","","","","0.73","0.73","","","","","has coordinates","198476","2020-10-21","18:00:00",""
"2004902","14.644","0.006","15.644","0.004","23.085","0.004","90","","90","","90","","5289","3","296","","","","","","","","","","","6","C c c a :2","-C 2a 2ac","68","","","","- C24 H24 N2 Ni O2 S4 -","- C24 H24 N2 Ni O2 S4 -","- C192 H192 N16 Ni8 O16 S32 -","8","0.5","MU1212","Xiong, R.-G.; Zuo, J.-L.; You, X.-Z.; Huang, X.-Y.","<i>trans</i>-Bis(<i>O</i>-ethyl dithiocarbonato-<i>S</i>,<i>S</i>')bis(isoquinoline)nickel(II)","Acta Crystallographica Section C","1996","52","5","1157","1159","10.1107/S0108270195014727","","","0.71073","MoKα","","","0.056","","","0.068","","","","","1.69","1.69","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004903","13.012","0.002","14.133","0.002","11.856","0.002","92.96","0.01","112.946","0.009","77.55","0.01","1959.3","0.5","293.2","","293.2","","","","","","","","","7","P -1","-P 1","2","","","","- C8 H42 Co2 Mo6 N2 O37 P4 -","- C8 H24 Co2 Mo6 N2 O37 P4 -","- C16 H48 Co4 Mo12 N4 O74 P8 -","2","1","MU1218","Lightfoot, P.; Masson, D.","[N(CH~3~)~4~]~2~[Co~2~Mo~6~O~12~(OH)~4~(PO~4~)(HPO~4~)~2~(H~2~PO~4~)].5H~2~O, a New One-Dimensional Molybdenum Phosphate","Acta Crystallographica Section C","1996","52","5","1077","1080","10.1107/S0108270195015551","","","0.71073","MoKα","","","0.041","","","0.057","","","","","4.91","4.91","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004904","8.601","0.001","8.768","0.001","15.008","0.002","89.32","0.01","83.97","0.01","81.22","0.01","1112.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(S-methyl-β-N-(4-methoxyphenyl)methylendithiocarbazide) nickel(II).","","- C20 H22 N4 Ni O2 S4 -","- C20 H22 N4 Ni O2 S4 -","- C40 H44 N8 Ni2 O4 S8 -","2","1","MU1220","Fun, H.-K.; Sivakumar, K.; Tian, Y.-P.; Duan, C.-Y.; Lu, Z.-L.; You, X.-Z.","Bis[methyl <i>N</i>^{β^}-(4-methoxyphenylmethylene)dithiocarbazato]nickel(II)","Acta Crystallographica Section C","1996","52","5","1143","1145","10.1107/S0108270195015290","","","0.71073","MoKα","","0.0367","0.0328","","0.0942","0.0914","","","","1.063","1.109","1.109","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004905","8.534","0.001","8.765","0.001","9.975","0.001","87.56","0.01","64.89","0.01","72.26","0.01","640.23","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(1-methyl-4-methylpyridinium) bis(maleonitriledithiolate) nickel(II).","","- C22 H20 N6 Ni S4 -","- C22 H20 N6 Ni S4 -","- C22 H20 N6 Ni S4 -","1","0.5","MU1222","Shan, B.-Z.; Zhang, X.-M.; You, X.-Z.; Fun, H.-K.; Sivakumar, K.","Bis(1,4-dimethylpyridinium) Bis(maleonitriledithiolato)nickelate(II)","Acta Crystallographica Section C","1996","52","5","1148","1150","10.1107/S0108270195014429","","","0.71073","MoKα","","0.0347","0.0327","","0.0984","0.0971","","","","1.077","1.112","1.112","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004906","27.858","0.005","8.094","0.002","9.951","0.002","90","","90","","90","","2243.8","0.8","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1-Morpholinyl-3-phenylthiourea.","","- C11 H14 N2 O S -","- C11 H14 N2 O S -","- C88 H112 N16 O8 S8 -","8","2","MU1225","Ramnathan, A.; Sivakumar, K.; Srinivasan, N.; Janarthanan, N.; Ramadas, K.; Fun, H.-K.","<i>N</i>-Phenyl-4-morpholinecarbothioamide and <i>N</i>-(2-Tolyl)-4-morpholinecarbothioamide","Acta Crystallographica Section C","1996","52","5","1285","1288","10.1107/S0108270195015010","","","0.71073","MoKα","","0.063","0.047","","0.1401","0.1309","","","","1.065","1.173","1.173","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004907","40.201","0.005","7.59","0.001","7.829","0.001","90","","90","","90","","2388.8","0.5","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","1-Morpholinyl-3-tolylthiourea.","","- C12 H16 N2 O S -","- C12 H16 N2 O S -","- C96 H128 N16 O8 S8 -","8","1","MU1225","Ramnathan, A.; Sivakumar, K.; Srinivasan, N.; Janarthanan, N.; Ramadas, K.; Fun, H.-K.","<i>N</i>-Phenyl-4-morpholinecarbothioamide and <i>N</i>-(2-Tolyl)-4-morpholinecarbothioamide","Acta Crystallographica Section C","1996","52","5","1285","1288","10.1107/S0108270195015010","","","0.71073","MoKα","","0.094","0.0507","","0.305","0.1396","","","","0.966","1.036","1.036","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004908","13.3698","0.0002","8.5803","0.0001","16.5573","0.0001","90","","109.459","0.001","90","","1790.91","0.04","153","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2-methyl-8-quinolinolato) Molybdenum","","- C20 H16 Mo N2 O4 -","- C20 H16 Mo N2 O4 -","- C80 H64 Mo4 N8 O16 -","4","1","MU1231","Fun, H.-K.; Sivakumar, K.; Niu, J.-Y.; Wang, J.-P.; You, X.-Z.","<i>cis</i>-Bis(2-methyl-8-quinolinolato-<i>N</i>,<i>O</i>)dioxomolybdenum(VI)","Acta Crystallographica Section C","1996","52","5","1150","1152","10.1107/S0108270195016933","","","0.71073","MoKα","","0.0238","0.0229","","0.0556","0.0552","","","","1.143","1.144","1.144","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004909","7.438","0.001","15.332","0.002","17.722","0.003","103.36","0.01","92.14","0.01","101.7","0.01","1917.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis-4-{(p-dimethylamino)styryl}pyridinium bis(maleonitriledithiolate) nickelate(II).","","- C40 H38 N8 Ni S4 -","- C40 H38 N8 Ni S4 -","- C80 H76 N16 Ni2 S8 -","2","1","MU1233","Fun, H.-K.; Sivakumar, K.; Shan, B.-Z.; You, X.-Z.","Bis[4-(4-dimethylaminostyryl)-<i>N</i>-methylpyridinium] Bis[maleonitriledithiolato(2‒)-<i>S</i>,<i>S</i>']nickelate(II)","Acta Crystallographica Section C","1996","52","5","1152","1154","10.1107/S0108270195016921","","","0.71073","MoKα","","0.0566","0.0368","","0.1059","0.0975","","","","0.934","1.049","1.049","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004910","9.431","0.002","11.27","0.002","15.781","0.003","90","","91.13","0.03","90","","1677","0.6","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Dichlorophenyl imino Zirconium dimer THF adduct","Zr,Zr,Zr',Zr'-TetrachloroDi(μ-Phenyl-imino)Zr,Zr,Zr',Zr'- Tetrakis(Tetrahydrofurane)DiZirconium(IV)","","- C28 H42 Cl4 N2 O4 Zr2 -","- C28 H42 Cl4 N2 O4 Zr2 -","- C56 H84 Cl8 N4 O8 Zr4 -","2","0.5","MU1234","Polamo, M.; Mutikainen, I.; Leskelä, M.","A 1:4 Adduct of Tetrachlorobis(μ-phenylimido)dizirconium(IV) and Tetrahydrofuran","Acta Crystallographica Section C","1996","52","5","1082","1084","10.1107/S0108270195016891","","","0.71069","MoKα","","0.0408","0.0362","","0.0896","0.0871","","","","1.037","1.064","1.064","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004911","11.755","0.008","14.521","0.003","15.884","0.005","89.333","0.001","77.715","0.001","67.027","0.001","2431.4","1.9","298","","","","","","","","","","","6","P -1","-P 1","2","","Bis(Tetraphenylphosphonium)Tetrachloro-dioxouranium(VI).dichloromethane","","- C49 H42 Cl6 O2 P2 U -","- C49 H42 Cl6 O2 P2 U -","- C98 H84 Cl12 O4 P4 U2 -","2","1","MU1235","Brown, D. R.; Chippindale, A. M.; Denning, R. G.","Bis(tetraphenylphosphonium) Tetrachlorodioxouranate(VI) Dichloromethane Solvate","Acta Crystallographica Section C","1996","52","5","1164","1166","10.1107/S0108270195016908","","","0.71069","MoKα","","","0.0461","","","0.0491","","","","","1.0864","1.0864","","","","","has coordinates","189213","2020-10-21","18:00:00",""
"2004912","8.131","0.003","10.052","0.004","18.473","0.004","100.75","0.04","101.52","0.04","99.03","0.04","1423.6","0.9","297","2","295","2","","","","","","","","5","P -1","-P 1","2","","(3,8,12,17-Me~4~-(9,10,11)(18,1,2)pyo~2~-[18]-3,7,12,16-tetraene- 1,4,7,10,13,16-N~6~)tris(isothiocyanato-N)europium tris(isocyanato-N)(2,7,13,18-tertamethyl-3,6,14,17,23,24-hexaazatricyclo [17.3.1.1^8,12^]tetracosa-1(23),8(24),9,11,19,21-hexaene-N^3^,N^6^,N^14^, N^17^,N^23^,N^24^)europium","","- C25 H26 Eu N9 S3 -","- C25 H26 Eu N9 S3 -","- C50 H52 Eu2 N18 S6 -","2","1","NA1202","Benetollo, F.; Bombieri, G.; Vallarino, L. M.","The β Form of the Macrocyclic Complex [Eu(NCS)~3~(C~22~H~26~N~6~)]","Acta Crystallographica Section C","1996","52","5","1190","1193","10.1107/S0108270195015484","","","0.71069","MoKα","","0.0293","0.0276","","0.0731","0.0696","","","","1.103","1.103","1.103","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004913","10.6262","0.001","18.101","0.002","14.1962","0.0014","90","","107.376","0.008","90","","2606","0.5","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Tricarbonyl(cyclopentadienyl)(selenotriphenylphosphonium)tungsten(I) Perchlorate","","- C26 H20 Cl O7 P Se W -","- C26 H20 Cl O7 P Se W -","- C104 H80 Cl4 O28 P4 Se4 W4 -","4","1","NA1204","Thöne, C.; Jones, P. G.","Tricarbonyl(cyclopentadienyl)(selenotriphenylphosphonium)tungsten(I) Perchlorate, [W(C~5~H~5~)(C~18~H~15~PSe)(CO)~3~](ClO~4~)","Acta Crystallographica Section C","1996","52","5","1084","1086","10.1107/S0108270195015289","","","0.71073","MoKα","","0.0461","0.0275","","0.056","0.0524","","","","0.905","0.992","0.992","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004914","6.8415","0.0003","24.411","0.003","19.377","0.001","90","","95.888","0.006","90","","3219","0.5","298","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Methoxy-9-methyl-9H-carbazol-1,2-dimethyldicarboxalat","","- C18 H17 N O5 -","- C18.5 H17 N O4.5 -","- C148 H136 N8 O36 -","8","2","NA1206","Schollmeyer, D.; Fischer, G.; Pindur, U.","Pyrrolo-Annellated Carbazoles as Potential Antitumour-Active Compounds: Dimethyl 4-Methoxy-9-methyl-9<i>H</i>-carbazole-1,2-dicarboxylate and 5-Hydroxy-2-phenyl-10-methyl-1,2,3,10-tetrahydropyrrolo[3,4-<i>a</i>]carbazole-1,3-dione Methanol Solvate","Acta Crystallographica Section C","1996","52","5","1277","1280","10.1107/S010827019501609X","","","1.5416","CuKα","","","0.06","","0.07","","","","","6.88","","","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2004915","22.028","0.002","11.698","0.001","7.0116","0.0003","90","","90","","90","","1806.8","0.2","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2-Benzene-9-hydroxy-4-methyl-2H,4H-pyrrolo-[2,3-b]carbazole-1,3-dione","","- C22 H18 N2 O4 -","- C22 H18 N2 O4 -","- C88 H72 N8 O16 -","4","1","NA1206","Schollmeyer, D.; Fischer, G.; Pindur, U.","Pyrrolo-Annellated Carbazoles as Potential Antitumour-Active Compounds: Dimethyl 4-Methoxy-9-methyl-9<i>H</i>-carbazole-1,2-dicarboxylate and 5-Hydroxy-2-phenyl-10-methyl-1,2,3,10-tetrahydropyrrolo[3,4-<i>a</i>]carbazole-1,3-dione Methanol Solvate","Acta Crystallographica Section C","1996","52","5","1277","1280","10.1107/S010827019501609X","","","1.5418","CuKα","","0.098","0.0628","","0.1852","0.1619","","","","1.009","1.047","1.047","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004916","10.044","0.003","10.044","0.003","10.044","0.003","90","","90","","90","","1013.3","0.5","296","","23","","","","","","","","","3","F 2 2 2","F 2 2","22","","","","- Re4 S4 Te4 -","- Re4 S4 Te4 -","- Re16 S16 Te16 -","4","0.25","OH1089","Fedorov, V. E.; Mironov, Y. V.; Fedin, V. P.; Imoto, H.; Saito, T.","Re~4~S~4~Te~4~","Acta Crystallographica Section C","1996","52","5","1065","1067","10.1107/S0108270195016763","","","0.7107","MoKα","","","0.0286","","","0.0224","","","","","4.27","4.27","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004917","3.908","0.001","3.908","0.001","11.16","0.004","90","","90","","90","","170.44","0.09","296","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","","","- Cs La Nb2 O7 -","- Cs La Nb2 O7 -","- Cs La Nb2 O7 -","1","0.0625","OH1090","Kumada, N.; Kinomura, N.; Sleight, A. W.","CsLaNb~2~O~7~","Acta Crystallographica Section C","1996","52","5","1063","1065","10.1107/S0108270195015848","","","0.71069","MoKα","","","0.026","","","0.031","","","","","1.79","1.79","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004918","6.5901","0.0008","9.4434","0.0009","14.983","0.002","90","","90","","90","","932.44","0.19","291","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C5 H14 N2 O5 Pt -","- C5 H14 N2 O5 Pt -","- C20 H56 N8 O20 Pt4 -","4","0.5","PA1135","Bréhin, P.; Chottard, J. C.; Kozelka, J.; Bois, C.","Diammine(dimethylmalonato)platinum(II) Monohydrate","Acta Crystallographica Section C","1996","52","5","1186","1188","10.1107/S010827019501482X","","","0.7107","MoKα","","","0.029","","","0.037","","","","","1.05","1.05","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004919","19.238","0.005","24.477","0.003","15.79","0.02","90","","109.52","0.02","90","","7008","9","123","2","150","2","","","","","","","","3","C 1 2 1","C 2y","5","β-Cyclodextrin-Z-9-dodecenol complex","cyclomaltoheptaose-Z-9-dodecen-1-ol complex","","- C49 H104 O46 -","- C48.81 H52.43 O45.37 -","- C195.24 H209.72 O181.48 -","4","1","PA1191","Mentzafos, D.; Mavridis, I. M.; Hursthouse, M. B.","β-Cyclodextrin (<i>Z</i>)-9-Dodecen-1-ol 2:1 Complex","Acta Crystallographica Section C","1996","52","5","1220","1223","10.1107/S0108270195014703","","","0.071069","MoKα","","0.0901","0.0679","","0.2204","0.1842","","","","0.596","0.732","0.732","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004920","19.825","0.005","16.714","0.002","4.905","0.001","90","","90","","90","","1625.3","0.6","293","","293","","","","","","","","","4","P n m a","-P 2ac 2n","62","","5,6-BENZO-4,7-DIOXA-1,10,14-TRIAZACYCLOHEPTADECANE-2,9-DIONE","","- C16 H23 N3 O4 -","- C16 H23 N3 O4 -","- C64 H92 N12 O16 -","4","0.5","PA1212","","Structure-Based Rationalization of the Ionophore Character of Lead-Selective Amide‒Ether‒Amine-Containing Macrocycles: 2,3-Benzo-1,4-dioxa-7,11,15-triazacycloheptadec-2-ene-6,16-dione and 2,3-Benzo-1,4-dioxa-7,10,13-triazacyclopentadec-2-ene-6,14-dione‒Water (1/2)","Acta Crystallographica C","1996","52","","1232","1236","10.1107/S0108270195015198","","","1.5418","CuKα","","0.133","0.039","","0.108","0.039","","","","1.918","1.219","1.219","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004921","7.3684","0.0009","22.641","0.003","10.479","0.002","90","","110.44","0.01","90","","1638.1","0.4","293","","293","","","","","","","","","4","I 1 a 1","I -2ya","9","","Diaqua 5,6-benzo-4,7-dioxa-1,10,13-triazacyclopentadecane-2,9-dione","","- C14 H23 N3 O6 -","- C14 H23 N3 O6 -","- C56 H92 N12 O24 -","4","1","PA1212","","Structure-Based Rationalization of the Ionophore Character of Lead-Selective Amide‒Ether‒Amine-Containing Macrocycles: 2,3-Benzo-1,4-dioxa-7,11,15-triazacycloheptadec-2-ene-6,16-dione and 2,3-Benzo-1,4-dioxa-7,10,13-triazacyclopentadec-2-ene-6,14-dione‒Water (1/2)","Acta Crystallographica C","1996","52","","1232","1236","10.1107/S0108270195015198","","","1.5418","CuKα","","0.05","0.041","","0.052","0.045","","","","1.191","1.128","1.128","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004922","9.484","0.002","7.812","0.002","26.171","0.005","90","","94.64","0.03","90","","1932.6","0.7","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,3-bis(2-imidazolyl)propionic acid hemihydrate","","- C9 H11 N4 O2.5 -","- C9 H11 N4 O2.5 -","- C72 H88 N32 O20 -","8","2","PA1214","Gimeno, B.; Sancho, A.; Soto, L.; Legros, J.-P.","3,3-Bis(2-imidazolyl)propionic Acid Hemihydrate","Acta Crystallographica Section C","1996","52","5","1226","1228","10.1107/S0108270195016222","","","0.71069","MoKα","","","0.04","","","0.043","","","","","2.44","2.44","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004923","9.16","0.006","7.819","0.005","9.57","0.004","80.49","0.05","113.72","0.04","98.97","0.05","615.9","0.7","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H11 N O3 S -","- C13 H11 N O3 S -","- C26 H22 N2 O6 S2 -","2","1","PT1031","Howie, R. A.; Wardell, J. L.","4-Methoxyphenyl 2-Nitrophenyl Sulfide","Acta Crystallographica Section C","1996","52","5","1228","1230","10.1107/S0108270195015587","","","0.71073","MoKα","","","0.032","","","0.037","","","","","1.24","1.24","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004924","7.852","0.002","13.714","0.002","13.265","0.003","90","","118.98","0.01","90","","1249.6","0.5","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H16 Cu2 N8 O4 -","- C28 H16 Cu2 N8 O4 -","- C56 H32 Cu4 N16 O8 -","2","0.5","PT1036","Parker, O. J.; Wolther, M. P.; Breneman, G. L.","Di-μ-isocyanato-bis[isocyanato(1,10-phenanthroline)copper(II)]","Acta Crystallographica Section C","1996","52","5","1089","1091","10.1107/S0108270195016799","","","0.71073","MoKα","","","0.028","","","0.036","","","","","1.44","1.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004925","11.36","0.002","35.845","0.005","11.495","0.002","90","","90.95","0.02","90","","4680.1","1.3","293","","","","","","","","","","","10","P 1 21/n 1","-P 2yn","14","","","","- C48 H36 B Br Cl2 D10 F4 O P2 Pt -","- C49 H38 B Br Cl2 F4 P2 Pt -","- C196 H152 B4 Br4 Cl8 F16 P8 Pt4 -","4","1","SZ1018","Klosin, J.; Jones, W. M.; Abboud, K. A.","Two Forms of Bromo(cycloheptatrienylidene)bis(triphenylphosphine)platinum(II)","Acta Crystallographica Section C","1996","52","5","1101","1104","10.1107/S010827019501016X","","","0.71073","MoKα","","","0.0509","","","0.0578","","","","","1.57","1.57","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004926","10.943","0.003","15.861","0.004","27.756","0.007","90","","90","","90","","4818","2","293","","","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C47 H44 B Br F4 O P2 Pt -","- C51 B Br F4 O2 P2 Pt -","- C204 B4 Br4 F16 O8 P8 Pt4 -","4","1","SZ1018","Klosin, J.; Jones, W. M.; Abboud, K. A.","Two Forms of Bromo(cycloheptatrienylidene)bis(triphenylphosphine)platinum(II)","Acta Crystallographica Section C","1996","52","5","1101","1104","10.1107/S010827019501016X","","","0.71073","MoKα","","","0.0646","","","0.0736","","","","","2.05","2.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004927","11.792","0.002","8.563","0.002","13.061","0.004","90","","90","","90","","1318.8","0.6","296","1","296","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H12 Cl2 N4 Ru -","- C8 H12 Cl2 N4 Ru -","- C32 H48 Cl8 N16 Ru4 -","4","0.5","TA1049","Bown, M.; Hockless, D. C. R.","<i>trans</i>-Tetrakis(acetonitrile)dichlororuthenium(II), [RuCl~2~(MeCN)~4~]","Acta Crystallographica Section C","1996","52","5","1105","1106","10.1107/S0108270195015320","","","0.7107","MoKα","","","0.0208","","","0.0165","","","","","1.577","1.577","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004928","8.802","0.006","9.517","0.005","10.989","0.008","100.15","0.05","106.51","0.06","101.75","0.05","836.8","1","298","","298","","","","","","","","","5","P -1","-P 1","2","","Trikis-(piperizinium) octamolybdate","","- C12 H36 Mo8 N6 O27 -","- C12 H36 Mo8 N6 O27 -","- C12 H36 Mo8 N6 O27 -","1","0.5","TA1054","Harrison, W. T. A.; Dussack, L. L.; Jacobson, A. J.","Tris(piperazinium) Octamolybdate, (C~4~H~12~N~2~)~3~[Mo~8~O~27~]","Acta Crystallographica Section C","1996","52","5","1075","1077","10.1107/S0108270195015642","","","0.71073","MolybdenumKα","","0.033","0.033","","0.026","0.026","","","","1.03","1.03","1.03","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004929","9.734","0.001","17.075","0.001","9.764","0.001","90","","96.4","0.01","90","","1612.7","0.3","295","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","2-(trimethylsilyl)-3-methyl-3H-benz[f]indolyl-3-hydroperoxide","","- C16 H19 N O2 Si -","- C16 H19 N O2 Si -","- C64 H76 N4 O8 Si4 -","4","2","TA1061","Morales, G. A.; Fronczek, F. R.","A Kryptoracemic Hydroperoxide","Acta Crystallographica Section C","1996","52","5","1266","1268","10.1107/S010827019501537X","","","1.54184","CuKα","","","0.041","","","0.048","","","","","2.146","2.146","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2004930","8.075","0.003","8.382","0.002","22.978","0.007","90","","90","","90","","1555.3","0.8","133","2","133","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R,2S,4R)-2-benzoyloxy-4-methoxy-5-(1-methylethyl)-6,8- dioxabicyclo[3.2.1]octane","","- C17 H24 O4 -","- C17 H24 O4 -","- C68 H96 O16 -","4","1","TA1065","Gainsford, G. J.; Tyler, P. C.; Furneaux, R. H.","(1<i>R</i>,2<i>S</i>,4<i>R</i>)-2-Benzyloxy-4-methoxy-5-(1-methylethyl)-6,8-dioxabicyclo[3.2.1]octane and (1<i>R</i>,2<i>S</i>,4<i>R</i>)-2-Benzyloxy-4-methoxy-2-methyl-6,8-dioxabicyclo[3.2.1]octane","Acta Crystallographica Section C","1996","52","5","1274","1277","10.1107/S0108270195015964","","","0.71069","MoKα","","0.0688","0.0524","","0.1316","0.1231","","","","1.041","1.11","1.11","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004931","5.934","0.003","6.907","0.003","32.751","0.018","90","","90","","90","","1342.3","1.2","133","2","133","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,6-anhydro-4-O-benzyl-3-deoxy-4-C-methyl-2-O-methyl-β-D-ribo-hexopyranose","","- C15 H20 O4 -","- C15 H20 O4 -","- C60 H80 O16 -","4","1","TA1065","Gainsford, G. J.; Tyler, P. C.; Furneaux, R. H.","(1<i>R</i>,2<i>S</i>,4<i>R</i>)-2-Benzyloxy-4-methoxy-5-(1-methylethyl)-6,8-dioxabicyclo[3.2.1]octane and (1<i>R</i>,2<i>S</i>,4<i>R</i>)-2-Benzyloxy-4-methoxy-2-methyl-6,8-dioxabicyclo[3.2.1]octane","Acta Crystallographica Section C","1996","52","5","1274","1277","10.1107/S0108270195015964","","","0.71069","MoKα","","0.0969","0.0585","","0.1374","0.1131","","","","0.983","1.094","1.094","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004932","8.978","0.002","8.689","0.002","10.702","0.002","90","","106.98","0.03","90","","798.5","0.3","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H24 N2 O4 -","- C14 H24 N2 O4 -","- C28 H48 N4 O8 -","2","0.5","VJ1033","Zhang, S.-W.; Liu, Q.; Wei, Y. G.; Shao, M.-C.","Anti-Cancer Agents. I. <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetraacetylhexamethylenediamine","Acta Crystallographica Section C","1996","52","5","1238","1239","10.1107/S0108270195014892","","","0.71073","MoKα","","","0.0563","","","0.0534","","","","","0.5","0.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004933","31.208","0.002","8.7588","0.0004","10.9435","0.0011","90","","101.706","0.003","90","","2929.1","0.4","298","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C17 H24 O2 -","- C17 H24 O2 -","- C136 H192 O16 -","8","1","CF1040","Harmata, M.; Elomari, S.; Barnes, C. L.","(±)-(3a<i>R</i>*,6<i>S</i>*,7<i>S</i>*,14a<i>R</i>*)-2,3,3a,7,8,9,10,11,12,13,14,14a-Dodecahydro-1<i>H</i>,6<i>H</i>-3a,6-epoxy-7,14a-methanocyclopentacyclotridecen-15-one","Acta Crystallographica Section C","1996","52","5","1209","1211","10.1107/S0108270195015782","","","1.54184","CuKα","","","0.054","","","0.09","","","","","3.18","3.18","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004934","7.701","0.002","40.02","0.005","4.6437","0.0006","90","","107.34","0.01","90","","1366.1","0.4","123","","123","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C11 H28 Cl N O -","- C11 H28 Cl N O -","- C44 H112 Cl4 N4 O4 -","4","1","CF1038","Silver, J.; Martin, S.; Marsh, P. J.; Frampton, C. S.","<i>n</i>-Undecylammonium Chloride Monohydrate","Acta Crystallographica Section C","1996","52","5","1261","1263","10.1107/S0108270195015770","","","0.7107","MoKα","","","0.0293","","","0.0324","","","","","1.67","1.67","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004935","7.802","0.003","12.138","0.002","14.748","0.002","95.77","0.01","99.33","0.02","104.28","0.02","1321.1","0.6","293","","293","","","","","","","","","4","P -1","-P 1","2","(Me~3~TTF)~2~C(OH)Me","[1,1'-bis(3',4,4'-trimethyl-tetrathiafulvalen-3-yl)] hemi-ethanol solvate","","- C21 H25 O1.5 S8 -","- C22 H22 O2 S8 -","- C44 H44 O4 S16 -","2","1","AB1303","Dolbecq, A.; Fourmigué, M.; Batail, P.","1,1-Bis(3',4,4'-trimethyltetrathiafulvalen-3-yl)ethanol Ethanol Hemisolvate; a New Bifunctional π-Donor Molecule","Acta Crystallographica Section C","1996","52","6","1543","1545","10.1107/S0108270196000509","","","0.71073","MoKα","","0.094","0.053","","0.081","0.057","","","","1.527","1.373","1.373","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004936","9.692","0.003","13.232","0.004","29.968","0.007","90","","91.31","0.03","90","","3842.2","1.9","178","2","178","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","(Z)-2,3-Bis-4'-[2.2.2]paracyclophanyl-but-2-ene","","- C52 H52 -","- C52 H52 -","- C208 H208 -","4","1","AB1325","Jones, P. G.; Bubenitschek, P.; Heirtzler, F.; Hopf, H.","(<i>Z</i>)-2,3-Bis(4'-[2.2.2]paracyclophanyl)but-2-ene and μ-η6:η6-[(<i>Z</i>)-2,3-Bis(4'-[2.2.2]paracyclophanyl)but-2-ene]-bis[(hexafluoroantimonato-<i>F</i>)silver(I)] Toluene Dichloromethane (1/1/1)","Acta Crystallographica Section C","1996","52","6","1380","1384","10.1107/S0108270195017008","","","0.71073","MoKα","","0.1151","0.0693","","0.1957","0.1506","","","","1.069","1.075","1.075","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004937","17.288","0.003","12.159","0.002","27.527","0.004","90","","97.06","0.02","90","","5742.4","1.6","163","2","163","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","{(Z)-2,3-Bis-4'-[2.2.2]paracyclophanyl-but-2-ene}-bis{silver(I) hexafluoroantimonate toluene dichloromethane (1:1:1)","","- C60 H62 Ag2 Cl2 F12 Sb2 -","- C60 H59 Ag2 Cl2 F12 Sb2 -","- C240 H236 Ag8 Cl8 F48 Sb8 -","4","0.5","AB1325","Jones, P. G.; Bubenitschek, P.; Heirtzler, F.; Hopf, H.","(<i>Z</i>)-2,3-Bis(4'-[2.2.2]paracyclophanyl)but-2-ene and μ-η6:η6-[(<i>Z</i>)-2,3-Bis(4'-[2.2.2]paracyclophanyl)but-2-ene]-bis[(hexafluoroantimonato-<i>F</i>)silver(I)] Toluene Dichloromethane (1/1/1)","Acta Crystallographica Section C","1996","52","6","1380","1384","10.1107/S0108270195017008","","","0.71073","MoKα","","0.0523","0.0429","","0.1131","0.0994","","","","1.052","1.046","1.046","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004938","14.8208","0.0012","8.1939","0.0004","17.4844","0.0009","90","","91.185","0.004","90","","2122.9","0.2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N-dibenzoyl-2-phenylbenzylamine","","- C27 H21 N O2 -","- C27 H21 N O2 -","- C108 H84 N4 O8 -","4","1","AB1326","Blake, A. J.; Cullen, K. E.; Sharp, J. T.","<i>N</i>,<i>N</i>-Dibenzoyl-2-phenylbenzylamine","Acta Crystallographica Section C","1996","52","6","1546","1548","10.1107/S0108270195017033","","","0.71073","MoKα","","0.0558","0.0347","","0.1044","0.0936","","","","1.034","1.086","1.086","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004939","26.319","0.007","16.313","0.004","17.842","0.004","90","","90","","90","","7660","3","178","2","178","2","","","","","","","","2","F d d 2","F 2 -2d","43","","1,4-bis-4'-[2.2.2]Paracyclophanyl-buta-1,3-diyne","","- C52 H46 -","- C52 H46 -","- C416 H368 -","8","0.5","AB1332","Jones, P. G.; Heirtzler, F.; Hopf, H.","1,4-Bis(4'-[2.2.2]paracyclophanyl)buta-1,3-diyne and its Bis[silver(I) hexafluoroantimonate] Complex","Acta Crystallographica Section C","1996","52","6","1384","1388","10.1107/S0108270195016994","","","0.71073","MoKα","","0.0916","0.0411","","0.1182","0.0902","","","","0.989","1.016","1.016","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004940","13.662","0.005","11.267","0.005","18.225","0.007","90","","105.83","0.03","90","","2699","1.9","143","2","143","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","{(1,4-bis-4'-[2.2.2]Paracyclophanyl-buta-1,3-diyne)bis(silver(I)} Bis-Hexafluoroantimonate Dichloromethane Solvate (1:2)","","- C54 H50 Ag2 Cl4 F12 Sb2 -","- C54 H50 Ag2 Cl4 F12 Sb2 -","- C108 H100 Ag4 Cl8 F24 Sb4 -","2","0.5","AB1332","Jones, P. G.; Heirtzler, F.; Hopf, H.","1,4-Bis(4'-[2.2.2]paracyclophanyl)buta-1,3-diyne and its Bis[silver(I) hexafluoroantimonate] Complex","Acta Crystallographica Section C","1996","52","6","1384","1388","10.1107/S0108270195016994","","","0.71073","MoKα","","0.1038","0.0662","","0.1824","0.1466","","","","1.044","1.063","1.063","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004941","9.781","0.002","10.597","0.002","20.216","0.004","101.49","0.03","93.85","0.03","109.53","0.03","1914.8","0.8","193","2","193","2","","","","","","","","4","P -1","-P 1","2","Tetrakis(diphenylamido)hafnium","Tetrakis(diphenylamido)hafnium","","- C48 H40 Hf N4 -","- C48 H40 Hf N4 -","- C96 H80 Hf2 N8 -","2","1","AB1336","Polamo, M.; Mutikainen, I.; Leskelä, M.","Tetrakis(diphenylamido-<i>N</i>)hafnium","Acta Crystallographica Section C","1996","52","6","1348","1350","10.1107/S0108270196001035","","","0.71073","MoKα","","0.032","0.0305","","0.0757","0.0741","","","","1.038","1.037","1.037","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004942","6.9936","0.0006","13.1255","0.0012","17.988","0.006","90","","90","","90","","1651.2","0.6","294","1","294","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Diiodobis(phenylsulfonyl)methane","","- C13 H10 I2 O4 S2 -","- C13 H10 I2 O4 S2 -","- C52 H40 I8 O16 S8 -","4","1","AB1343","Glidewell, C.; Ferguson, G.; Nikas, S.; Varvoglis, A.","Accurate Redetermination of Diiodobis(phenylsulfonyl)methane, (PhSO~2~)~2~CI~2~","Acta Crystallographica Section C","1996","52","6","1488","1490","10.1107/S0108270195016647","","","0.7107","MolybdenumKα","","0.0964","0.0481","","0.1115","0.1001","","","","0.961","1.125","1.125","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004943","18.629","0.002","18.629","0.002","29.863","0.005","90","","90","","120","","8975","2","150","0.2","150","0.2","","","","","","","","7","R -3 :H","-R 3","148","","Tris(1,4,7,10-tetraoxa-13,16-dithiacyclooctadecane)ruthenium(II) bis(hexafluorophosphate) dihydrate methanol solvate","","- C37 H80 F12 O15 P2 Ru S6 -","- C36.99 H79.94 F12 O14.98 P2 Ru S6 -","- C221.94 H479.64 F72 O89.88 P12 Ru6 S36 -","6","0.333333","AB1354","Blake, A. J.; Radek, C.; Schröder, M.","Tris(1,4,7,10-tetraoxa-13,16-dithiacyclooctadecane-<i>S</i>,<i>S</i>')ruthenium(II) Bis(hexafluorophosphate)‒Water‒Methanol (1/2/1)","Acta Crystallographica Section C","1996","52","6","1401","1403","10.1107/S0108270196001497","","","0.71073","MoKα","","0.0453","0.0361","","0.1275","0.1002","","","","1.039","1.052","1.052","","","","","has coordinates","191017","2020-10-21","18:00:00",""
"2004944","7.386","0.001","11.81","0.001","17.197","0.002","90","","90","","90","","1500.1","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","p-N,N-Dimethylaminobenzaldehyde Isonicotinylhydrazone Monohydrate.","","- C15 H18 N4 O2 -","- C15 H18 N4 O2 -","- C60 H72 N16 O8 -","4","1","AS1221","Fun, H.-K.; Sivakumar, K.; Lu, Z.-L.; Duan, C.-Y.; Tian, Y.-P.; You, X.-Z.","<i>p</i>-(Dimethylamino)benzaldehyde Isonicotinoylhydrazone Monohydrate","Acta Crystallographica Section C","1996","52","6","1505","1507","10.1107/S0108270196000303","","","0.71073","MoKα","","0.0536","0.0336","","0.0864","0.0789","","","","0.928","1.049","1.049","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004945","6.417","0.001","8.378","0.001","12.503","0.002","94.02","0.01","92.19","0.01","91.66","0.01","669.7","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","p-Nitrobenzaldehyde Nictonylhydrazone Monohydrate.","","- C13 H12 N4 O4 -","- C13 H12 N4 O4 -","- C26 H24 N8 O8 -","2","1","AS1222","Lu, Z.-L.; Duan, C.-Y.; Tian, Y.-P.; You, X.-Z.; Fun, H.-K.; Sivakumar, K.","<i>p</i>-Nitrobenzaldehyde Nicotinoylhydrazone Monohydrate","Acta Crystallographica Section C","1996","52","6","1507","1509","10.1107/S0108270195016702","","","0.71073","MoKα","","0.0624","0.0486","","0.1599","0.1492","","","","1.108","1.22","1.22","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004946","11.6086","0.0015","7.7966","0.0009","15.2545","0.0014","90","","104.52","0.007","90","","1336.6","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 I N O2 S -","- C13 H12 I N O2 S -","- C52 H48 I4 N4 O8 S4 -","4","1","BK1198","Protasiewicz, J. D.","(Tosyliminoiodo)benzene at 298K","Acta Crystallographica Section C","1996","52","6","1570","1572","10.1107/S0108270195016659","","","0.71073","MoKα","","0.0385","0.028","","0.106","0.0598","","","","1.11","1.147","1.147","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004947","14.498","0.005","9.263","0.003","14.703","0.004","90","","103.16","0.02","90","","1922.7","1.1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","DADLE HCl","[D-Ala^2^,D-Leu^5^]-enkephalin hydrochloride","","- C33 H48 Cl N5 O8 -","- C33 H47 Cl N5 O8 -","- C66 H94 Cl2 N10 O16 -","2","1","BK1199","Deschamps, J. R.; George, C.; Flippen-Anderson, J. L.","[ <small>D</small>-Ala^2^, <small>D</small>-Leu^5^]-Enkephalin Hydrochloride","Acta Crystallographica Section C","1996","52","6","1583","1585","10.1107/S0108270196000534","","","1.54178","CuKα","","0.1279","0.0811","","0.2138","0.1824","","","","1.094","1.236","1.236","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004948","6.752","0.001","12.44","0.001","16.251","0.001","90","","90","","90","","1365","0.2","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","β-isopipitzol","(1R,3R,6r,11R)-1,2,2,6,-tetramethyl-8-hydroxytriciclo[5.2.2.0^3,11^] undec-7-en-9,10-dione","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","BK1206","Hernández-Ortega, S.; Yuste, F.; Ortiz, B.; Barrios, H.; Sánchez-Obregón, R.; Walls, F.","β-Isopipitzol","Acta Crystallographica Section C","1996","52","6","1452","1454","10.1107/S0108270195015988","","","1.5418","CuKα","","0.0619","0.057","","0.0823","0.075","","","","","1.32","1.32","","","","","has coordinates","198488","2020-10-21","18:00:00",""
"2004949","10.082","0.002","10.912","0.002","12.228","0.002","98.105","0.015","108.339","0.014","106.541","0.015","1184.1","0.4","130","2","","","","","","","","","","3","P -1","-P 1","2","","5,8-Bis(trimethylsilyl)-6,7-dihydroindeno[2,1c]fluorene","","- C26 H32 Si2 -","- C26 H32 Si2 -","- C52 H64 Si4 -","2","1","BK1209","Olmstead, M. M.; Hitchcock, S. R.; Nantz, M. H.","Cyclohexane-Linked Indenyl Rings in 5,8-Bis(trimethylsilyl)-6,7,12b,12c-tetrahydroindeno[2,1-<i>c</i>]fluorene","Acta Crystallographica Section C","1996","52","6","1523","1525","10.1107/S0108270196000054","","","0.71073","MoKα","","0.0708","0.052","","0.1357","0.1231","","","","1.034","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004950","14.963","0.006","6.093","0.003","12.228","0.005","90","","100.14","0.02","90","","1097.4","0.8","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(4aRS,4bSR,6RS,8aRS,8bSR) 6-methyl-3,4,4a,4b,5,6,7,8,8a,8b-decahydro- 2H-benzofuro[2,3,b]pyran","","- C12 H20 O2 -","- C12 H20 O2 -","- C48 H80 O8 -","4","1","BM1023","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mercier-Girardot, S.; Caubère, P.","New Routes to Pyranotetrahydrofuran Derivatives","Acta Crystallographica Section C","1996","52","6","1530","1532","10.1107/S0108270195014405","","","1.54178","CuKα","","0.0607","0.054","","0.1109","0.1064","","","","1.222","1.227","1.227","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004951","15.875","0.009","13.09","0.01","13.771","0.008","90","","90","","90","","2862","3","153","","153","","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C17 H11 N O3 S -","- C17 H11 N O3 S -","- C136 H88 N8 O24 S8 -","8","2","BM1049","Alves, J. A. C.; Brigas, A. F.; Johnstone, R. A. W.","3-(1-Naphthyloxy)-1,2-benzisothiazole 1,1-Dioxide: Electronic Effects of Conjugation","Acta Crystallographica Section C","1996","52","6","1576","1579","10.1107/S0108270196000935","","","0.7107","MoKα","","","0.0449","","","0.0491","","","","","1.586","1.586","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004952","7.204","0.001","11.752","0.002","15.057","0.001","103.14","0.01","98.37","0.01","92.45","0.01","1224.3","0.3","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H22 Co N4 O20 -","- C14 H22 Co N4 O20 -","- C28 H44 Co2 N8 O40 -","2","1","BM1053","Tahir, M. N.; Ülkü, D.; Mövsümov, E. M.","Tetraaquabis(3,5-dinitrobenzoato-<i>O</i>)cobalt(II) Tetrahydrate","Acta Crystallographica Section C","1996","52","6","1392","1394","10.1107/S010827019600128X","","","0.71073","MoKα","","","0.036","","","0.042","","","","","1.27","1.27","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004953","13.702","0.002","12.498","0.002","7.894","0.001","90","","90","","90","","1351.8","0.3","293","2","293","2","","","","","","","","2","P n m a","-P 2ac 2n","62","Hexaiododisilane","Hexaiododisilane","","- I6 Si2 -","- I6 Si2 -","- I24 Si8 -","4","0.5","BR1117","Jansen, M.; Friede, B.","Hexaiododisilane","Acta Crystallographica Section C","1996","52","6","1333","1334","10.1107/S0108270196000820","","","0.71073","MoKα","","0.071","0.0608","","0.1712","0.165","","","","1.232","1.306","1.306","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004954","13.298","0.002","10.08","0.002","13.637","0.004","90","","92.39","0.02","90","","1826.4","0.7","292","","292","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Sr (ReO4)2 . 2H2O","","- H4 O10 Re2 Sr -","- H4 O10 Re2 Sr -","- H32 O80 Re16 Sr8 -","8","2","BR1122","Todorov, T.; Angelova, O.; Macícek, J.","The Covert Water in the Structure of Sr(ReO~4~)~2~.2H~2~O: a Revision of the Sesquihydrate Model","Acta Crystallographica Section C","1996","52","6","1319","1323","10.1107/S0108270195016362","","","0.71073","MoKα","","0.102","0.038","","0.191","0.05","","","","2.998","0.808","0.808","","","","","has coordinates","191094","2020-10-21","18:00:00",""
"2004955","4.024","0.003","4.024","0.003","5.113","0.004","90","","90","","120","","71.7","0.09","113","2","","","","","","","","","","2","P -3 m 1","-P 3 2""","164","","","","- Pd Te2 -","- Pd Te2 -","- Pd Te2 -","1","0.0833333","BR1127","Pell, M. A.; Mironov, Y. V.; Ibers, J. A.","PdTe~2~","Acta Crystallographica Section C","1996","52","6","1331","1332","10.1107/S0108270195016246","","","0.7107","MoKα","","","0.0262","","","0.0648","","","","","1.325","1.325","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004956","4.555","0.002","4.555","","9.772","0.006","90","","90","","90","","202.75","0.15","293","","20","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","","","- Bi2 Ce Cu0.71 -","- Bi2 Ce Cu0.7055 -","- Bi4 Ce2 Cu1.411 -","2","0.125","BR1129","Ye, J.; Huang, Y. K.; Kadowaki, K.; Matsumoto, T.","A Novel Intermetallic Compound, CeCu~1{-~<i>x</i>}Bi~2~","Acta Crystallographica Section C","1996","52","6","1323","1325","10.1107/S0108270195016738","","","0.7107","MoKα","","","0.0483","","","0.0482","","","","","1.16","1.16","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004957","6.499","0.001","14.191","0.004","7.607","0.002","90","","93.95","0.02","90","","699.9","0.3","296","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- As2 H4 Mg2 O9 -","- As2 H4 Mg2 O9 -","- As8 H16 Mg8 O36 -","4","1","BR1130","Wu, C.-H.; Chen, T.-C.; Wang, S.-L.","Two Hydrous Divalent-Metal Diarsenates","Acta Crystallographica Section C","1996","52","6","1326","1329","10.1107/S0108270195016350","","","","MoKα","","","0.0253","","","0.0278","","","","","0.997","0.997","","","","","has coordinates","278315","2022-10-03","11:11:45",""
"2004958","6.496","0.021","14.211","0.006","7.628","0.004","90","","93.91","0.04","90","","703","2","296","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- As2 H4 O9 Zn2 -","- As2 O9 Zn2 -","- As8 O36 Zn8 -","4","1","BR1130","Wu, C.-H.; Chen, T.-C.; Wang, S.-L.","Two Hydrous Divalent-Metal Diarsenates","Acta Crystallographica Section C","1996","52","6","1326","1329","10.1107/S0108270195016350","","","","MoKα","","","0.059","","","0.0616","","","","","0.76","0.76","","","","","has coordinates","278318","2022-10-03","11:48:11",""
"2004959","7.429","0.002","13.906","0.009","9.157","0.002","90","","110.72","0.02","90","","884.8","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Potassium Molybdenyl Diarsenate","","- As2 K2 Mo O9 -","- As2 K2 Mo O9 -","- As8 K8 Mo4 O36 -","4","1","BR1131","Zid, M. F.; Jouini, T.","K~2~MoO~2~As~2~O~7~","Acta Crystallographica Section C","1996","52","6","1334","1336","10.1107/S0108270195016726","","","0.71069","MoKα","","0.0368","0.0247","","0.052","0.0494","","","","1.221","1.29","1.29","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004960","9.491","0.003","12.201","0.006","18.786","0.012","81.27","0.03","81.02","0.02","71.12","0.02","2021.2","1.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","barium decavanadate enneahydrate","","- Ba3 H6 O31 V10 -","- Ba3 O47 V10 -","- Ba6 O94 V20 -","2","1","BR1133","Kamenar, B.; Cindrić, M.; Strukan, N.","Ba~3~[V~10~O~28~].19H~2~O","Acta Crystallographica Section C","1996","52","6","1338","1341","10.1107/S0108270195017124","","","0.71069","MoKα","","0.081","0.0587","","0.1869","0.1557","","","","1.031","1.051","1.051","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004961","17.797","0.003","10.2594","0.0006","7.4438","0.0005","90","","98.44","0.01","90","","1344.4","0.3","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","p-nitrophenyl-α-D-mannopyranoside hemihydrate","","- C24 H32 N2 O17 -","- C24 H32 N2 O17 -","- C48 H64 N4 O34 -","2","1","CF1032","Fernandez-Castaño, C.; Foces-Foces, C.","<i>p</i>-Nitrophenyl α-<small>D</small>-Mannopyranoside Hemihydrate","Acta Crystallographica Section C","1996","52","6","1586","1588","10.1107/S0108270196000728","","","1.5418","CuKα","","0.069","0.069","","0.069","0.069","","","","1.017","1.017","1.017","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2004962","6.7341","0.0006","19.76","0.002","8.1797","0.0015","90","","102.085","0.009","90","","1064.3","0.2","294","1","294","1","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","1,3-adamantanedicarboxylic acid","","- C12 H16 O4 -","- C12 H15.806 O4 -","- C48 H63.224 O16 -","4","1","CF1046","Glidewell, C.; Ferguson, G.","1,3-Adamantanedicarboxylic Acid and 1,3-Adamantanediacetic Acid","Acta Crystallographica Section C","1996","52","6","1466","1470","10.1107/S0108270195016593","","","0.7107","MoKα","","0.1444","0.0499","","0.1458","0.1233","","","","0.863","1.186","1.186","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004963","23.677","0.014","7.739","0.005","14.73","0.014","90","","110.23","0.05","90","","2533","3","294","1","294","1","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","1,3-Adamantanediacetic acid","","- C14 H20 O4 -","- C14 H20 O4 -","- C112 H160 O32 -","8","2","CF1046","Glidewell, C.; Ferguson, G.","1,3-Adamantanedicarboxylic Acid and 1,3-Adamantanediacetic Acid","Acta Crystallographica Section C","1996","52","6","1466","1470","10.1107/S0108270195016593","","","0.7107","MoKα","","0.1517","0.0654","","0.186","0.1641","","","","0.967","1.327","1.327","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004964","9.548","0.007","11.924","0.011","12.714","0.01","90","","94.68","0.06","90","","1443","2","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 I2 Sn -","- C12 H10 I2 Sn -","- C48 H40 I8 Sn4 -","4","1","CF1048","Howie, R. A.; Wardell, J. L.","Diphenyltin Diiodide","Acta Crystallographica Section C","1996","52","6","1424","1426","10.1107/S0108270195016945","","","0.71073","MoKα","","","0.048","","","0.066","","","","","0.75","0.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004965","7.839","0.007","8.281","0.007","13.113","0.009","92.77","0.06","104.85","0.06","120.82","0.06","689.9","1.1","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 N2 O4 S3 -","- C12 H8 N2 O4 S3 -","- C24 H16 N4 O8 S6 -","2","1","CF1050","Howie, R. A.; Wardell, J. L.","Bis(2-nitrophenyl) Trisulfide","Acta Crystallographica Section C","1996","52","6","1533","1534","10.1107/S010827019600073X","","","0.71073","MoKα","","","0.049","","","0.042","","","","","1.45","1.45","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004966","6.884","0.001","8.809","0.002","12.17","0.002","90","","91.99","0.03","90","","737.6","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(1S,6R,9S)-6-Benzamido-9-hydroxymethyl-8-oxabicyclo[4.3.0]non-3-en-7-one","","- C16 H17 N O4 -","- C16 H17 N O4 -","- C32 H34 N2 O8 -","2","1","CF1053","Buñuel, E.; Cativiela, C.; Díaz-de-Villegas, M. D.; Gálvez, J. A.","A Lactone Derived from an Amino Acid with a Cyclohexyl Skeleton: (1<i>S</i>,6<i>R</i>,9<i>S</i>)-6-Benzamido-9-hydroxymethyl-8-oxabicyclo[4.3.0]non-3-en-7-one","Acta Crystallographica Section C","1996","52","6","1456","1458","10.1107/S0108270195016581","","","0.71073","MoKα","","0.0637","0.0396","","0.133","0.0908","","","","1.039","1.077","1.077","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004967","10.359","0.002","12.218","0.002","13.53","0.003","90","","110.64","0.03","90","","1602.5","0.6","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Flurtamone","Flurtamone, 5-methylamino-2-phenyl-4 (a,a,a,-trifluoro-m-tolyl) furan-3(2H)-one.","","- C18 H14 F3 N O2 -","- C18 H14 F3 N O2 -","- C72 H56 F12 N4 O8 -","4","1","CF1058","Pèpe, G.; Pfefer, G.; Astier, J. P.; Marchal, P.; Bossy, A.","Flurtamone","Acta Crystallographica Section C","1996","52","6","1514","1516","10.1107/S0108270196000868","","","1.5418","CuKα","","0.056","0.056","","0.056","0.056","","","","0.78","0.78","0.78","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2004968","3.841","0.001","27.234","0.003","7.3616","0.0008","90","","102.09","0.014","90","","753","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","potassium phthalimide","","","- C8 H4 K N O2 -","- C8 H4 K N O2 -","- C32 H16 K4 N4 O8 -","4","1","CF1066","Nagel, N.; Bock, H.; Bats, J. W.","Potassium Phthalimide","Acta Crystallographica Section C","1996","52","6","1344","1346","10.1107/S0108270196002387","","","1.5418","CuKα","","0.038","0.0323","","0.1007","0.0894","","","","1.092","1.087","1.087","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004969","9.803","0.002","10.467","0.003","23.386","0.004","90","","95.69","0.01","90","","2387.8","0.9","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H21 O3 P S -","- C28 H21 O3 P S -","- C112 H84 O12 P4 S4 -","4","1","DE1007","Mani Naidu, S.; Krishnaiah, M.; Sivakumar, K.","8-(4-Methylphenoxy)-16<i>H</i>-dinaphtho[2,1-<i>d</i>:1',2'-<i>g</i>][1,3,2]dioxaphosphocine 8-sulfide","Acta Crystallographica Section C","1996","52","6","1556","1558","10.1107/S0108270195015538","","","0.71073","MoKα","","","0.042","","","0.051","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004970","7.63","0.001","35.156","0.005","8.505","0.001","90","","90","","90","","2281.4","0.5","293","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H14 N2 O4 -","- C12 H14 N2 O4 -","- C96 H112 N16 O32 -","8","1","DE1008","Magotra, D. K.; Gupta, V. K.; Rajnikant; Goswami, K. N.; Thappa, R. K.; Agarwal, S. G.","7-Methoxyvasicinone Hydrate","Acta Crystallographica Section C","1996","52","6","1491","1493","10.1107/S0108270195010870","","","0.71073","MoKα","","","0.049","","","0.149","","","","","0.703","0.703","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004971","10.683","0.002","16.996","0.005","18.77","0.003","90","","90","","90","","3408","1.3","295","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H25 N O2 -","- C19 H25 N O2 -","- C152 H200 N8 O16 -","8","1","DE1018","Thiruvalluvar, A.; Parthasarathi, V.; Natarajan, D.; Bhavani, N.; Bhadbhade, M.","<i>N</i>-Acetyl-3-ethyl-2-phenyldecahydroquinolin-4-one, C~19~H~25~NO~2~","Acta Crystallographica Section C","1996","52","6","1563","1565","10.1107/S0108270195015149","","","1.54184","CuKα","","","0.045","","","0.053","","","","","1.57","1.57","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004972","21.04","0.002","7.936","0.002","20.444","0.002","90","","116.44","0.01","90","","3056.5","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Spermine dilithium cyclohexaphosphate tetrahydrate","4,9,12-triazoniadoceylammonium Dilithiumcyclohexaphosphate Tetrahydrate","","- C10 H38 Li2 N4 O22 P6 -","- C10 H38 Li2 N4 O22 P6 -","- C40 H152 Li8 N16 O88 P24 -","4","0.5","DU1143","Gharbi, A.; Jouini, A.","4,9-Diazonia-1,12-dodecanediammonium Dilithium <i>cyclo</i>-Hexaphosphate Tetrahydrate","Acta Crystallographica Section C","1996","52","6","1342","1344","10.1107/S0108270196000558","","","0.71069","MoKα","","0.0479","0.0326","","0.1092","0.0948","","","","0.906","0.881","0.881","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004973","9.531","0.001","12.12","0.001","14.327","0.002","64.34","0.02","70.61","0.01","82.9","0.01","1406.8","0.4","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H13 Ce N6 O20 -","- C42 H26 Ce2 N12 O40 -","- C42 H26 Ce2 N12 O40 -","1","0.5","FG1076","Tahir, M. N.; Ülkü, D.; Ünaleroglu, C.; Mövsümov, E. M.","Cerium 3,5-Dinitrobenzoate Dihydrate","Acta Crystallographica Section C","1996","52","6","1449","1451","10.1107/S010827019600011X","","","0.71073","MoKα","","","0.044","","","0.044","","","","","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004974","11.598","0.001","14.526","0.001","10.612","0.001","90","","111.5","0.01","90","","1663.4","0.3","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","dimethyl 2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate","","- C17 H16 N2 O6 -","- C17 H16 N2 O6 -","- C68 H64 N8 O24 -","4","1","FG1105","Rowan, K. R.; Holt, E. M.","Dimethyl 2,6-Dimethyl-4-(3-nitrophenyl)-pyridine-3,5-dicarboxylate, Diethyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, and Diethyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate","Acta Crystallographica Section C","1996","52","6","1565","1570","10.1107/S0108270196000091","","","0.71073","MoKα","","0.0641","0.0471","","0.0699","0.0648","","","","","1.53","1.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004975","14.328","0.004","15.292","0.003","8.673","0.002","90","","90","","90","","1900.3","0.8","298","","298","","","","","","","","","4","P n a 21","P 2c -2n","33","","diethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate","","- C19 H22 N2 O6 -","- C19 H22 N2 O6 -","- C76 H88 N8 O24 -","4","1","FG1105","Rowan, K. R.; Holt, E. M.","Dimethyl 2,6-Dimethyl-4-(3-nitrophenyl)-pyridine-3,5-dicarboxylate, Diethyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, and Diethyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate","Acta Crystallographica Section C","1996","52","6","1565","1570","10.1107/S0108270196000091","","","0.71073","MoKα","","0.1097","0.0482","","0.0745","0.0537","","","","","1.16","1.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004976","12.018","0.001","19.517","0.002","8.606","0.001","90","","109.92","0.01","90","","1897.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","diethyl 2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate","","- C19 H20 N2 O6 -","- C19 H21 N2 O6 -","- C76 H84 N8 O24 -","4","1","FG1105","Rowan, K. R.; Holt, E. M.","Dimethyl 2,6-Dimethyl-4-(3-nitrophenyl)-pyridine-3,5-dicarboxylate, Diethyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, and Diethyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate","Acta Crystallographica Section C","1996","52","6","1565","1570","10.1107/S0108270196000091","","","0.71073","MoKα","","0.1452","0.0587","","0.1605","0.1064","","","","0.984","1.134","1.134","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004977","14.021","0.002","15.613","0.002","15.43","0.002","116.34","0.01","124.84","0.01","75.36","0.01","2484.5","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[NBDRh(II-phophos)~2~](BF~4~)~3~","Bis{2-(diphenylphosphinoethyl)trimethylphosphonium}(norbornadiene)rhodium(I) Fluoroborate","","- C43 H58 B3 F12 P4 Rh -","- C43 H58 B3 F12.003 P4 Rh -","- C86 H116 B6 F24.006 P8 Rh2 -","2","1","FG1107","Roszak, A. W.; Renaud, E.; Baird, M. C.","Bis{[3-(diphenylphosphino)propyl]trimethylphosphonium-<i>P</i>}[(2,3,5,6-η)-norbornadiene]rhodium(I) Tris(tetrafluoroborate)","Acta Crystallographica Section C","1996","52","6","1359","1362","10.1107/S0108270195017069","","","0.71069","MoKα","","0.0962","0.0495","","0.1591","0.1228","","","","1.112","1.155","1.155","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2004978","23.144","0.003","4.036","0.001","20.956","0.003","90","","103.89","0.01","90","","1900.2","0.6","296","","296","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C9 H4 S4 -","- C9 H4 S4 -","- C72 H32 S32 -","8","1","FG1109","Parvez, M.; Mesher, S. T. E.; Clark, P. D.","[1,3]Dithiolo[4,5-<i>b</i>][1]benzothiophene-2-thione","Acta Crystallographica Section C","1996","52","6","1503","1505","10.1107/S0108270195016532","","","0.71069","MoKα","","","0.0562","","","0.0569","","","","","2.856","2.856","","","","","has coordinates","199444","2020-10-21","18:00:00",""
"2004979","12.2102","0.0008","31.464","0.002","8.368","0.002","90","","90","","90","","3214.8","0.8","294","","294","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H48 N4 O4 -","- C31 H48 N4 O5 -","- C124 H192 N16 O20 -","4","1","FG1120","Coleman, J. E.; Patrick, B. O.; Andersen, R. J.; Rettig, S. J.","Hemiasterlin Methyl Ester","Acta Crystallographica Section C","1996","52","6","1525","1527","10.1107/S0108270195016556","","","1.5418","CuKα","","","0.0391","","","0.0375","","","","","2.207","2.207","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004980","3.756","0.001","14.191","0.001","10.911","0.001","90","","99.18","0.01","90","","574.12","0.17","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-aminopyrazine-2-carboxylic acid","","","- C5 H5 N3 O2 -","- C5 H5 N3 O2 -","- C20 H20 N12 O8 -","4","1","FG1125","A. J. Dobson; R. E. Gerkin","3-Aminopyrazine-2-carboxylic Acid","Acta Crystallographica Section C","1996","52","6","1512","1514","10.1107/S0108270195016416","","","0.71073","MoKα","","","0.045","","","0.053","","","","","1.8","1.8","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004981","10.454","0.002","5.507","0.002","18","0.002","90","","99.9","0.01","90","","1020.8","0.4","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Alpha-fluorene-4-carboxylic acid","","","- C14 H10 O2 -","- C14 H10 O2 -","- C56 H40 O8 -","4","1","FG1130","Blackburn, A. C.; Dobson, A. J.; Gerkin, R. E.","Two <i>P</i>2~1~/<i>n</i> Monoclinic Phases of Fluorene-4-carboxylic Acid at 296K","Acta Crystallographica Section C","1996","52","6","1482","1486","10.1107/S0108270195016179","","","0.71073","MoKα","","","0.048","","","0.037","","","","","1.9","1.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004982","9.308","0.002","12.464","0.002","17.833","0.002","90","","95.29","0.01","90","","2060.1","0.6","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Beta-fluorene-4-carboxylic acid","","","- C14 H10 O2 -","- C14 H10 O2 -","- C112 H80 O16 -","8","2","FG1130","Blackburn, A. C.; Dobson, A. J.; Gerkin, R. E.","Two <i>P</i>2~1~/<i>n</i> Monoclinic Phases of Fluorene-4-carboxylic Acid at 296K","Acta Crystallographica Section C","1996","52","6","1482","1486","10.1107/S0108270195016179","","","0.71073","MoKα","","","0.045","","","0.047","","","","","1.5","1.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004983","12.129","0.001","11.116","0.001","9.716","0.001","90","","93.95","0.01","90","","1306.9","0.2","298","","298","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","(Author's name) catena-Poly[(μ2-O,μ-N'(di-2-pyridyl ketone)-N,O)μ2-O,μ-N(di-2- pyridyl ketone)-N',O]silver(I) tetrafluoroborate","","- C11 H8 Ag B F4 N2 O -","- C11 H8 Ag B F8 N2 O -","- C44 H32 Ag4 B4 F32 N8 O4 -","4","0.5","FG1132","Sommerer, S. O.; Westcott, B. L.; Jircitano, A. J.; Abboud, K. A.","<i>catena</i>-Poly[silver-μ-(di-2-pyridyl ketone)-<i>N</i>,<i>O</i>:<i>N</i>',<i>O</i>] Tetrafluoroborate","Acta Crystallographica Section C","1996","52","6","1426","1428","10.1107/S0108270196001503","","","0.71073","MoKα","","0.0598","0.0456","","0.0671","0.0584","","","","","2.06","2.06","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004984","16.139","0.001","5.117","0.001","26.887","0.002","90","","90","","90","","2220.4","0.5","296","","296","","","","","","","","","3","P n a 21","P 2c -2n","33","Xanthene-9-carboxylic acid","","","- C14 H10 O3 -","- C14 H10 O3 -","- C112 H80 O24 -","8","2","FG1134","Blackburn, A. C.; Dobson, A. J.; Gerkin, R. E.","Xanthene-9-carboxylic Acid","Acta Crystallographica Section C","1996","52","6","1486","1488","10.1107/S0108270195016167","","","0.71073","MoKα","","","0.058","","","0.046","","","","","1.32","1.32","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004985","3.809","0.001","19.911","0.002","13.206","0.002","90","","91.28","0.01","90","","1001.3","0.3","296","1","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H8 O3 -","- C14 H8 O3 -","- C56 H32 O12 -","4","1","FG1139","Coté, M. L.; Lalancette, R. A.; Thompson, H. W.","1-Carboxyfluorenone: an Intramolecularly Hydrogen-Bonded γ-Keto Acid","Acta Crystallographica Section C","1996","52","6","1535","1537","10.1107/S0108270195016155","","","0.71073","MoKα","","0.129","0.047","","0.117","0.091","","","","0.75","1.02","1.02","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004986","8.031","0.002","10.583","0.002","14.655","0.004","90","","96.25","0.03","90","","1238.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Pt(MeIm)~4~](ClO~4~)~2~","Tetrakis(1-methylimidazole)platinum(II) Perchlorate","","- C16 H24 Cl2 N8 O8 Pt -","- C16 H24 Cl2 N8 O8 Pt -","- C32 H48 Cl4 N16 O16 Pt2 -","2","0.5","FG1141","Roszak, A. W.; Clement, O.; Buncel, E.","A Monoclinic Form of Tetrakis(1-methylimidazole-<i>N</i>^3^)platinum(II) Diperchlorate","Acta Crystallographica Section C","1996","52","6","1362","1365","10.1107/S0108270196000984","","","0.71069","MoKα","","0.058","0.0313","","0.0995","0.0847","","","","1.052","1.14","1.14","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004987","12.214","0.003","3.0371","0.0009","5.7981","0.0009","90","","103.83","0.02","90","","208.85","0.09","273.2","","273","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","","","- Ga2 O3 -","- Ga2 O3 -","- Ga8 O12 -","4","0.5","FG1144","Åhman, J.; Svensson, G.; Albertsson, J.","A Reinvestigation of β-Gallium Oxide","Acta Crystallographica Section C","1996","52","6","1336","1338","10.1107/S0108270195016404","","","0.7107","MoKα","","","0.022","","","0.032","","","","","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004988","14.204","0.002","16.381","0.003","11.878","0.002","96.13","0.01","92.42","0.01","64.94","0.01","2489.2","0.7","294.2","","294.2","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H30 Cl3.86 O0.14 P2 Re -","- C36 H30 Cl4 O0.666667 P2 Re -","- C108 H90 Cl12 O2 P6 Re3 -","3","1.5","FG1149","Luo, H.; Orvig, C.; Rettig, S. J.","<i>trans</i>-Tetrachlorobis(triphenylphosphine-<i>P</i>)rhenium(IV)‒<i>mer</i>-<i>trans</i>-Trichlorooxobis(triphenylphosphine-<i>P</i>)rhenium(V) (0.86/0.14)","Acta Crystallographica Section C","1996","52","6","1377","1380","10.1107/S0108270196001710","","","0.71069","MoKα","","","0.032","","","0.025","","","","","1.24","1.24","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004989","11.105","0.002","8.978","0.002","17.219","0.001","90","","90.13","0.01","90","","1716.7","0.5","296","","296","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C19 H20 Cl N3 -","- C19 H20 Cl N3 -","- C76 H80 Cl4 N12 -","4","1","FG1153","Parvez, M.; Sabir, A. P.","Clemizole","Acta Crystallographica Section C","1996","52","6","1572","1574","10.1107/S0108270196000819","","","0.71069","MoKα","","","0.0473","","","0.0472","","","","","2.825","2.825","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004990","9.45","0.002","12.383","0.003","14.453","0.002","90","","90","","90","","1691.3","0.6","294.2","","294.2","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C14 H26 O2 Si W -","- C14 H26 O2 Si W -","- C56 H104 O8 Si4 W4 -","4","0.5","FG1161","Legzdins, P.; Rettig, S. J.; Sayers, S. F.","Dioxo(η^5^-pentamethylcyclopentadienyl)(trimethylsilylmethyl)tungsten(VI)","Acta Crystallographica Section C","1996","52","6","1355","1357","10.1107/S0108270196001217","","","0.71069","MoKα","","0.0962","0.0284","","0.0313","0.0257","","","","","1.267","1.267","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004991","8.744","0.002","11.087","0.002","14.511","0.003","106.16","0.02","102.98","0.02","75.31","0.02","1288.9","0.5","295","","295","","","","","","","","","4","P -1","-P 1","2","","2-(4-nitrophenyl)-6[4-(6-acrylyloxy-hexyloxy)-benzoyloxy]benzoxazole","","- C29 H26 N2 O8 -","- C29 H26 N2 O8 -","- C58 H52 N4 O16 -","2","1","HA1148","Centore, R.; Ciajolo, M. R.; Tuzi, A.","Two Mesogenic Nitrobenzoxazoles","Acta Crystallographica Section C","1996","52","6","1499","1503","10.1107/S0108270195014314","","","1.54178","CuKα","","0.1","0.049","","","0.064","","","","","1.758","1.758","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2004992","11.477","0.001","15.123","0.002","17.242","0.002","105.78","0.01","99.22","0.01","107.83","0.01","2642.9","0.6","295","","295","","","","","","","","","4","P -1","-P 1","2","","2-[4-(6-acrylyloxy-hexyloxy)-benzoyloxy]phenyl-6-nitrobenzoxazole","","- C29 H26 N2 O8 -","- C29 H26 N2 O8 -","- C116 H104 N8 O32 -","4","2","HA1148","Centore, R.; Ciajolo, M. R.; Tuzi, A.","Two Mesogenic Nitrobenzoxazoles","Acta Crystallographica Section C","1996","52","6","1499","1503","10.1107/S0108270195014314","","","1.54178","CuKα","","0.211","0.069","","","0.093","","","","","2.505","2.505","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2004993","7.392","0.001","9.888","0.002","10.814","0.002","90","","99.59","0.03","90","","779.4","0.2","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","3-nitroacetophenone","1-(3-nitrophenyl)-ethanone","","- C8 H7 N O3 -","- C8 H7 N O3 -","- C32 H28 N4 O12 -","4","1","HA1154","Feeder, N.; Jones, W.; Chorlton, A. P.; Docherty, R.","3-Nitroacetophenone","Acta Crystallographica Section C","1996","52","6","1454","1456","10.1107/S0108270195015939","","","0.71073","MoKα","","0.2084","0.0613","","0.2315","0.1592","","","","1.003","1.207","1.207","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004994","7.022","0.002","9.532","0.002","15.811","0.009","90","","99.03","0.03","90","","1045.2","0.7","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-phthalimidoperpropanoic acid","1,3-dihydro-1,3-dioxo-2H-isoindole-2-propaneperoxoic acid","","- C11 H9 N O5 -","- C11 H8 N O5 -","- C44 H32 N4 O20 -","4","1","HA1155","Feeder, N.; Jones, W.","Four ω-Phthalimidoaliphatic Peracids","Acta Crystallographica Section C","1996","52","6","1516","1520","10.1107/S010827019501701X","","","0.71069","MoKα","","0.1976","0.0707","","0.2769","0.1978","","","","1.001","1.24","1.24","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004995","7.968","0.002","8.463","0.002","9.4295","0.001","85.473","0.01","113.31","0.02","105.37","0.02","562.8","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","4-phthalimidoperbutanoic acid","1,3-dihydro-1,3-dioxo-2H-isoindole-2-butaneperoxoic acid","","- C12 H11 N O5 -","- C12 H10 N O5 -","- C24 H20 N2 O10 -","2","1","HA1155","Feeder, N.; Jones, W.","Four ω-Phthalimidoaliphatic Peracids","Acta Crystallographica Section C","1996","52","6","1516","1520","10.1107/S010827019501701X","","","0.71069","MoKα","","0.0975","0.0439","","0.1378","0.1121","","","","1","1.088","1.088","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004996","6.7773","0.001","4.7222","0.001","19.935","0.004","90","","98.22","0.02","90","","631.4","0.2","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","5-phthalimidoperpentanoic acid","1,3-dihydro-1,3-dioxo-2H-isoindole-2-pentaneperoxoic acid","","- C13 H13 N O5 -","- C13 H12 N O5 -","- C26 H24 N2 O10 -","2","1","HA1155","Feeder, N.; Jones, W.","Four ω-Phthalimidoaliphatic Peracids","Acta Crystallographica Section C","1996","52","6","1516","1520","10.1107/S010827019501701X","","","0.71069","MoKα","","0.1621","0.0611","","0.202","0.1526","","","","1.014","1.144","1.144","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004997","19.028","0.005","4.5724","0.001","15.517","0.006","90","","90.16","0.03","90","","1350","0.7","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","6-phthalimidoperhexanoic acid","1,3-dihydro-1,3-dioxo-2H-isoindole-2-hexaneperoxoic acid","","- C14 H15 N O5 -","- C14 H14 N O5 -","- C56 H56 N4 O20 -","4","1","HA1155","Feeder, N.; Jones, W.","Four ω-Phthalimidoaliphatic Peracids","Acta Crystallographica Section C","1996","52","6","1516","1520","10.1107/S010827019501701X","","","0.71069","MoKα","","0.214","0.0497","","0.16","0.1055","","","","0.914","1.113","1.113","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2004998","9.681","0.005","5.301","0.003","13.956","0.006","90","","96.16","0.04","90","","712.1","0.6","153","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-isoleucine","","- C6 H13 N O2 -","- C6 H13 N O2 -","- C24 H52 N4 O8 -","4","2","HA1156","Görbitz, Carl Henrik; Dalhus, Bjørn","L-Isoleucine, Redetermination at 120 K","Acta Crystallographica Section C","1996","52","6","1464","1466","10.1107/S0108270195016386","","","0.71069","MoKα","","0.0717","0.0524","","0.1316","0.1223","","","","1.009","1.065","1.065","","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"2004999","8.696","0.003","10.421","0.004","17.113","0.008","76.63","0.05","87.31","0.06","72.23","0.05","1436.3","1.1","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C30 H38 N4 O4 P Rh -","- C30 H38 N4 O4 P Rh -","- C60 H76 N8 O8 P2 Rh2 -","2","1","HR1052","Kettmann, V.; Dunaj-Jurčo, M.; Steinborn, D.; Ludwig, M.","<i>tert</i>-Butylbis(dimethylglyoximato-<i>N</i>,<i>N</i>')(triphenylphosphine-<i>P</i>)rhodium","Acta Crystallographica Section C","1996","52","6","1399","1401","10.1107/S0108270195010912","","","0.71073","MoKα","","","0.055","","","0.068","","","","","1.27","1.27","","","","","has coordinates","190596","2020-10-21","18:00:00",""
"2005000","7.442","0.003","10.255","0.005","16.128","0.008","90","","90.92","0.05","90","","1230.7","1","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 N2 O3 S -","- C13 H14 N2 O3 S -","- C52 H56 N8 O12 S4 -","4","1","JZ1026","Kettmann, V.; Svetlik, J.","Methyl 9-Methyl-11-thioxo-8-oxa-10,12-diazatricyclo[7.3.1.0^2,7^]trideca-2,4,6-triene-13-carboxylate","Acta Crystallographica Section C","1996","52","6","1496","1499","10.1107/S0108270195008924","","","0.71073","MoKα","","","0.057","","","0.065","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005001","8.233","0.002","10.953","0.002","11.636","0.007","63.85","0.03","80.76","0.02","84.79","0.02","929.4","0.7","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H12 Cl6 Cu N4 S2 -","- C8 H12 Cl6 Cu N4 S2 -","- C16 H24 Cl12 Cu2 N8 S4 -","2","1","JZ1065","Fernández, V.; Doadrio, J. C.; García-Granda, S.; Pertierra, P.","Bis(2-amino-4-chloromethylthiazolium) Tetrachlorocuprate at 200 and 100K and Bis(2-amino-4-methylthiazolium) Tetrachlorocuprate at 100K","Acta Crystallographica Section C","1996","52","6","1412","1415","10.1107/S010827019501225X","","","0.71073","MoKα","","0.0624","0.0426","","0.1324","0.1269","","","","1.126","1.247","1.247","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005002","8.168","0.002","10.919","0.004","11.437","0.008","64.24","0.05","80.03","0.03","84.72","0.03","904.6","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H12 Cl6 Cu N4 S2 -","- C8 H12 Cl6 Cu N4 S2 -","- C16 H24 Cl12 Cu2 N8 S4 -","2","1","JZ1065","Fernández, V.; Doadrio, J. C.; García-Granda, S.; Pertierra, P.","Bis(2-amino-4-chloromethylthiazolium) Tetrachlorocuprate at 200 and 100K and Bis(2-amino-4-methylthiazolium) Tetrachlorocuprate at 100K","Acta Crystallographica Section C","1996","52","6","1412","1415","10.1107/S010827019501225X","","","0.71073","MoKα","","0.0355","0.0283","","0.0816","0.0797","","","","1.032","1.087","1.087","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005003","7.75","0.003","8.474","0.003","13.683","0.007","104.49","0.04","100.02","0.03","102.83","0.03","822.8","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H14 Cl4 Cu N4 S2 -","- C8 H14 Cl4 Cu N4 S2 -","- C16 H28 Cl8 Cu2 N8 S4 -","2","1","JZ1065","Fernández, V.; Doadrio, J. C.; García-Granda, S.; Pertierra, P.","Bis(2-amino-4-chloromethylthiazolium) Tetrachlorocuprate at 200 and 100K and Bis(2-amino-4-methylthiazolium) Tetrachlorocuprate at 100K","Acta Crystallographica Section C","1996","52","6","1412","1415","10.1107/S010827019501225X","","","0.71073","MoKα","","0.0404","0.0284","","0.0774","0.0758","","","","1.03","1.128","1.128","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005004","7.7451","0.0007","7.7451","0.0007","5.6351","0.0006","90","","90","","90","","338.03","0.06","295","2","","","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","","","","- Bi7.5 O12 Y0.5 -","- Bi8 O12 -","- Bi8 O12 -","1","0.0625","JZ1066","Ducke, J.; Trömel, M.; Hohlwein, D.; Kizler, P.","Yttrium and Titanium Bismuthates with Structures Related to β-Bi~2~O~3~","Acta Crystallographica Section C","1996","52","6","1329","1331","10.1107/S0108270195011267","","neutron","1.2167","neutron","","","0.041","","","","","","","","","","","","","","has coordinates","209442","2020-10-21","18:00:00",""
"2005005","7.7069","0.0006","7.7069","0.0006","5.6735","0.0004","90","","90","","90","","336.98","0.04","295","2","","","","","","","","","","3","P 42/n m c","","","","","","- Bi7.68 O12.16 Ti0.32 -","- Bi8 O12.16 -","- Bi8 O12.16 -","1","","JZ1066","Ducke, J.; Trömel, M.; Hohlwein, D.; Kizler, P.","Yttrium and Titanium Bismuthates with Structures Related to β-Bi~2~O~3~","Acta Crystallographica Section C","1996","52","6","1329","1331","10.1107/S0108270195011267","","neutron","1.2167","neutron","","","0.043","","","","","","","","","","","","","","has coordinates","208743","2020-10-21","18:00:00",""
"2005006","10.456","0.002","12.237","0.002","9.531","0.001","90","","111","0.01","90","","1138.5","0.3","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2R^*^,4S^*^,6S^*^)-4-chloro-4-methyl-8-oxo-1-azabicyclo[4.2.0]octane -2-carboxylic acid methyl ester","","- C10 H14 Cl N O3 -","- C10 H14 Cl N O3 -","- C40 H56 Cl4 N4 O12 -","4","1","JZ1068","De Ridder, D. J. A.; Goubitz, K.; Reiss, C. A.; Schenk, H.; Hiemstra, H.","One Bicyclic β-Lactam and Two Bicyclic γ-Lactam Compounds","Acta Crystallographica Section C","1996","52","6","1473","1479","10.1107/S0108270195014788","","","0.71069","MoKα","","0.049","0.049","","0.049","0.049","","","","0.87","0.87","0.87","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005007","9.732","0.002","13.903","0.003","9.116","0.002","90","","99.99","0.01","90","","1214.7","0.5","293","","293","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","(5R^*^,7S^*^,9S^*^)-7-chloro-7-methyl-3-oxo-octahydro-indolizidine-5- carboxylic acid methyl ester","","- C11 H16 Cl N O3 -","- C11 H16 Cl N O3 -","- C44 H64 Cl4 N4 O12 -","4","1","JZ1068","De Ridder, D. J. A.; Goubitz, K.; Reiss, C. A.; Schenk, H.; Hiemstra, H.","One Bicyclic β-Lactam and Two Bicyclic γ-Lactam Compounds","Acta Crystallographica Section C","1996","52","6","1473","1479","10.1107/S0108270195014788","","","0.71069","MoKα","","0.048","0.048","","0.047","0.047","","","","0.783","0.783","0.783","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005008","10.5793","0.0005","13.524","0.0008","10.4365","0.0006","90","","118.305","0.005","90","","1314.66","0.14","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(5R^*^,6S^*^,10R^*^)-3oxo-6-vinyl-oactahydro-pyrrolo[1,2-a]azepine-5- carboxylic acid methyl ester","","- C13 H19 N O3 -","- C13 H19 N O3 -","- C52 H76 N4 O12 -","4","1","JZ1068","De Ridder, D. J. A.; Goubitz, K.; Reiss, C. A.; Schenk, H.; Hiemstra, H.","One Bicyclic β-Lactam and Two Bicyclic γ-Lactam Compounds","Acta Crystallographica Section C","1996","52","6","1473","1479","10.1107/S0108270195014788","","","1.5418","CuKα","","0.047","0.047","","0.042","0.042","","","","0.643","0.643","0.643","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005009","7.418","0.001","10.814","0.002","14.039","0.002","105.4","0.01","90.26","0.01","109.97","0.01","1014.8","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Mer-(2'-benzoylisopropylidene-1-naphthohydrazido)-methanol-cis-dioxo- molybdenum(VI)","","- C22 H20 Mo N2 O5 -","- C22 H20 Mo N2 O5 -","- C44 H40 Mo2 N4 O10 -","2","1","JZ1096","Prelesnik, B.; Ivanovic, I.; Leovac, V. M.; Andjelkovic, K.","<i>mer</i>-[2'-(2-Benzoyl-1-methylethylidene)-1-naphthohydrazido(2‒)](methanol)-<i>cis</i>-dioxo-molybdenum(VI)","Acta Crystallographica Section C","1996","52","6","1375","1377","10.1107/S010827019600039X","","","0.71069","MoKα","","","0.03","","","0.035","","","","","0.88","0.88","","","","","has coordinates","192027","2020-10-21","18:00:00",""
"2005010","11.533","0.003","20.585","0.006","12.217","0.002","90","","97.2","0.02","90","","2877.5","1.2","213","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H102 Li4 O2 P4 -","- C46 H102 Li4 O2 P4 -","- C92 H204 Li8 O4 P8 -","2","0.5","JZ1099","Rabe, G. W.; Riede, J.; Schier, A.","[Li~2~(μ~3~-^<i>t^</i>Bu~2~ P)(μ~2~-^<i>t^</i>Bu~2~P)(thf)]~2~: a Redetermination","Acta Crystallographica Section C","1996","52","6","1350","1352","10.1107/S0108270195017094","","","0.71073","MoKα","","","0.0552","","","0.1216","","","","","1.004","1.004","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005011","6.086","0.001","11.99","0.001","23.831","0.002","90","","90","","90","","1739","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3β-hydroxy-20methyl-pregn-5,14-dien-16-on(18‒20) lactone","","","- C21 H26 O4 -","- C21 H26 O4 -","- C84 H104 O16 -","4","1","JZ1101","Luger, P.; Weber, M.; Dung, N. X.; Ky, P. T.; The, C. L.","The New Pentacyclic Saponine Ecdysantherin [3β-Hydroxy-20-methylpregn-5,14-dien-16-one-(18‒20)-lactone] from <i>Ecdysanthera rosea Hook</i>. <i>et Arn</i>. (<i>Apocynaceae</i>) of Vietnam","Acta Crystallographica Section C","1996","52","6","1574","1576","10.1107/S0108270195017045","","","1.5418","CuKα,Nifilter","","0.0909","0.0436","","0.1323","0.1081","","","","1.052","1.103","1.103","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005012","10.166","0.001","12.206","0.001","20.873","0.002","90","","102.2","0.01","90","","2531.6","0.4","223","2","223","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,3-Dicyclohexyl-2,4-bis(cyclohexylimino)1,3-diazetidine","","- C26 H44 N4 -","- C26 H44 N4 -","- C104 H176 N16 -","4","1","JZ1103","Goj, O.; Haufe, G.; Fröhlich, R.","1,3-Dicyclohexyl-2,4-bis(cyclohexylimino)-1,3-diazetidine: Dimer of Dicyclohexylcarbodiimide","Acta Crystallographica Section C","1996","52","6","1554","1556","10.1107/S0108270196000522","","","1.54178","CuKα","","0.0634","0.0505","","0.1557","0.1509","","","","1.057","1.154","1.154","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005013","6.73","0.003","12.887","0.003","8.274","0.002","90","","107.26","0.02","90","","685.3","0.4","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 Cu N2 O8 -","- C14 H8 Cu N2 O8 -","- C28 H16 Cu2 N4 O16 -","2","0.5","JZ1106","Suga, T.; Okabe, N.","Bis(pyridine-2,3-dicarboxylato-<i>N</i>,<i>O</i>)copper(II)","Acta Crystallographica Section C","1996","52","6","1410","1412","10.1107/S0108270196001126","","","0.71069","MoKα","","","0.041","","","0.051","","","","","1.56","1.56","","","","","has coordinates","198397","2020-10-21","18:00:00",""
"2005014","11.871","0.002","11.586","0.003","5.707","0.002","90","","98.75","0.02","90","","775.8","0.4","293","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 Cl2 Cr2 N2 O6 -","- C10 H10 Cl2 Cr2 N2 O6 -","- C20 H20 Cl4 Cr4 N4 O12 -","2","0.5","KA1153","Lorenzo Luis, P. A.; Martin-Zarza, P.; Gili, P.; Ruiz-Pérez, C.; Hernández-Molina, M.; Solans, X.","Five New Chlorochromates of Organic Bases","Acta Crystallographica Section C","1996","52","6","1441","1448","10.1107/S0108270196000637","","","0.71073","MoKα","","","0.052","","","0.058","","","","","1.32","1.32","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005015","9.685","0.002","11.679","0.002","11.022","0.002","90","","112.28","0.03","90","","1153.6","0.4","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Cl Cr N O3 -","- C10 H10 Cl Cr N O3 -","- C40 H40 Cl4 Cr4 N4 O12 -","4","1","KA1153","Lorenzo Luis, P. A.; Martin-Zarza, P.; Gili, P.; Ruiz-Pérez, C.; Hernández-Molina, M.; Solans, X.","Five New Chlorochromates of Organic Bases","Acta Crystallographica Section C","1996","52","6","1441","1448","10.1107/S0108270196000637","","","0.71073","MoKα","","","0.0708","","","0.1986","","","","","1.082","1.082","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005016","6.748","0.005","7.957","0.005","11.611","0.002","104.89","0.01","100.34","0.03","92.11","0.03","590.5","0.6","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C10 H10 Cl Cr N O3 -","- C10 H10 Cl Cr N O3 -","- C20 H20 Cl2 Cr2 N2 O6 -","2","1","KA1153","Lorenzo Luis, P. A.; Martin-Zarza, P.; Gili, P.; Ruiz-Pérez, C.; Hernández-Molina, M.; Solans, X.","Five New Chlorochromates of Organic Bases","Acta Crystallographica Section C","1996","52","6","1441","1448","10.1107/S0108270196000637","","","0.71073","MoKα","","","0.0601","","","0.1578","","","","","1.341","1.341","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005017","12.157","0.002","12.265","0.003","6.316","0.002","90","","114.5","0.03","90","","857","0.4","293","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C2 H10 Cl2 Cr N2 O3 -","- C2 H10 Cl2 Cr N2 O3 -","- C8 H40 Cl8 Cr4 N8 O12 -","4","1","KA1153","Lorenzo Luis, P. A.; Martin-Zarza, P.; Gili, P.; Ruiz-Pérez, C.; Hernández-Molina, M.; Solans, X.","Five New Chlorochromates of Organic Bases","Acta Crystallographica Section C","1996","52","6","1441","1448","10.1107/S0108270196000637","","","0.71073","MoKα","","","0.07","","","0.086","","","","","1.138","1.138","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2005018","6.396","0.002","10.915","0.005","19.192","0.005","90","","92.83","0.03","90","","1338.2","0.8","293","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H9 Cl2 Cr N3 O3 -","- C10 H7 Cl2 Cr N3 O3 -","- C40 H28 Cl8 Cr4 N12 O12 -","4","1","KA1153","Lorenzo Luis, P. A.; Martin-Zarza, P.; Gili, P.; Ruiz-Pérez, C.; Hernández-Molina, M.; Solans, X.","Five New Chlorochromates of Organic Bases","Acta Crystallographica Section C","1996","52","6","1441","1448","10.1107/S0108270196000637","","","0.71073","MoKα","","","0.056","","","0.073","","","","","1.164","1.164","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005019","11.194","0.002","10.492","0.002","6.976","0.002","94.62","0.02","97.78","0.02","102.54","0.02","787.3","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","sodium [1,3-propanodiylbis(oximato)cupprate(II)] hexahydrate","","- C7 H18 Cu N2 Na2 O12 -","- C7 H18 Cu N2 Na2 O12 -","- C14 H36 Cu2 N4 Na4 O24 -","2","1","KA1157","Rodríguez-Romero, F. V.; Ruiz-Pérez, C.; Solans, X.","Disodium [<i>N</i>,<i>N</i>'-(1,3-Propanediyl)bis(oxamato-<i>N</i>,<i>O</i>)]cuprate(II) Hexahydrate","Acta Crystallographica Section C","1996","52","6","1415","1417","10.1107/S010827019600114X","","","0.71069","MoKα","","","0.0719","","0.1872","0.0774","","","","1.076","0.948","0.948","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2005020","10.749","0.006","13.068","0.005","22.643","0.009","90","","90","","90","","3181","2","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C37 H40 N2 O6 -","- C38 H43 N2 O7 -","- C152 H172 N8 O28 -","4","1","KA1162","Sivý, J.; Kettmann, V.; Kostálová, D.; Vrábel, V.","Oxyacanthine","Acta Crystallographica Section C","1996","52","6","1479","1482","10.1107/S0108270195015927","","","0.71073","MoKα","","","0.053","","0.1077","0.055","","","","1.228","0.86","0.86","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005021","11.354","0.005","11.354","0.005","11.354","0.005","107.21","0.05","107.21","0.05","107.21","0.05","1211.9","1.3","293","2","293","2","","","","","","","","3","R -3 :R","-P 3*","148","3,7,10-tribenzyl-3,7,10-triaza[3.3.3]propellane","","","- C29 H33 N3 -","- C29 H33 N3 -","- C58 H66 N6 -","2","0.333333","KA1166","Herbstein, F. H.; Kapon, M.; Reisner, G. M.","Comparison of the Geometries of 3,7,10-Tribenzyl-3,7,10-triaza[3.3.3]propellane, (1), 7,10-Dibenzyl-3-<i>p</i>-tolyl-3,7,10-triaza[3.3.3]propellane, (2), and 7,10-Dibenzyl-3-oxa-7,10-diaza[3.3.3]propellane, (3)","Acta Crystallographica Section C","1996","52","6","1539","1543","10.1107/S0108270195016039","","","0.71069","MoKα","","0.085","0.0544","","0.1357","0.1153","","","","1.131","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005022","13.283","0.007","11.748","0.006","8.533","0.004","103.94","0.05","96.87","0.05","104.87","0.05","1225.5","1.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","3-p-tolyl-7,10-dibenzyl3,7,10-triaza[3.3.3]propellane","","","- C29 H33 N3 -","- C29 H33 N3 -","- C58 H66 N6 -","2","1","KA1166","Herbstein, F. H.; Kapon, M.; Reisner, G. M.","Comparison of the Geometries of 3,7,10-Tribenzyl-3,7,10-triaza[3.3.3]propellane, (1), 7,10-Dibenzyl-3-<i>p</i>-tolyl-3,7,10-triaza[3.3.3]propellane, (2), and 7,10-Dibenzyl-3-oxa-7,10-diaza[3.3.3]propellane, (3)","Acta Crystallographica Section C","1996","52","6","1539","1543","10.1107/S0108270195016039","","","0.71069","MoKα","","0.0982","0.061","","0.1365","0.1159","","","","1.081","1.184","1.184","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005023","35.656","0.02","9.652","0.005","11.018","0.006","90","","90","","90","","3792","4","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","3-oxa-7,10-dibenzyl-7,10-triaza[3.3.3]propellane","","","- C22 H26 N2 O -","- C22 H26 N2 O -","- C176 H208 N16 O8 -","8","1","KA1166","Herbstein, F. H.; Kapon, M.; Reisner, G. M.","Comparison of the Geometries of 3,7,10-Tribenzyl-3,7,10-triaza[3.3.3]propellane, (1), 7,10-Dibenzyl-3-<i>p</i>-tolyl-3,7,10-triaza[3.3.3]propellane, (2), and 7,10-Dibenzyl-3-oxa-7,10-diaza[3.3.3]propellane, (3)","Acta Crystallographica Section C","1996","52","6","1539","1543","10.1107/S0108270195016039","","","0.71069","MoKα","","0.1679","0.0702","","0.1691","0.1271","","","","0.982","1.22","1.22","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005024","9.761","0.002","12.422","0.002","12.486","0.002","108.27","0.01","101.26","0.02","100.02","0.02","1364.2","0.5","298","","298","","","","","","","","","6","P -1","-P 1","2","","(N,N-Dimethyldithiocarbamoylacetato)trimethyltin","","- C8 H17 N O2 S2 Sn -","- C8 H17 N O2 S2 Sn -","- C32 H68 N4 O8 S8 Sn4 -","4","2","KH1073","Ng, S. W.; Kumar Das, V. G.","[(<i>N</i>,<i>N</i>-Dimethylthiocarbamoylthio)acetato]trimethyltin","Acta Crystallographica Section C","1996","52","6","1371","1373","10.1107/S0108270196001874","","","0.71073","MoKα","","0.0486","0.0385","","0.0991","0.0928","","","","1.095","1.134","1.134","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005025","9.17","0.001","16.135","0.0009","17.697","0.002","90","","96.98","0.006","90","","2599","0.4","300","","300","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(3-diethylphosphonopropionato)triphenyltin","","- C25 H29 O5 P Sn -","- C25 H29 O5 P Sn -","- C100 H116 O20 P4 Sn4 -","4","1","KH1075","Ng, S. W.; Kumar Das, V. G.","[3-(Diethylphosphono)propionato]triphenyltin","Acta Crystallographica Section C","1996","52","6","1373","1375","10.1107/S0108270196001886","","","0.71073","MoKα","","0.0545","0.0355","","0.0827","0.0767","","","","0.971","1.06","1.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005026","34.086","0.005","10.0389","0.0009","23.778","0.004","90","","110.114","0.006","90","","7640.3","1.9","300","2","300","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","2-triphenylstannyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide triphenylphosphine oxide","","- C43 H34 N O4 P S Sn -","- C43 H34 N O4 P S Sn -","- C344 H272 N8 O32 P8 S8 Sn8 -","8","1","KH1076","Ng, S. W.","2-Triphenylstannyl-1,2-benzisothiazol-3(2<i>H</i>)-one 1,1-Dioxide‒Triphenylphosphine Oxide (1/1)","Acta Crystallographica Section C","1996","52","6","1365","1367","10.1107/S0108270196001898","","","0.71073","MoKα","","0.0768","0.0485","","0.1178","0.1078","","","","1.018","1.143","1.143","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005027","9.1876","0.0006","9.593","0.001","11.0473","0.0007","78.839","0.008","65.036","0.005","86.203","0.009","865.88","0.13","300","2","300","2","","","","","","","","6","P -1","-P 1","2","","butyldiichlorophenyltin.1,2-(diphenylphosphoryl)ehtane","","- C36 H38 Cl2 O2 P2 Sn -","- C36 H38 Cl2 O2 P2 Sn -","- C36 H38 Cl2 O2 P2 Sn -","1","0.5","KH1077","Ng, S. W.; Kumar Das, V. G.","Butyldichlorophenyltin‒1,2-Bis(diphenylphosphoryl)ethane (1/1)","Acta Crystallographica Section C","1996","52","6","1367","1369","10.1107/S0108270196001904","","","0.71073","MoKα","","0.0536","0.0407","","0.1091","0.1006","","","","1.063","1.114","1.114","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005028","9.482","0.002","17.146","0.003","16.931","0.004","90","","98.72","0.02","90","","2720.8","1","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-iso-propylammonium triphenylstannylthiolyacetate","","- C26 H33 N O2 S Sn -","- C26 H33 N O2 S Sn -","- C104 H132 N4 O8 S4 Sn4 -","4","1","KH1078","Ng, S. W.; Kumar Das, V. G.; Yap, G.; Rheingold, A. L.","Diisopropylammonium (Mercaptoacetato-<i>S</i>,<i>O</i>)triphenylstannate","Acta Crystallographica Section C","1996","52","6","1369","1371","10.1107/S0108270196001916","","","0.71073","MoKα","","0.055","0.0351","","0.0834","0.0745","","","","1.02","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005029","21.9","0.007","6.368","0.002","8.939","0.002","90","","93.51","0.02","90","","1244.3","0.6","293","2","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C28 H40 O3 -","- C28 H40 O3 -","- C56 H80 O6 -","2","1","KH1087","Honda, T.; Fujii, I.; Hirayama, N.; Ishikawa, D.; Kawagishi, H.; Song, K.-S.; Yoo, I.-D.","(14α,22<i>E</i>)-14-Hydroxyergosta-4,7,22-triene-3,6-dione, C~28~H~40~O~3~","Acta Crystallographica Section C","1996","52","6","1550","1552","10.1107/S0108270196000030","","","1.54184","CuKα","","","0.039","","","0.047","","","","","2.3","2.3","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005030","10.538","0.001","8.895","0.001","16.031","0.001","90","","102.742","0.009","90","","1465.7","0.2","293","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C14 H23 N O3 -","- C14 H23 N O3 -","- C56 H92 N4 O12 -","4","1","LI1142","Zukerman-Schpector, J.; Caracelli, I.; de Oliveira, S. Ma.; Faria de Medeiros, E.; Brocksom, T. J.","A Key Intermediate in the Synthesis of (+)-Hernandulcin","Acta Crystallographica Section C","1996","52","6","1579","1581","10.1107/S010827019600008X","","","0.71073","MoKα","","0.1881","0.0535","","0.1715","0.1048","","","","1.127","1.154","1.154","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005031","8.37","0.003","8.8948","0.0014","23.441","0.004","90","","90","","90","","1745.2","0.7","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Tris(η^5^-cyclopentadienyl)phenolatoneptunium(IV)","","- C21 H20 Np O -","- C21 H20 Np O -","- C84 H80 Np4 O4 -","4","1","MU1209","De Ridder, D. J. A.; Apostolidis, C.; Rebizant, J.; Kanellakopulos, B.; Maier, R.","Tris(η^5^-cyclopentadienyl)phenolatoneptunium(IV)","Acta Crystallographica Section C","1996","52","6","1436","1438","10.1107/S0108270195014582","","","0.71073","MoKα","","0.0334","0.033","","0.077","0.0765","","","","0.978","0.979","0.979","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005032","17.832","0.002","15.088","0.001","11.023","0.001","90","","103.26","0.01","90","","2886.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1:2 complex of 1,4,10-trioxa-7,13-diazacyclopentadecane and picric acid.","","- C22 H28 N8 O17 -","- C22 H28 N8 O17 -","- C88 H112 N32 O68 -","4","1","MU1223","Saleh, M. I.; Salhin, A.; Saad, B.; Sivakumar, K.; Fun, H.-K.","A 1:2 Host‒Guest Complex of Diaza-15-crown-5 with Picric Acid","Acta Crystallographica Section C","1996","52","6","1509","1512","10.1107/S010827019501691X","","","0.71073","MoKα","","0.0775","0.0466","","0.1343","0.1219","","","","0.981","1.149","1.149","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005033","10.52","0.001","10.89","0.001","12.854","0.001","74.62","0.01","72.55","0.01","64.7","0.01","1253.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Pentacarbonyl Tris-(2-methoxyphenyl)phosphine Chromium(0).","","- C26 H21 Cr O8 P -","- C26 H21 Cr O8 P -","- C52 H42 Cr2 O16 P2 -","2","1","MU1238","bin Shawkataly, O.; Saminathan, T.; Muniswaran, K.; Fun, H.-K.; Sivakumar, K.","Pentacarbonyl[tris(2-methoxyphenyl)phosphine-<i>P</i>]chromium and its Molybdenum Analogue","Acta Crystallographica Section C","1996","52","6","1352","1355","10.1107/S0108270196001527","","","0.71073","MoKα","","0.0374","0.0335","","0.1042","0.1016","","","","1.052","1.093","1.093","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005034","10.889","0.002","16.395","0.002","14.808","0.002","90","","92.57","0.01","90","","2640.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Pentacarbonyl tris(2-methoxyphenyl)phosphine Molybdenum(0).","","- C26 H21 Mo O8 P -","- C26 H21 Mo O8 P -","- C104 H84 Mo4 O32 P4 -","4","1","MU1238","bin Shawkataly, O.; Saminathan, T.; Muniswaran, K.; Fun, H.-K.; Sivakumar, K.","Pentacarbonyl[tris(2-methoxyphenyl)phosphine-<i>P</i>]chromium and its Molybdenum Analogue","Acta Crystallographica Section C","1996","52","6","1352","1355","10.1107/S0108270196001527","","","0.71073","MoKα","","0.0605","0.035","","0.0849","0.0781","","","","0.899","1.02","1.02","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005035","8.682","0.001","13.983","0.001","9.956","0.001","90","","96.66","0.01","90","","1200.5","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[1-hydroxy-2(1H)-pyridinethionato-O,S']palladium(II).","","- C10 H8 N2 O2 Pd S2 -","- C10 H8 N2 O2 Pd S2 -","- C40 H32 N8 O8 Pd4 S8 -","4","1","MU1242","Song, B.-L.; Xiong, R.-G.; Wang, H.; Zuo, J.-L.; You, X.-Z.; Fun, H.-K.; Sivakumar, K.","Bis[1-hydroxy-2(1<i>H</i>)-pyridinethionato-<i>O</i>,<i>S</i>]palladium(II)","Acta Crystallographica Section C","1996","52","6","1403","1405","10.1107/S0108270196001539","","","0.71073","MoKα","","0.0288","0.0257","","0.0702","0.0687","","","","1.024","1.065","1.065","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005036","7.941","0.003","12.81","0.004","13.509","0.004","90","","90.93","","90","","1374","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H11 Br2 Cu N3 -","- C12 H11 Br2 Cu N3 -","- C48 H44 Br8 Cu4 N12 -","4","1","NA1146","Garland, M. T.; Manzur, J.; Moreno, Y.; Spodine, E.; Baggio, R.; González, O.","Dibromo[<i>N</i>-(2-pyridylmethylidene)-2-pyridylmethylamine-<i>N</i>,<i>N</i>',<i>N</i>'']copper(II) Complex","Acta Crystallographica Section C","1996","52","6","1405","1407","10.1107/S0108270195017021","","","0.71073","MoKα","","0.0432","0.0301","","0.077","0.0731","","","","1.013","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005037","7.826","0.002","14.606","0.004","8.83","0.003","90","","96.58","0.02","90","","1002.7","0.5","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C6 H7 Au Cl3 N O -","- C6 H7 Au Cl3 N O -","- C24 H28 Au4 Cl12 N4 O4 -","4","1","NA1179","Bruni, B.; Ferraroni, M.; Orioli, P.; Speroni, G.","A Biologically Active Gold Complex: Trichloro[(2-pyridyl)methanol-<i>N</i>]gold(III)","Acta Crystallographica Section C","1996","52","6","1423","1424","10.1107/S0108270195008067","","","0.71073","MoKα","","","0.0515","","","0.141","","","","","1.265","1.265","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005038","19.649","0.003","19.649","0.003","10.704","0.002","90","","90","","90","","4132.6","1.2","111","2","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis[(μu3-5-methylthiophene-C2)-(diethylether-O)-lithium","","- C36 H60 Li4 O4 S4 -","- C36 H60 Li4 O4 S4 -","- C144 H240 Li16 O16 S16 -","4","0.25","NA1208","Powell, D. R.; Whipple, W. L.; Reich, H. J.","Tetrakis(μ~3~-2-methyl-5-thienyl)tetrakis(diethyl ether-<i>O</i>)-<i>tetrahedro</i>-tetralithium","Acta Crystallographica Section C","1996","52","6","1346","1348","10.1107/S0108270196000546","","","1.54184","CuKα","","","0.0727","","0.1918","0.1701","","","","1.097","1.243","1.243","","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2005039","11.059","0.002","32.367","0.006","18.933","0.003","90","","97.41","0.03","90","","6720","2","294","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H14 Fe4 O12 Se3 -","- C26 H14 Fe4 O12 Se3 -","- C208 H112 Fe32 O96 Se24 -","8","2","NA1209","Song, L.-C.; Hu, Q.-M.; Yan, C.-G.; Wang, R.-J.; Mak, T. C. W.","The First μ~4~-Se Spiro-Type Fe~4~Se~3~ Cluster: [(μ-4-CH~3~-C~6~H~4~Se)Fe~2~(CO)~6~]~2~(μ~4~-Se)","Acta Crystallographica Section C","1996","52","6","1357","1359","10.1107/S0108270196000613","","","0.71073","MoKα","","","0.06","","","0.053","","","","","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005040","14.664","0.013","7.697","0.008","5.08","0.005","90","","96.71","0.01","90","","569.4","1","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C10 H9 Cl2 Cu N3 -","- C10 H9 Cl2 Cu N3 -","- C20 H18 Cl4 Cu2 N6 -","2","0.5","NA1211","Spodine, E.; Atria, A. M.; Baggio, R.; Garland, M. T.","Dichloro(di-2-pyridylamine-<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section C","1996","52","6","1407","1410","10.1107/S0108270196000601","","","0.71073","MoKα","","0.0387","0.0377","","0.0886","0.0877","","","","1.148","1.151","1.151","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005041","9.099","0.004","9.52","0.003","16.753","0.006","102.46","0.03","92.34","0.03","102.22","0.03","1379.2","0.9","298","","298","","","","","","","","","6","P -1","-P 1","2","","disodium [4-carboxy-4,8,11-tris(carboxymethyl)-1-phenyl-2-oxa-5,8,11- triazatridecan-13-oato(5^-^)]europate(2^-^)","","- C22 H31 Eu N3 Na2 O13.5 -","- C22 H31 Eu N3 Na2 O13.5 -","- C44 H62 Eu2 N6 Na4 O27 -","2","1","NA1216","Dapporto, P.; Fedeli, F.; Paoli, P.; Uggeri, F.","Disodium Aqua[2,5,8-tris(carboxymethyl)-12-phenyl-2,5,8-triaza-11-oxa-1,9-dodecanedicarboxylato(5–)]europate Sesquihydrate","Acta Crystallographica Section C","1996","52","6","1438","1441","10.1107/S0108270196000972","","","0.71069","MoKα","","","0.066","","","0.148","","","","","1.14","1.14","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2005042","5.858","0.003","8.171","0.003","24.367","0.007","90","","90","","90","","1166.3","0.8","293","1","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1-O-benzyl-β-L-arabinopyranose","1-O-benzyl-β-L-arabinopyranose","","- C12 H16 O5 -","- C12 H16 O5 -","- C48 H64 O20 -","4","1","NS1003","Popek, T.; Mazurek, J.; Lis, T.","1-<i>O</i>-Benzyl-β-<small>L</small>-arabinopyranose, 1-<i>O</i>-Benzyl-3,4-<i>O</i>-isopropylidene-β-<small>L</small>-arabinopyranose and 1-<i>O</i>-Benzyl-2-<i>O</i>-benzoyl-3,4-<i>O</i>-isopropylidene-β-<small>L</small>-arabinopyranose","Acta Crystallographica Section C","1996","52","6","1558","1563","10.1107/S0108270195016143","","","1.5418","CuKα","","0.0426","0.0327","","0.095","0.0913","","","","1.041","1.102","1.102","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005043","12.565","0.008","5.692","0.003","10.584","0.005","90","","102.66","0.05","90","","738.6","0.7","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","1-O-benzyl-3,4-O-isopropylidene-β-L-arabinopyranose","1-O-benzyl-3,4-O-isopropylidene-β-L-arabinopyranose","","- C15 H20 O5 -","- C15 H20 O5 -","- C30 H40 O10 -","2","1","NS1003","Popek, T.; Mazurek, J.; Lis, T.","1-<i>O</i>-Benzyl-β-<small>L</small>-arabinopyranose, 1-<i>O</i>-Benzyl-3,4-<i>O</i>-isopropylidene-β-<small>L</small>-arabinopyranose and 1-<i>O</i>-Benzyl-2-<i>O</i>-benzoyl-3,4-<i>O</i>-isopropylidene-β-<small>L</small>-arabinopyranose","Acta Crystallographica Section C","1996","52","6","1558","1563","10.1107/S0108270195016143","","","1.5418","CuKα","","0.0885","0.0373","","0.0971","0.0796","","","","1.03","1.131","1.131","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005044","8.106","0.004","11.353","0.006","11.546","0.006","90","","106.83","0.04","90","","1017","0.9","290","2","290","2","","","","","","","","3","P 1 21 1","P 2yb","4","1-O-benzyl-2-O-benzoyl-3,4-O-isopropylidene-β-L-arabinopyranose","1-O-benzyl-2-O-benzoyl-3,4-O-isopropylidene-β-L-arabinopyranose","","- C22 H24 O6 -","- C22 H24 O6 -","- C44 H48 O12 -","2","1","NS1003","Popek, T.; Mazurek, J.; Lis, T.","1-<i>O</i>-Benzyl-β-<small>L</small>-arabinopyranose, 1-<i>O</i>-Benzyl-3,4-<i>O</i>-isopropylidene-β-<small>L</small>-arabinopyranose and 1-<i>O</i>-Benzyl-2-<i>O</i>-benzoyl-3,4-<i>O</i>-isopropylidene-β-<small>L</small>-arabinopyranose","Acta Crystallographica Section C","1996","52","6","1558","1563","10.1107/S0108270195016143","","","1.5418","CuKα","","0.0408","0.0352","","0.1086","0.1059","","","","1.085","1.132","1.132","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005045","8.738","0.002","9.998","0.002","15.307","0.003","90","","91.02","0.03","90","","1337","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S~1~,S~2~,R~4~,S~S~)-Benzyl 3,3-diethoxycarbonyl-2-(p-tolylsulfinyl)- bicyclo[2.2.1]hept-5-ene-2-carboxylate","","- C28 H30 O7 S -","- C28 H30 O7 S -","- C56 H60 O14 S2 -","2","1","NS1006","Alonso, I.; López-Solera, I.; Raithby, P. R.","The Diels‒Alder Adduct of an Enantiopure Sulfinyl Trialkoxycarbonyl Ethene and Cyclopentadiene","Acta Crystallographica Section C","1996","52","6","1548","1550","10.1107/S0108270196000315","","","1.54178","CuKα","","0.0604","0.0505","","0.1391","0.129","","","","1.04","1.065","1.065","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005046","12.502","0.005","7.533","0.002","13.04","0.004","90","","112.97","0.03","90","","1130.7","0.7","295","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Cl3 Co N5 -","- C4 H12 Cl3 Co N5 -","- C16 H48 Cl12 Co4 N20 -","4","1","PA1186","Lemoine, P.; Chiadmi, M.; Bissery, V.; Tomas, A.; Viossat, B.","Les Composés de la Metformine avec les Ions Co^II^, Cu^II^ et Ni^II^","Acta Crystallographica Section C","1996","52","6","1430","1436","10.1107/S0108270195008377","","","0.7107","MoKα","","","0.031","","","0.031","","","","","1.28","1.28","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005047","7.727","0.001","16.675","0.005","8.023","0.002","90","","115.25","0.02","90","","935","0.4","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H11 Cl2 Cu N5 -","- C4 H11 Cl2 Cu N5 -","- C16 H44 Cl8 Cu4 N20 -","4","1","PA1186","Lemoine, P.; Chiadmi, M.; Bissery, V.; Tomas, A.; Viossat, B.","Les Composés de la Metformine avec les Ions Co^II^, Cu^II^ et Ni^II^","Acta Crystallographica Section C","1996","52","6","1430","1436","10.1107/S0108270195008377","","","0.71069","MoKα","","","0.045","","","0.049","","","","","1.55","1.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005048","15.059","0.009","5.153","0.005","11.57","0.009","90","","90","","95.83","0.06","893.2","1.2","293","1","","","","","","","","","","6","P 1 1 21/n","-P 2n","14","","","","- C8 H26 Cl2 Cu N10 O2 -","- C8 H26 Cl2 Cu N10 O2 -","- C16 H52 Cl4 Cu2 N20 O4 -","2","0.5","PA1186","Lemoine, P.; Chiadmi, M.; Bissery, V.; Tomas, A.; Viossat, B.","Les Composés de la Metformine avec les Ions Co^II^, Cu^II^ et Ni^II^","Acta Crystallographica Section C","1996","52","6","1430","1436","10.1107/S0108270195008377","","","1.5418","CuKα","","","0.047","","","0.047","","","","","1.55","1.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005049","13.449","0.004","7.44","0.005","15.811","0.004","90","","104.8","0.1","90","","1529.6","1.4","293","1","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H23 Cl N10 Ni O -","- C8 H23 Cl N10 Ni O -","- C32 H92 Cl4 N40 Ni4 O4 -","4","0.5","PA1186","Lemoine, P.; Chiadmi, M.; Bissery, V.; Tomas, A.; Viossat, B.","Les Composés de la Metformine avec les Ions Co^II^, Cu^II^ et Ni^II^","Acta Crystallographica Section C","1996","52","6","1430","1436","10.1107/S0108270195008377","","","1.5418","CuKα","","","0.038","","","0.038","","","","","1.91","1.91","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005050","23.123","0.004","11.484","0.002","9.22","0.001","90","","95.05","0.03","90","","2438.8","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Chromene","8,8-dimethyl-[8H]-pyrano[3,2-f]quinolene","","- C14 H15 N O2 -","- C14 H15 N O2 -","- C112 H120 N8 O16 -","8","1","PA1202","Aldoshin, S.; Chuev, I.; Philipenko, O.; Pozzo, J. L.; Lokshin, V.; Pèpe, G.; Samat, A.","Photochromic Pyrido-Annelated 2,2-Dimethylchromene","Acta Crystallographica Section C","1996","52","6","1537","1539","10.1107/S0108270195016192","","","0.71069","MoKα","","0.0405","0.0405","","0.047","0.047","","","","0.957","1.188","1.188","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005051","15.312","0.003","5.024","0.001","12.514","0.003","90","","112.23","0.03","90","","891.1","0.4","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-phenyl-4-imidazolidinone (Z)-oxime","","- C9 H11 N3 O -","- C9 H11 N3 O -","- C36 H44 N12 O4 -","4","1","PA1215","Suwinski, J.; Wagner, P.; Holt, E. M.","1-Phenyl-4-imidazolidinone (<i>Z</i>)-Oxime","Acta Crystallographica Section C","1996","52","6","1462","1464","10.1107/S0108270195016210","","","0.71073","MoKα","","","0.047","","","0.0475","","","","","1.06","1.06","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005052","7.556","0.002","11.587","0.002","20.255","0.004","90","","90","","90","","1773.4","0.7","298","","298","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Boldine hydrochloride","[6a-(S)-1,10-dimethoxy-2-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,","","- C19 H22 Cl N O4 -","- C19 H22 Cl N O4 -","- C76 H88 Cl4 N4 O16 -","4","1","PT1029","Asencio, M.; Cassels, B. K.; Manríquez, V.; Boys, D.","(<i>S</i>)-1,10-Dimethoxy-2,9-dihydroxyaporphinium Chloride (Boldine Hydrochloride), C~19~H~22~NO~4~^+^.Cl^{-^}","Acta Crystallographica Section C","1996","52","6","1581","1583","10.1107/S0108270195016805","","","0.71073","MoKα","","0.0711","0.0409","","0.0512","0.0466","","","","","1.19","1.19","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005053","6.4262","0.001","9.1322","0.001","9.3627","0.001","90","","108.85","0.01","90","","519.98","0.12","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C8 H16 N2 O6 -","- C8 H16 N2 O6 -","- C16 H32 N4 O12 -","2","1","PT1032","Aakeröy, C. B.; Bahra, G. S.; Nieuwenhuyzen, M.","Piperazinium <small>L</small>-Tartrate","Acta Crystallographica Section C","1996","52","6","1471","1473","10.1107/S0108270195016374","","","0.71073","MoKα","","","0.0248","","","0.0658","","","","","1.085","1.085","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005054","6.997","0.001","11.887","0.002","23.201","0.004","90","","90","","90","","1929.7","0.5","296","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H34 O4 -","- C20 H34 O4 -","- C80 H136 O16 -","4","1","PT1035","Jiménez, M.; González de la Parra, M.; Melendez, E.; Campos, M. P.; Soriano-García, M.","Trinervinol","Acta Crystallographica Section C","1996","52","6","1458","1460","10.1107/S0108270195015599","","","1.54184","CuKα","","","0.037","","","0.056","","","","","1.256","1.256","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005055","8.664","0.002","12.314","0.004","19.763","0.004","90","","90","","90","","2108.5","0.9","296","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H36 O4 -","- C23 H36 O4 -","- C92 H144 O16 -","4","1","PT1039","Soriano-García, M.; Jiménez, M.; González de la Parra, M.; Navarro, A.; Campos, M. P.","Acetonide-3-trinervinone","Acta Crystallographica Section C","1996","52","6","1460","1462","10.1107/S0108270195015617","","","0.71073","MoKα","","","0.052","","","0.073","","","","","1.208","1.208","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005056","11.653","0.002","12.045","0.001","12.594","0.002","90","","105.156","0.008","90","","1706.2","0.4","296","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C11 H23 Co N2 O7 S2 -","- C11 H23 Co N2 O7 S2 -","- C44 H92 Co4 N8 O28 S8 -","4","2","PT1040","Yonemura, T.; Yasui, T.; Okamoto, K.-I.; Hidaka, J.","<i>trans</i>(S)-(<i>S</i>-Methyl-<small>D</small>-penicillaminato)(<small>D</small>-penicillaminesulfinato)cobalt(III) Monohydrate","Acta Crystallographica Section C","1996","52","6","1390","1392","10.1107/S0108270195015605","","","0.71073","MoKα","","","0.071","","","0.084","","","","","2.39","2.39","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2005057","8.336","0.002","15.044","0.004","17.454","0.006","90","","99.46","0.02","90","","2159.1","1.1","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-2-hydroxyethyl-N,N-bis[1-methyl-2-benzimidazolylmethyl]aminechlorocopper(II) chloride hydrate","","- C20 H25 Cl2 Cu N5 O2 -","- C20 H24 Cl2 Cu N5 O2 -","- C80 H96 Cl8 Cu4 N20 O8 -","4","1","SK1011","Elliot, D.; Price, C. L.; Martin, L. L.; Taylor, M. R.","{2-[Bis(1-methyl-2-benzimidazolylmethyl)amino]-ethanol}chlorocopper(II) Chloride Hydrate","Acta Crystallographica Section C","1996","52","6","1421","1423","10.1107/S0108270196001205","","","0.71073","MoKα","","0.063","0.056","","0.106","0.104","","","","1.765","1.798","1.798","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2005058","13.695","0.004","25.34","0.01","9.128","0.003","90","","90","","90","","3167.7","1.9","291","","291","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H39 N2 O9 P Si -","- C26 H39 N2 O9 P Si -","- C104 H156 N8 O36 P4 Si4 -","4","1","SX1005","McEldoon, W. L.; Swenson, D. C.; Wiemer, D. F.","(2'<i>S</i>,3'<i>S</i>,4'<i>R</i>)-5'-<i>O</i>-Benzoyl-3'-deoxy-3'β-diethylphosphono-2'-<i>O</i>-<i>tert</i>-butyldimethylsilyluridine","Acta Crystallographica Section C","1996","52","6","1552","1554","10.1107/S0108270195014831","","","0.71073","Mo_Kα","","0.15","0.051","","","0.053","","","","","1.054","1.054","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2005059","14.51","0.001","17.248","0.001","11.908","0.002","90","","90","","90","","2980.2","0.6","296","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C31 H38 O11 -","- C31 H38 O11 -","- C124 H152 O44 -","4","1","SZ1030","Soriano-Garcia, M.; Jimenez, M. A.; Mata, R.; Segura de Correa, R.","Humilinolide D","Acta Crystallographica Section C","1996","52","6","1527","1529","10.1107/S0108270195010109","","","1.54184","CuKα","","","0.0562","","","0.0651","","","","","1.32","1.32","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005060","17.116","0.004","9.96","0.003","21.416","0.005","90","","108.59","0.02","90","","3460.4","1.6","298","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H39 B3 O Os P2 -","- C37 H39 B3 O Os P2 -","- C148 H156 B12 O4 Os4 P8 -","4","1","SZ1031","Bould, J.; Rath, N. P.; Barton, L.","[(CO)H(PPh~3~)~2~-<i>arachno</i>-OsB~3~H~8~]","Acta Crystallographica Section C","1996","52","6","1388","1390","10.1107/S0108270195017239","","","0.71073","MoKα","","","0.0471","","","0.1129","","","","","0.935","0.935","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005061","5.536","0.002","7.901","0.002","16.54","0.003","83.98","0.01","82.55","0.02","76.76","0.02","696.2","0.3","297","","","","","","","","","","","3","P -1","-P 1","2","","","","- C14 H24 O3 -","- C14 H24 O3 -","- C28 H48 O6 -","2","1","SZ1045","Thompson, H. W.; Coté, M. L.; Lalancette, R. A.","(±)-2-Oxocyclododecaneacetic Acid: Structure and Hydrogen-Bonding Pattern of a Large-Ring γ-Keto Acid","Acta Crystallographica Section C","1996","52","6","1520","1523","10.1107/S0108270195010249","","","0.71073","MoKα","","","0.0504","","","0.0582","","","","","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005062","9.293","0.002","12.992","0.003","12.71","0.002","90","","97.67","0.02","90","","1520.8","0.5","213","1","213","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H11 Br5 O2 -","- C12 H11 Br5 O2 -","- C48 H44 Br20 O8 -","4","1","TA1040","Banwell, M. G.; Hockless, D. C. R.; Peters, S. C.","(2α,5α)-1,5,6,9,9-Pentabromo-7-methoxy-2,3,3a,4,5,6-hexahydro-3a,6-methanoazulen-2-ol","Acta Crystallographica Section C","1996","52","6","1589","1591","10.1107/S0108270195017112","","","1.5418","CuKα","","0.0422","0.04","","0.0486","0.0485","","","","","2.92","2.92","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005063","11.379","0.003","12.708","0.002","16.241","0.003","90","","100.11","0.02","90","","2312.1","0.8","141","2","141","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","μ-Chloro-bis-{([9R^*^,12R^*^]-6,8,8,13,13,15-hexamethyl-1,5,9,12- tetraazacyclopentadeca-5,15(1)-diene-N^1^,N^5^,N^9^,N^12^)- perchlorato)copper(II)} perchlorate","","- C17 H34 Cl2 Cu N4 O6 -","- C17 H31 Cl2 Cu N4 O6 -","- C68 H124 Cl8 Cu4 N16 O24 -","4","1","TA1060","Gladkikh, O. P.; Curtis, N. F.","A Chloro-Bridged Dinuclear Copper(II) Cationic Complex of a 15-Membered Tetraaza Macrocyclic Ligand","Acta Crystallographica Section C","1996","52","6","1418","1421","10.1107/S0108270196002004","","","0.71073","MoKα","","0.0953","0.056","","0.1567","0.1387","","","","1.009","1.145","1.145","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005064","22.201","0.005","13.667","0.003","22.087","0.004","90","","90.43","0.02","90","","6701","2","296","","296","","","","","","","","","7","C 1 2 1","C 2y","5","","bis[tris(2,2'-bipyridine)ruthenium(II)] hexacyanocobaltate(III) chloride octahydrate","","- C66 H64 Cl Co N18 O8 Ru2 -","- C66 H64 Cl Co N18 O8 Ru2 -","- C264 H256 Cl4 Co4 N72 O32 Ru8 -","4","1","TA1068","Tamura, H.; Ikeda, N.; Iguro, T.; Ohno, T.; Matsubayashi, G.-E.","The Pseudo-Racemic Complex Bis[tris(2,2'-bipyridine)ruthenium(II)] Hexacyanocobaltate(III) Chloride Octahydrate, [Ru(bpy)~3~]~2~[Co(CN)~6~]Cl.8H~2~O","Acta Crystallographica Section C","1996","52","6","1394","1399","10.1107/S0108270196000042","","","0.7107","MoKα","","","0.035","","","0.06","","","","","1.56","1.56","","","","","has coordinates","189124","2020-10-21","18:00:00",""
"2005065","7.2309","0.0009","29.517","0.004","20.717","0.003","90","","101.98","0.01","90","","4325.4","1","130","2","130","2","","","","","","","","5","P 1 n 1","P -2yac","7","","(4) bis-(p-nitrobenzoate) ester of cis-1,1-dimethylsilacyclohex-3,4-diylbis- p-Nitrobenzoate","","- C21 H22 N2 O8 Si -","- C21 H22 N2 O8 Si -","- C168 H176 N16 O64 Si8 -","8","4","TA1071","White, J. M.; Tham, W.-Y.; Green, A. J.","Bis(<i>p</i>-nitrobenzoate) Ester of <i>cis</i>-1,1-Dimethylsilacyclohexane-3,4-diol","Acta Crystallographica Section C","1996","52","6","1493","1496","10.1107/S0108270195016441","","","1.5418","CuKαradiation(Nifiltered)","","0.0395","0.0358","","0.0956","0.0913","","","","1.007","0.992","0.992","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2005066","13.165","0.003","9.53","0.005","28.924","0.002","90","","98.27","0.01","90","","3591","2","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H20 N2 O3 Sn -","- C17 H20 N2 O3 Sn -","- C136 H160 N16 O24 Sn8 -","8","1","TA1087","Basu Baul, T. S.; Tiekink, E. R. T.","Polymeric [<i>p</i>-(2-Hydroxy-5-methylphenylazo)benzoato]trimethyltin","Acta Crystallographica Section C","1996","52","6","1428","1430","10.1107/S0108270196001990","","","0.7107","MoKα","","0.0639","0.0639","","0.0848","0.0848","","","","1.572","1.572","1.572","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005067","12.299","0.002","8.046","0.002","11.563","0.002","90","","90.83","0.03","90","","1144.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(p-pethoxy-phenyl)-2-methyl-4-nitro-imidazole","","- C11 H11 N3 O3 -","- C11 H11 N3 O3 -","- C44 H44 N12 O12 -","4","1","AB1279","Kowalski, A.","1-(<i>p</i>-Methoxyphenyl)-2-methyl-4-nitroimidazole and 1-(<i>p</i>-Acetylphenyl)-2-methyl-4-nitroimidazole","Acta Crystallographica Section C","1996","52","7","1784","1787","10.1107/S0108270196001722","","","1.54178","CuKα","","0.0705","0.0409","","0.1628","0.127","","","","1.12","1.251","1.251","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005068","7.493","0.001","8.217","0.002","10.332","0.002","90.46","0.02","105.24","0.02","110.59","0.02","571","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-(p-acetyl-phenyl)-2-methyl-4-nitro-imidazole","","- C12 H11 N3 O3 -","- C12 H11 N3 O3 -","- C24 H22 N6 O6 -","2","1","AB1279","Kowalski, A.","1-(<i>p</i>-Methoxyphenyl)-2-methyl-4-nitroimidazole and 1-(<i>p</i>-Acetylphenyl)-2-methyl-4-nitroimidazole","Acta Crystallographica Section C","1996","52","7","1784","1787","10.1107/S0108270196001722","","","1.54178","CuKα","","0.1025","0.0424","","0.2912","0.1147","","","","0.855","0.738","0.738","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005069","11.018","0.007","14.184","0.007","24.78","0.01","90","","94.5","0.05","90","","3861","3","293","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C15 H19 Fe K N2 O10.5 -","- C15 H19 Fe K N2 O10.5 -","- C120 H152 Fe8 K8 N16 O84 -","8","1","AB1280","Hernández-Padilla, M.; Sanchiz, J.; Domínguez, S.; Mederos, A.; Arrieta, J. M.; Zuñiga, F. J.","Potassium Aqua(3,4-toluenediamine-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetraacetato)ferrate(III)‒Water (1/1.5)","Acta Crystallographica Section C","1996","52","7","1618","1621","10.1107/S0108270196002697","","","0.71069","MoKα","","","","","","0.1432","","","","","1.115","1.115","","","","","has coordinates","190595","2020-10-21","18:00:00",""
"2005070","15.89","0.005","13.093","0.004","7.828","0.003","75.48","0.01","78.25","0.01","73.46","0.01","1495.9","0.9","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C17 H15 Br N2 O -","- C17 H15 Br N2 O -","- C68 H60 Br4 N8 O4 -","4","2","AB1282","Barakat, S. E.-S.; Lindner, H. J.","2-Bromomethyl-3-(2-ethylphenyl)-4(3<i>H</i>)-quinazolinone","Acta Crystallographica Section C","1996","52","7","1703","1705","10.1107/S0108270196001291","","","0.71069","MoKα","","0.0497","0.0348","","0.1185","0.1061","","","","0.957","0.974","0.974","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005071","7.813","0.002","8.058","0.002","10.212","0.002","92.44","0.03","105.51","0.03","106.03","0.03","590.7","0.3","273","2","273","2","","","","","","","","4","P 1","P 1","1","","(5R)-5-[(1''S)-Hydroxybenzyl]-5-(l-menthyloxy)-4-(pyrrolidin-yl)furan-2(5H)- one","","- C25 H35 N O4 -","- C25 H35 N O4 -","- C25 H35 N O4 -","1","1","AB1288","Alonso, I.; López-Solera, I.; Raithby, P. R.","(5<i>R</i>)-5-[(<i>S</i>)-α-Hydroxybenzyl]-5-(<small>L</small>-menthyloxy)-4-(1-pyrrolidinyl)furan-2(5<i>H</i>)-one","Acta Crystallographica Section C","1996","52","7","1743","1745","10.1107/S0108270196001023","","","0.71073","MoKα","","0.1563","0.0742","","0.1683","0.1324","","","","1.02","1.118","1.118","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005072","21.771","0.004","10.608","0.002","16.885","0.003","90","","90","","90","","3899.5","1.2","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","trans-chloromethylbis(tri-p-tolylarsine)platinum(II)","","- C43 H45 As2 Cl Pt -","- C43 H45 As2 Cl Pt -","- C172 H180 As8 Cl4 Pt4 -","4","1","AB1292","Otto, S.; Roodt, A.","<i>trans</i>-Chloromethylbis(tri-<i>p</i>-tolylarsine)platinum(II)","Acta Crystallographica Section C","1996","52","7","1636","1638","10.1107/S0108270196000510","","","0.71073","MoKα","","0.0226","0.0226","","0.0545","0.0545","","","","1.077","1.077","1.077","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005073","8.71","0.003","12.988","0.002","14.069","0.003","90","","102.44","0.04","90","","1554.2","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-bis(1'-closo-2'-phenyl-1',2'-dicarbadodecaboryl)-2,3,5,6- tetrafluorobenzene","","- C22 H30 B20 F4 -","- C22 H30 B20 F4 -","- C44 H60 B40 F8 -","2","0.5","AB1305","Thomas, R. Ll.; Welch, A. J.","Haloaryl Carboranes. I. 1,4-Bis[2-phenyl-1,2-dicarba-<i>closo</i>-dodecaboran(12)-1-yl]-2,3,5,6-tetrafluorobenzene","Acta Crystallographica Section C","1996","52","7","1689","1691","10.1107/S0108270196000029","","","0.71069","MoKα","","0.0645","0.0463","","0.1361","0.1312","","","","1.11","1.221","1.221","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005074","4.747","0.007","14.399","0.002","15.191","0.002","90","0.011","90","0.011","90","0.011","1038.3","1.5","293","2","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-alanyl-glycyl-L-alanine","","- C8 H15 N3 O4 -","- C8 H15 N3 O4 -","- C32 H60 N12 O16 -","4","1","AB1324","Padiyar, G. S.; Seshadri, T. P.","The Linear Tripeptide <small>L</small>-Alanylglycyl-<small>L</small>-alanine","Acta Crystallographica Section C","1996","52","7","1693","1695","10.1107/S0108270196001138","","","1.5418","CuKα","","0.0305","0.0279","","0.08","0.078","","","","1.045","1.057","1.057","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005075","6.891","0.002","11.412","0.006","11.78","0.004","101.25","0.04","96.96","0.01","102.06","0.04","875.8","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Gallium Hexamolybdocobaltate (III)-water (1:16)","","- Co Ga H38 Mo6 O40 -","- Co Ga H38 Mo6 O40 -","- Co Ga H38 Mo6 O40 -","1","0.5","AB1334","Panneerselvam, K.; Soriano-García, M.; Holguin-Quiñones, S.; Holt, E. M.","Hexaaquagallium Hexahydrogenhexamolybdocobaltate(III) Decahydrate","Acta Crystallographica Section C","1996","52","7","1605","1607","10.1107/S0108270195017161","","","0.71073","MoKα","","0.0395","0.0371","","0.0995","0.0981","","","","1.086","1.128","1.128","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005076","8.569","0.003","17.316","0.006","9.968","0.004","90","","109.02","0.02","90","","1398.3","0.9","240","2","240","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,3-benzo-1,4-diaza-7,10,13-trioxapentadec-2-ene","","- C14 H22 N2 O3 -","- C14 H22 N2 O3 -","- C56 H88 N8 O12 -","4","1","AB1361","Clegg, W.; Cooper, P. J.; Lockhart, J. C.","A Diaza Analogue of Benzo-15-crown-5","Acta Crystallographica Section C","1996","52","7","1795","1797","10.1107/S0108270196003113","","","1.54184","CuKα","","0.051","0.0508","","0.1492","0.149","","","","1.128","1.135","1.135","","","","","has coordinates","209447","2020-10-21","18:00:00",""
"2005077","5.396","0.002","7.935","0.003","18.311","0.004","90","0.06","93.71","0.03","90","","782.4","0.4","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Bandrowski's base","N,N'-(2,5-diamino-2,5-cyclohexadiene-1,4-diylidene)bis-1,4-benzenediamine","","- C18 H18 N6 -","- C18 H18 N6 -","- C36 H36 N12 -","2","0.5","AB1362","Blake, A. J.; Hubberstey, P.; Quinlan, D. J.","Bandrowski's Base","Acta Crystallographica Section C","1996","52","7","1774","1776","10.1107/S0108270196003125","","","0.71073","MoKα","","0.2227","0.0771","","0.2134","0.1403","","","","0.924","1.278","1.278","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2005078","8.679","0.002","7.964","0.001","4.86","0.002","90","","101.1","0.02","90","","329.64","0.16","293","","","","","","","","","","","4","C 1 m 1","C -2y","8","","","","- C6 H9 N S -","- C6 H9 N S -","- C12 H18 N2 S2 -","2","0.5","BK1147","Andras, M. T.; Hepp, A. F.; Fanwick, P. E.; Martuch, R. A.; Duraj, S. A.; Gordon, E. M.","4-Methylpyridinium Hydrogen Sulfide","Acta Crystallographica Section C","1996","52","7","1701","1702","10.1107/S0108270196000078","","","0.71073","MoKα","","","0.039","","","0.048","","","","","1.617","1.617","","","","","has coordinates","296843","2024-12-11","14:15:26",""
"2005079","8.144","0.001","21.772","0.001","6.966","0.001","90","","90","","90","","1235.1","0.2","295","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H15 B N4 O4 -","- C10 H15 B N4 O4 -","- C40 H60 B4 N16 O16 -","4","1","BK1158","Gao, Q.; Sood, A.; Ramsay Shaw, B.; Williams, L. D.","2'-Deoxycytidine-<i>N</i>3-cyanoborane","Acta Crystallographica Section C","1996","52","7","1823","1825","10.1107/S0108270195013783","","","1.5418","CuKα","","","0.029","","","0.042","","","","","1.505","1.505","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005080","10.9215","0.001","9.54","0.002","11.9604","0.001","90","","107.2","0.01","90","","1190.4","0.3","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 N2 O4 -","- C12 H12 N2 O4 -","- C48 H48 N8 O16 -","4","1","BK1163","Moreno-Fuquen, R.; do Gambardella, M. T.; de Santos, R. H.","1:1 Complex Formed by 2-Picoline <i>N</i>-Oxide and 4-Nitrophenol","Acta Crystallographica Section C","1996","52","7","1745","1747","10.1107/S0108270196000066","","","0.71073","MoKα","","0.0978","0.055","","0.1144","0.107","","","","3.302","3.934","3.934","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2005081","7.249","0.002","9.893","0.002","11.247","0.003","90","","102.86","0.02","90","","786.3","0.3","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H10 N O6 P -","- C4 H10 N O6 P -","- C16 H40 N4 O24 P4 -","4","1","BK1167","Maniukiewicz, W.; Kwiatkowski, W.; Blessing, R. H.","<i>O</i>-Phospho-<small>DL</small>-threonine and <i>O</i>-Phospho-<small>L</small>-threonine Compared with their Serine Analogs","Acta Crystallographica Section C","1996","52","7","1736","1741","10.1107/S0108270195015708","","","0.71069","MoKα","","","0.028","","","0.075","","","","","3.08","3.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005082","6.709","0.001","9.854","0.001","11.766","0.002","90","","90","","90","","777.86","0.19","295","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C4 H10 N O6 P -","- C4 H10 N O6 P -","- C16 H40 N4 O24 P4 -","4","1","BK1167","Maniukiewicz, W.; Kwiatkowski, W.; Blessing, R. H.","<i>O</i>-Phospho-<small>DL</small>-threonine and <i>O</i>-Phospho-<small>L</small>-threonine Compared with their Serine Analogs","Acta Crystallographica Section C","1996","52","7","1736","1741","10.1107/S0108270195015708","","","0.71069","MoKα","","","0.026","","","0.065","","","","","2.38","2.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005083","6.141","0.001","19.57","0.002","11.366","0.001","90","","91.64","0.01","90","","1365.4","0.3","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 Mn N4 O4 -","- C12 H10 Mn N4 O4 -","- C48 H40 Mn4 N16 O16 -","4","1","BK1196","Tamaki, K.; Okabe, N.","Manganese Cupferronate","Acta Crystallographica Section C","1996","52","7","1612","1614","10.1107/S0108270196002661","","","0.71069","MoKα","","","0.04","","","0.041","","","","","1.2","1.2","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005084","17.816","0.002","9.05","0.001","15.468","0.003","90","","98.7","0.01","90","","2465.3","0.6","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","cis-4,5-bis(fluorodinitromethyl)-cis-2-methoxy-1,3-dioxolane","","- C6 H6 F2 N4 O11 -","- C6 H6 F2 N4 O11 -","- C48 H48 F16 N32 O88 -","8","1","BK1205","Corbett, J. M.; Dickman, M. H.","4,5-Bis(fluorodinitromethyl)-2-methoxy-1,3-dioxolane","Acta Crystallographica Section C","1996","52","7","1851","1853","10.1107/S010827019600265X","","","0.71073","MoKα","","0.0625","0.0408","","0.1063","0.0946","","","","1.038","1.115","1.115","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005085","10.646","0.003","16.547","0.002","6.899","0.003","90","","90","","90","","1215.3","0.6","298","","298","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Anthracene-1,8-dicarboxylic acid","anthracene-1,8-dicarboxylic acid","","- C16 H10 O4 -","- C16 H10 O4 -","- C64 H40 O16 -","4","1","BK1211","Fitzgerald, L. J.; Gerkin, R. E.","Anthracene-1,8-dicarboxylic Acid","Acta Crystallographica Section C","1996","52","7","1838","1841","10.1107/S0108270196002703","","","0.71073","MoKα","","","0.051","","","0.05","","","","","1.39","1.39","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005086","8.21","0.002","12.076","0.005","11.949","0.003","90","","99.71","0.02","90","","1167.7","0.6","295","2","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 O4 Ti -","- C12 H12 O4 Ti -","- C48 H48 O16 Ti4 -","4","1","BK1212","Gibson, D. H.; Ding, Y.; Richardson, J. F.; Mashuta, M. S.","Bis(η^5^-cyclopentadienyl)bis(formato-<i>O</i>)titanium","Acta Crystallographica Section C","1996","52","7","1614","1616","10.1107/S0108270196002715","","","0.7107","MoKα","","","0.038","","","0.038","","","","","1.88","1.88","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005087","8.216","0.002","16.164","0.002","12.762","0.002","90","","107.12","0.02","90","","1619.7","0.5","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","lithium isodicyclopentadienide tetramethylethylenediamine","(N,N,N',N'‒tetramethylethylenediamine)lithium(1+) (1,2,3,3a,7a‒η)‒4,5,6,7‒tetrahydro‒4,7‒methanoindenide","","- C16 H27 Li N2 -","- C16 H27 Li N2 -","- C64 H108 Li4 N8 -","4","1","BK1216","Gallucci, J. C.; Sivik, M. R.; Paquette, L. A.; Zaegel, F.; Meunier, P.; Gautheron, B.","Two Derivatives of Lithium Isodicyclopentadienide: [(1,2,3,3a,7a-η)-4,5,6,7-Tetrahydro-4,7-methanoindenido](<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine)lithium and Bis(1,4,7,10-tetraoxacyclododecane)lithium(1+) Bis[(1,2,3,3a,7a-η)-4,5,6,7-tetrahydro-4,7-methanoindenido]lithate(1‒)","Acta Crystallographica Section C","1996","52","7","1673","1679","10.1107/S0108270196002454","","","0.71073","MoKα","","0.2548","0.059","","0.189","0.125","","","","1","1.253","1.253","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005088","11.818","0.001","16.129","0.002","9.871","0.001","107.05","0.01","108.23","0.01","88.7","0.01","1703.6","0.3","203","","203","","","","","","","","","4","P -1","-P 1","2","","bis(1,4,7,10‒tetraoxacyclododecane)lithium(1+) bis[(1,2,3,3a,7a‒η)‒4,5,6,7‒tetrahydro‒4,7‒methanoindenido] lithate(1-)","","- C36 H54 Li2 O8 -","- C36 H54 Li2 O8 -","- C72 H108 Li4 O16 -","2","1","BK1216","Gallucci, J. C.; Sivik, M. R.; Paquette, L. A.; Zaegel, F.; Meunier, P.; Gautheron, B.","Two Derivatives of Lithium Isodicyclopentadienide: [(1,2,3,3a,7a-η)-4,5,6,7-Tetrahydro-4,7-methanoindenido](<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine)lithium and Bis(1,4,7,10-tetraoxacyclododecane)lithium(1+) Bis[(1,2,3,3a,7a-η)-4,5,6,7-tetrahydro-4,7-methanoindenido]lithate(1‒)","Acta Crystallographica Section C","1996","52","7","1673","1679","10.1107/S0108270196002454","","","0.71073","MoKα","","","0.054","","0.056","0.0555","","","","1.706","1.706","1.706","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005089","11.868","0.007","12.2","0.01","20.746","0.011","96.83","0.05","100.85","0.05","101.16","0.04","2856","3","193","2","193","2","","","","","","","","5","P -1","-P 1","2","Di(N-propallyl-phenylammonium) phenylimidopentachloroniobate(V)","Di(N-propallyl-phenylammonium) phenylimidopentachloroniobate(V)","","- C24 H29 Cl5 N3 Nb -","- C24 H29 Cl5 N3 Nb -","- C96 H116 Cl20 N12 Nb4 -","4","2","BK1221","Polamo, M.; Leskelä, M.","Phenylimidopentachloroniobate(V) Dianion with <i>N</i>-Allylphenylammonium Counterion","Acta Crystallographica Section C","1996","52","7","1631","1634","10.1107/S0108270196003319","","","0.71069","MoKα","","0.0843","0.065","","0.15","0.1403","","","","1.042","1.104","1.104","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2005090","12.062","0.005","11.652","0.004","10.304","0.004","90","","94.13","0.03","90","","1444.4","1","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H12 O4 S -","- C17 H12 O4 S -","- C68 H48 O16 S4 -","4","1","BK1226","Chen, Y.-S.; Khan, M.; Rao, S. N.; Krishnaiah, M.; Raju, K. V. N.","3-[(2-Phenylsulfonyl)ethenyl]-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section C","1996","52","7","1847","1849","10.1107/S0108270196003526","","","0.71073","MoKα","","","0.039","","","0.042","","","","","1.78","1.78","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005091","9.68","0.003","13.093","0.003","16.607","0.005","90","0.02","91.82","0.03","90","0.02","2103.7","1","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N-(2-hydroxyethyl)piperidinium[2-[(2,6-dichlorophenyl)amino]phenyl]acetate","","- C21 H26 Cl2 N2 O3 -","- C21 H26 Cl2 N2 O3 -","- C84 H104 Cl8 N8 O12 -","4","1","BM1046","Castellari, C.; Sabatino, P.","Anti-Inflammatory Drugs. III. Salts of Diclofenac with <i>N</i>-(2-Hydroxyethyl)piperidine, <i>N</i>-(2-Hydroxyethyl)morpholine and <i>N</i>-(2-Hydroxyethyl)piperazine","Acta Crystallographica Section C","1996","52","7","1708","1712","10.1107/S0108270196000571","","","0.71069","MoKα","","0.1544","0.0399","","0.1345","0.0961","","","","1.003","1.136","1.136","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005092","9.525","0.002","12.962","0.004","16.579","0.007","90","","91.81","0.03","90","","2045.9","1.2","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N-(2-hydroxyethyl)morpholinium[2-[(2,6-dichlorophenyl)amino]phenyl]acetate","","- C20 H24 Cl2 N2 O4 -","- C20 H24 Cl2 N2 O4 -","- C80 H96 Cl8 N8 O16 -","4","1","BM1046","Castellari, C.; Sabatino, P.","Anti-Inflammatory Drugs. III. Salts of Diclofenac with <i>N</i>-(2-Hydroxyethyl)piperidine, <i>N</i>-(2-Hydroxyethyl)morpholine and <i>N</i>-(2-Hydroxyethyl)piperazine","Acta Crystallographica Section C","1996","52","7","1708","1712","10.1107/S0108270196000571","","","0.71069","MoKα","","0.0811","0.0428","","0.1208","0.1006","","","","1.035","1.102","1.102","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005093","9.681","0.005","13.083","0.004","16.582","0.005","90","0.03","91.66","0.04","90","0.03","2099.3","1.4","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N-(2-hydroxyethyl)piperazinium[2-[(2,6-dichlorophenyl)amino]phenyl]acetate","","- C20 H25 Cl2 N3 O3 -","- C20 H25 Cl2 N3 O3 -","- C80 H100 Cl8 N12 O12 -","4","1","BM1046","Castellari, C.; Sabatino, P.","Anti-Inflammatory Drugs. III. Salts of Diclofenac with <i>N</i>-(2-Hydroxyethyl)piperidine, <i>N</i>-(2-Hydroxyethyl)morpholine and <i>N</i>-(2-Hydroxyethyl)piperazine","Acta Crystallographica Section C","1996","52","7","1708","1712","10.1107/S0108270196000571","","","0.71069","MoKα","","0.1858","0.0422","","0.159","0.1102","","","","1.011","1.185","1.185","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005094","9.391","0.002","11.14","0.002","20.373","0.004","90","","90","","90","","2131.3","0.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,2,3,4-tetrahydro-1,4-disulfinylphenanthrene","","- C12 H10 O2 S2 -","- C12 H10 O2 S2 -","- C96 H80 O16 S16 -","8","1","BM1051","Martinez-Alcazar, M. P.; Fonseca, I.; Cano, F. H.","2,3-Dihydro-1,4-dithiaphenanthrene 1,4-Dioxide","Acta Crystallographica Section C","1996","52","7","1787","1789","10.1107/S0108270196001771","","","1.5418","CuKα","","0.0818","0.0435","","0.1058","0.0917","","","","0.883","1.023","1.023","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005095","8.611","0.001","9.848","0.001","9.948","0.001","68.96","0.015","68.3","0.015","89.18","0.015","724.71","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(3'-Methyl-2'-pyridyl)-3-(-m-bromophenyl)pyrrolidin-2,5-dione","","- C16 H13 Br N2 O2 -","- C16 H13 Br N2 O2 -","- C32 H26 Br2 N4 O4 -","2","1","BM1056","Karolak-Wojciechowska, J.; Kwiatkowski, W.; Obniska, J.; Zejc, A.","3-(<i>m</i>-Bromophenyl)-1-(3-methyl-2-pyridyl)pyrrolidin-2,5-dione","Acta Crystallographica Section C","1996","52","7","1808","1810","10.1107/S0108270196002028","","","1.54178","CuKα","","0.0757","0.0567","","0.1594","0.1399","","","","1.147","1.135","1.135","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005096","9.653","0.003","7.472","0.003","14.627","0.002","90","","107.08","0.02","90","","1008.5","0.5","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H22 Cl6 O4 Sn2 -","- C8 H22 Cl6 O4 Sn2 -","- C16 H44 Cl12 O8 Sn4 -","2","0.5","BM1062","Genge, A. R. J.; Levason, W.; Reid, G.","Redetermination of [(μ-OEt)~2~{SnCl~3~(EtOH)}~2~]","Acta Crystallographica Section C","1996","52","7","1666","1668","10.1107/S0108270196002909","","","0.71073","MoKα","","0.0394","0.0247","","0.0315","0.0291","","","","1.28","1.32","1.32","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005097","4.785","0.002","7.097","0.002","7.851","0.003","89.71","0.02","87.53","0.03","73.54","0.02","255.44","0.16","298","","298","","","","","","","","","4","P -1","-P 1","2","","Lead^II^ Iron^III^ Diphosphate","","- Fe2 O14 P4 Pb -","- Fe2 O14 P4 Pb -","- Fe2 O14 P4 Pb -","1","0.5","BR1123","Boutfessi, A.; Boukhari, A.; Holt, E. M.","Lead(II) Diiron(III) Pyrophosphate and Barium Diiron(III) Pyrophosphate","Acta Crystallographica Section C","1996","52","7","1594","1597","10.1107/S0108270196000340","","","0.71073","MoKα","","","0.0421","","","0.0534","","","","","1.22","1.22","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005098","10.586","0.002","10.463","0.002","9.685","0.002","90","","103.16","0.03","90","","1044.6","0.4","298","","298","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Barium Iron^III^ Diphosphate","","- Ba Fe2 O14 P4 -","- Ba Fe2 O14 P4 -","- Ba4 Fe8 O56 P16 -","4","0.5","BR1123","Boutfessi, A.; Boukhari, A.; Holt, E. M.","Lead(II) Diiron(III) Pyrophosphate and Barium Diiron(III) Pyrophosphate","Acta Crystallographica Section C","1996","52","7","1594","1597","10.1107/S0108270196000340","","","0.71073","MoKα","","","0.0421","","","0.0534","","","","","1.22","1.22","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005099","13.628","0.003","13.628","0.003","9.096","0.002","90","","90","","120","","1463","0.6","293","","293","","","","","","","","","4","R 3 :H","R 3","146","Lithium Zinc Phosphate","","","- Li O4 P Zn -","- Li O4 P Zn -","- Li18 O72 P18 Zn18 -","18","2","BR1128","Bu, X.; Gier, T. E.; Stucky, G. D.","A New Form of Lithium Zinc Phosphate with an Ordered Phenakite Structure, LiZnPO~4~","Acta Crystallographica Section C","1996","52","7","1601","1603","10.1107/S0108270195015940","","","0.71073","MolybdenumKα","","0.024","0.024","","0.034","0.034","","","","","1.75","1.75","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005100","3.911","0.002","3.911","0.002","11.734","0.001","90","","90","","90","","179.48","0.13","293","2","293","2","","","","","","","","4","P 4/m m m","-P 4 2","123","Lanthanum barium copper oxide","","","- Ba1.5 Cu3 La1.5 O6.66 -","- Ba1.5 Cu3 La1.5 O6.64 -","- Ba1.5 Cu3 La1.5 O6.64 -","1","0.0625","BR1132","Hjorth, M.","Refinement of La~1.5~Ba~1.5~Cu~3~O~7{-~<i>x</i>} from a Twinned Crystal","Acta Crystallographica Section C","1996","52","7","1599","1601","10.1107/S0108270196001692","","","0.71073","MoKα","","0.0857","0.0327","","0.1135","0.0748","","","","1.067","1.141","1.141","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005101","10.5672","0.002","15.9577","0.0012","14.5196","0.0012","90","","90","","90","","2448.4","0.5","294","","294","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Di(μ-hydrido)hexadecacarbonylpentaosmium","","- C16 H2 O16 Os5 -","- C18 O16 Os5 -","- C72 O64 Os20 -","4","0.5","BR1134","Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K.","[Os~5~(μ-H)~2~(CO)~16~]: a Second Crystal Form","Acta Crystallographica Section C","1996","52","7","1607","1609","10.1107/S0108270196000339","","","0.7107","MolybdenumKα","","0.051","0.051","","0.058","0.058","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005102","6.589","0.001","5.163","0.001","15.633","0.003","90","","91.99","0.03","90","","531.5","0.17","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Copper(II) Iron(III) Diphosphate","","- Cu Fe2 O14 P4 -","- Cu Fe2 O14 P4 -","- Cu2 Fe4 O28 P8 -","2","0.5","BR1137","Boutfessi, A.; Boukhari, A.; Holt, E. M.","Copper(II) Diiron(III) Pyrophosphate","Acta Crystallographica Section C","1996","52","7","1597","1599","10.1107/S0108270196000856","","","0.71073","MoKα","","","0.042","","","0.0541","","","","","1.26","1.26","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005103","7.241","0.002","6.214","0.001","8.643","0.001","90","","101.19","0.01","90","","381.5","0.13","295","1","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H8 As N O3 -","- C6 H7 As N O3 -","- C12 H14 As2 N2 O6 -","2","1","CF1008","Nuttall, R. H.; Hunter, W. N.","<i>p</i>-Arsanilic Acid, a Redetermination","Acta Crystallographica Section C","1996","52","7","1681","1683","10.1107/S010827019501657X","","","1.54178","CuKα","","","0.044","","","0.055","","","","","1.04","1.04","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005104","18.678","0.009","7.627","0.003","19.099","0.01","90","","116.6","0.04","90","","2433","2","198","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C24 H30 I N Sn -","- C24 H30 I N Sn -","- C96 H120 I4 N4 Sn4 -","4","1","CF1055","Howie, R. A.; Wardell, J. L.","Trimethyl[3-(triphenylstannyl)propyl]ammonium Iodide","Acta Crystallographica Section C","1996","52","7","1668","1670","10.1107/S0108270196000881","","","0.71073","MoKα","","","0.043","","","0.043","","","","","1.43","1.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005105","5.739","0.003","14.237","0.002","18.644","0.002","90","","93.65","0.01","90","","1520.2","0.8","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,3-dichlor-4-(p-metoxyphenyl)-1-phenyl-2-azetidinone","","- C16 H13 Cl2 N O2 -","- C16 H13 Cl2 N O2 -","- C64 H52 Cl8 N4 O8 -","4","1","CF1057","Ercan, F.; Ülkü, D.; Güner, V.","3,3-Dichloro-4-(<i>p</i>-methoxyphenyl)-1-phenyl-2-azetidinone","Acta Crystallographica Section C","1996","52","7","1779","1780","10.1107/S0108270196002119","","","0.71073","MoKα","","","0.042","","","0.04","","","","","0.64","0.64","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005106","7.4402","0.0008","14.8767","0.0013","11.5652","0.0012","90","","105.539","0.009","90","","1233.3","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","8,9,10,11-Tetrahydrobenz[c]acridine.","","- C17 H15 N -","- C17 H15 N -","- C68 H60 N4 -","4","1","CF1059","Ray, J. K.; Haldar, M. K.; Nigam, G. D.; Sivakumar, K.; Fun, H.-K.","8,9,10,11-Tetrahydrobenz[<i>c</i>]acridine","Acta Crystallographica Section C","1996","52","7","1813","1815","10.1107/S0108270196002132","","","0.71073","MoKα","","0.0585","0.0429","","0.1356","0.1279","","","","1.064","1.187","1.187","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005107","8.193","0.005","10.546","0.006","11.092","0.006","90","","103.21","0.04","90","","933","0.9","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","(1R,3S,4R,5S,6S,7R,8S)-4-chloromethyl-3,4-diyhdroxy- 8-(4-hydroxymethacrylate)-1H,5H,6H,7H-guaia-10(14),11(13)-dien-6,12-olide,","","- C19 H23 Cl O7 -","- C19 H23 Cl O7 -","- C38 H46 Cl2 O14 -","2","1","CF1061","Mattern, G.; Weckert, E.; Youssef, D.; Frahm, A. W.","Absolute Configuration of Chlorojanerin, a Chlorine-Containing Guaianolide from <i>Centaurea scoparia</i>","Acta Crystallographica Section C","1996","52","7","1791","1793","10.1107/S0108270196000741","","","0.71073","MoKα","","0.0381","0.0354","","0.0367","0.0366","","","","2.27","2.34","2.34","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005108","7.2382","0.0005","15.9407","0.0014","13.152","0.0011","90","","93.473","0.007","90","","1514.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,5-Diazafluren-9-one Isonicotinoylhydrozone Monohydrate.","","- C17 H13 N5 O2 -","- C17 H13 N5 O2 -","- C68 H52 N20 O8 -","4","1","CF1063","Lu, Z.-L.; Shan, B.-Z.; Duan, C.-Y.; Tian, Y.-P.; You, X.-Z.; Fun, H.-K.; Sivakumar, K.","4,5-Diaza-9-fluorenone Isonicotinoylhydrazone Monohydrate","Acta Crystallographica Section C","1996","52","7","1720","1722","10.1107/S0108270196002144","","","0.71073","MoKα","","0.0615","0.0404","","0.1149","0.1063","","","","0.966","1.088","1.088","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005109","16.949","0.002","17.907","0.002","19.662","0.003","90","","90","","90","","5967.5","1.3","294","1","294","1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(α-Ferrocenylphenacyl)triphenylphosphonium iodide","","- C36 H30 Fe I O P -","- C36 H30 Fe I O P -","- C288 H240 Fe8 I8 O8 P8 -","8","1","CF1086","Ahmed, S. Z.; Glidewell, C.; Ferguson, G.","Racemic (α-Ferrocenylphenacyl)triphenylphosphonium Iodide","Acta Crystallographica Section C","1996","52","7","1634","1636","10.1107/S0108270196003538","","","0.7107","MolybdenumKα","","0.1953","0.0552","","0.1132","0.0911","","","","0.802","1.151","1.151","","","","","has coordinates","192293","2020-10-21","18:00:00",""
"2005110","6.209","0.002","5.023","0.001","10.457","0.003","90","","95.35","0.03","90","","324.71","0.16","160.95","","160.95","","","","","","","","","4","P 1 21 1","P 2yb","4","","p-nitrobenzaldehyde","","- C7 H5 N O3 -","- C7 H6 N O4 -","- C14 H12 N2 O8 -","2","1","CR1179","King, Jnr, J. A.; Bryant, Jnr, G. L.","<i>p</i>-Nitrobenzaldehyde","Acta Crystallographica Section C","1996","52","7","1691","1693","10.1107/S0108270196001254","","","0.71073","MoKα","","0.0619","0.0589","","0.0755","0.0755","","","","","4.39","4.39","","","","","has coordinates","190398","2020-10-21","18:00:00",""
"2005111","11.059","0.004","14.188","0.005","11.996","0.005","90","","102.39","0.03","90","","1838.4","1.2","300","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H20 O4 -","- C23 H20 O4 -","- C92 H80 O16 -","4","1","DE1017","Mostafa, G.; Ray, S.; Singh, R.; Lahiri, S.","A Multichromophoric Bicyclo[2.2.2]octenone and a Photorearranged Ester Derivative","Acta Crystallographica Section C","1996","52","7","1747","1750","10.1107/S0108270195016696","","","0.7107","MoKα","","","0.047","","","0.052","","","","","1.169","1.169","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005112","6.63","0.003","21.78","0.006","14.759","0.005","90","","98.35","0.03","90","","2108.6","1.3","300","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 O5 -","- C24 H24 O5 -","- C96 H96 O20 -","4","1","DE1017","Mostafa, G.; Ray, S.; Singh, R.; Lahiri, S.","A Multichromophoric Bicyclo[2.2.2]octenone and a Photorearranged Ester Derivative","Acta Crystallographica Section C","1996","52","7","1747","1750","10.1107/S0108270195016696","","","1.5418","CuKα","","","0.063","","","0.064","","","","","1.274","1.274","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005113","20.337","0.003","5.8139","0.0006","13.362","0.002","90","","105.97","0.02","90","","1518.9","0.4","295","2","","","","","","","","","","4","C 1 2 1","C 2y","5","","5'-O-Benzoyl-3'-deoxy-2'-keto-alpha-uridine","","- C16 H14 N2 O6 -","- C16 H14 N2 O6 -","- C64 H56 N8 O24 -","4","1","DE1026","Suresh, C. G.; Sakthivel, K.; Pathak, T.","5'-<i>O</i>-Benzoyl-2',3'-dideoxy-2'-oxo-α-uridine","Acta Crystallographica Section C","1996","52","7","1776","1779","10.1107/S0108270195017082","","","0.71069","MoKα","","0.0823","0.0365","","0.1057","0.0794","","","","0.714","0.776","0.776","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005114","4.8984","0.0004","8.3919","0.0008","7.034","0.001","90","","109.33","0.01","90","","272.83","0.07","294","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- Li Mo O7 P2 -","- Li Mo O7 P2 -","- Li2 Mo2 O14 P4 -","2","1","","","LiMoP~2~O~7~","Acta Crystallographica C","1996","52","","1593","1594","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005115","9.666","0.001","8.062","0.001","12.996","0.001","90","","97.262","0.009","90","","1004.62","0.18","299","2","299","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- H Ni O14 P5 -","- H Ni O14 P5 -","- H4 Ni4 O56 P20 -","4","1","DU1148","Olbertz, A.; Stachel, D.; Svoboda, I.; Fuess, H.","NiHP~5~O~14~ Ultraphosphate","Acta Crystallographica Section C","1996","52","7","1603","1605","10.1107/S0108270196000595","","","0.71093","MoKα","","0.0737","0.0302","","0.0729","0.0636","","","","1.023","1.066","1.066","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005116","8.042","0.0008","8.4045","0.0008","15.174","0.001","105.021","0.008","95.128","0.009","95.326","0.008","979.39","0.16","298","","298","","","","","","","","","8","P -1","-P 1","2","","trans-dichloloro-triethylphosphine-2-n-propylsulfinylpyridine-palladium(II)","","- C14 H26 Cl2 N O P Pd S -","- C14 H26 Cl2 N O P Pd S -","- C28 H52 Cl4 N2 O2 P2 Pd2 S2 -","2","1","FG1058","Rodrigues, A. M. G. D.; do Gambardella, M. T.; Francisco, R. H. P.; de Sousa, G. F.; Filgueiras, C. A. L.","<i>trans</i>-Dichloro(2-<i>n</i>-propylsulfinylpyridine-<i>N</i>)(triethylphosphine-<i>P</i>)palladium(II)","Acta Crystallographica Section C","1996","52","7","1641","1642","10.1107/S0108270196002478","","","0.71073","MoKα","","0.0612","0.0427","","0.0576","0.0476","","","","1.26","1.33","1.33","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005117","7.851","0.001","10.239","0.002","10.869","0.002","63.03","0.01","80.85","0.01","85.97","0.01","768.8","0.2","298","","298","","","","","","","","","4","P -1","-P 1","2","","(4aα, 8α, 8aα)-(+,-)-Octahydro-8-(4-bromobenzoate)-1 (2H)-naphthalenone","","- C17 H19 Br O3 -","- C17 H19 Br O3 -","- C34 H38 Br2 O6 -","2","1","FG1079","Abboud, K. A.; Xie, Y.; Enholm, E. J.","A <i>cis</i>-Fused Decalone and a Bicyclo[4.3.1]decanone Ring System","Acta Crystallographica Section C","1996","52","7","1829","1831","10.1107/S0108270196000121","","","0.71073","MoKα","","0.0881","0.069","","0.0523","0.0476","","","","","1.41","1.41","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005118","12.01","","7.553","","12.134","","90","","110.34","","90","","1032.06","","298","","298","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(±)-endo-5-hydroxy-1-methylbicyclo[4.3.1.]decan-7-one","","- C11 H18 O2 -","- C11 H18 O2 -","- C44 H72 O8 -","4","1","FG1079","Abboud, K. A.; Xie, Y.; Enholm, E. J.","A <i>cis</i>-Fused Decalone and a Bicyclo[4.3.1]decanone Ring System","Acta Crystallographica Section C","1996","52","7","1829","1831","10.1107/S0108270196000121","","","0.71073","MoKα","","0.0771","0.0463","","0.0564","0.0526","","","","","1.55","1.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005119","16.445","0.002","6.3075","0.0006","21.092","0.003","90","","112.02","0.01","90","","2028.2","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-dimethyl-cis-dicloro-μ-bis{meso-1,2-di(phenylsulphinyl)ethane}-tin(IV)","","- C16 H20 Cl2 O2 S2 Sn -","- C16 H20 Cl2 O2 S2 Sn -","- C64 H80 Cl8 O8 S8 Sn4 -","4","1","FG1084","Carvalho, C. C.; Francisco, R. H. P.; do Gambardella, M. T.; de Sousa, G. F.; Filgueiras, C. A. L.","<i>catena</i>-Poly[<i>cis</i>-dichloro-<i>trans</i>-dimethyltin(IV)-μ-<i>meso</i>-1,2-bis(phenylsulfinyl)ethane-<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","1996","52","7","1629","1631","10.1107/S0108270196002466","","","0.71073","MoKα","","0.0577","0.0334","","0.1008","0.0836","","","","1.09","1.038","1.038","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005120","11.356","0.001","11.862","0.001","12.989","0.001","106.88","0.01","102.95","0.01","94.38","0.01","1612.8","0.3","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H40 Cu N4 O9 -","- C26 H36 Cu N4 O13 -","- C52 H72 Cu2 N8 O26 -","2","1","FG1104","Neves, A.; Vencato, I.; Verani, C. N.","Bis[2-(2-pyridylmethylaminomethyl)phenol]copper(II) Diacetate Trihydrate [Cu(HBPA)~2~](CH~3~COO)~2~.3H~2~O","Acta Crystallographica Section C","1996","52","7","1648","1651","10.1107/S0108270196000108","","","0.71073","Mo","","0.08","0.0609","","","0.0823","","","","","1.96","1.96","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005121","15.754","0.004","11.468","0.004","15.084","0.003","90","","108.97","0.02","90","","2577.2","1.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Pt(tpy)(MeIm)](ClO4)2.CH3CN","2,2':6',2''-Terpyridine(1-methylimidazole)platinum(II) Perchlorate Acetonitrile Solvate","","- C21 H20 Cl2 N6 O8 Pt -","- C21 H20 Cl2 N6 O8 Pt -","- C84 H80 Cl8 N24 O32 Pt4 -","4","1","FG1115","Roszak, A. W.; Clement, O.; Buncel, E.","2,2':6',2''-Terpyridine(1-methylimidazole-<i>N</i>^3^)platinum(II) Perchlorate Acetonitrile Solvate","Acta Crystallographica Section C","1996","52","7","1645","1648","10.1107/S0108270196001370","","","0.71069","MoKα","","0.0937","0.0382","","0.1239","0.0939","","","","1.006","1.091","1.091","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2005122","12.365","0.003","13.192","0.003","13.373","0.002","90","","113.38","0.02","90","","2002.3","0.8","170","","170","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 Cl3 N3 Zn -","- C19 H20 Cl3 N3 Zn -","- C76 H80 Cl12 N12 Zn4 -","4","1","FG1168","Parvez, M.; Sabir, A. P.","Clemizoledichlorozinc(II)","Acta Crystallographica Section C","1996","52","7","1651","1653","10.1107/S0108270196003605","","","0.71069","MoKα","","","0.033","","","0.031","","","","","1.273","1.273","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005123","9.802","0.007","21.172","0.005","5.504","0.005","90","","90","","90","","1142.2","1.3","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-(2-deoxy-α-D-erythropentopyranosyl) 1-(R),2-(R)-4,4- dimethylpyrazolidine-3,5-dione","","- C10 H16 N2 O5 -","- C10 H16 N2 O5 -","- C40 H64 N8 O20 -","4","1","FG1174","Kolb, V. M.; Colloton, P. A.; Robinson, P. D.; Lutfi, H. G.; Meyers, C. Y.","(1<i>R</i>,2<i>R</i>)-4,4-Dimethylpyrazolidine-3,5-dione-α-<small>D</small>-pyranosyl-2-deoxyriboside","Acta Crystallographica Section C","1996","52","7","1781","1784","10.1107/S0108270196004416","","","0.71069","MoKα","","","0.058","","","0.048","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005124","15.312","0.005","10.3","0.003","17.554","0.005","90","","93.68","0.03","90","","2762.8","1.4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(Bromodifluoromethyl)diphenylphosphine sulfide","","- C13 H10 Br F2 P S -","- C13 H10 Br F2 P S -","- C104 H80 Br8 F16 P8 S8 -","8","1","FG1182","Jones, P. G.","(Bromodifluoromethyl)diphenylphosphine Sulfide","Acta Crystallographica Section C","1996","52","7","1793","1795","10.1107/S0108270196004489","","","0.71073","MoKα","","0.0432","0.0313","","0.0856","0.0749","","","","1.065","1.043","1.043","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005125","4.098","0.003","25.665","0.002","12.989","0.003","90","","97.22","0.05","90","","1355.3","1.1","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 N3 O3 S -","- C14 H11 N3 O3 S -","- C56 H44 N12 O12 S4 -","4","1","HA1152","Zhang, D.-C.; Zhang, Y.-Q.; Cao, Y.; Zhao, B.","1-Benzoyl-3-(4-nitrophenyl)thiourea","Acta Crystallographica Section C","1996","52","7","1716","1718","10.1107/S0108270196001047","","","0.7107","MoKα","","","0.034","","","0.044","","","","","1.63","1.63","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005126","11.614","0.014","5.288","0.005","10.602","0.015","90","","110.02","0.03","90","","611.8","1.3","150","0.2","150","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,6-bis(1,3-dioxolan-2-one)-2,5-dithiahexane","","- C10 H14 O6 S2 -","- C10 H14 O6 S2 -","- C20 H28 O12 S4 -","2","0.5","HA1158","Blake, A. J.; Parsons, S.; Richtzenhain, H.; Schröder, M.","2,5-Dithiahexane-1,6-diyl-4,4'-bis(1,3-dioxolan-2-one)","Acta Crystallographica Section C","1996","52","7","1699","1701","10.1107/S0108270196001515","","","0.71073","MoKα","","0.0903","0.0732","","0.1948","0.1749","","","","1.162","1.217","1.217","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005127","10.492","0.002","11.436","0.002","9.334","0.001","92.04","0.01","97.31","0.02","110.68","0.02","1035.4","0.3","294","","","","","","","","","","","4","P -1","-P 1","2","","","","- C23 H25 N3 S -","- C23 H25 N3 S -","- C46 H50 N6 S2 -","2","1","JZ1081","Ergin, Ö.; Sillanpää, R.; Yeşilada, A.","5-Benzylidene-8-ethylthiocarbamoyl-9-phenyl-7,8-diazabicyclo[4.3.0]non-6-ene","Acta Crystallographica Section C","1996","52","7","1770","1772","10.1107/S0108270195015794","","","0.71069","MoKα","","","0.037","","","0.044","","","","","1.46","1.46","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005128","6.689","0.006","8.79","0.009","9.447","0.008","95.23","0.09","104.88","0.07","92.21","0.06","533.5","0.9","153","2","153","2","","","","","","","","5","P -1","-P 1","2","TAPSO","3-(N-tris(hydroxymethyl) methylamino)-2-hydroxy-propanesulfonic acid","","- C7 H17 N O7 S -","- C7 H17 N O7 S -","- C14 H34 N2 O14 S2 -","2","1","JZ1092","Wouters, J.; Stalke, D.","TAPSO at Low Temperature","Acta Crystallographica Section C","1996","52","7","1684","1686","10.1107/S0108270196001199","","","0.71073","MoKα","","0.0461","0.0379","","0.1401","0.1001","","","","1.074","1.093","1.093","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005129","11.804","0.003","11.392","0.003","16.256","0.004","90","","90","","90","","2186","1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H18 N2 O4 S -","- C8 H18 N2 O4 S -","- C64 H144 N16 O32 S8 -","8","1","JZ1093","Wouters, J.; Häming, L.; Sheldrick, G.","HEPES","Acta Crystallographica Section C","1996","52","7","1687","1688","10.1107/S0108270196001187","","","1.54178","CuKα","","0.0501","0.0487","","0.1362","0.1334","","","","1.103","1.114","1.114","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005130","5.579","0.002","8.014","0.002","12.014","0.002","95.72","0.01","95.72","0.01","92.54","0.02","531","0.2","102","","","","","","","","","","","3","P -1","-P 1","2","","","","- C9 H21 P -","- C9 H21 P -","- C18 H42 P2 -","2","1","JZ1100","Bruckmann, J.; Krüger, C.","Tris(<i>n</i>-propyl)phosphine and Tris(isopropyl)phosphine","Acta Crystallographica Section C","1996","52","7","1733","1736","10.1107/S0108270195017100","","","0.71073","MoKα","","","0.051","","","0.068","","","","","1.73","1.73","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005131","8.622","0.003","14.368","0.002","8.928","0.002","90","","106.19","0.02","90","","1062.1","0.5","102","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H21 P -","- C9 H21 P -","- C36 H84 P4 -","4","1","JZ1100","Bruckmann, J.; Krüger, C.","Tris(<i>n</i>-propyl)phosphine and Tris(isopropyl)phosphine","Acta Crystallographica Section C","1996","52","7","1733","1736","10.1107/S0108270195017100","","","0.71073","MoKα","","","0.078","","","0.101","","","","","1.75","1.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005132","10.741","0.002","20.532","0.004","8.776","0.002","90","","90","","90","","1935.4","0.7","293","2","293","2","","","","","","","","6","C m c m","-C 2c 2","63","","Bis(1,3-diaminopropane(diiodo)platinum(IV) Diiodide Dihydrate","","- C6 H24 I4 N4 O2 Pt -","- C6 H24 I4 N4 O2 Pt -","- C24 H96 I16 N16 O8 Pt4 -","4","0.25","JZ1105","Pajunen, A.; Oksanen, A.; Leskelä, M.","Bis(1,3-diaminopropane)diiodoplatinum(IV) Diiodide Dihydrate","Acta Crystallographica Section C","1996","52","7","1643","1645","10.1107/S0108270196002235","","","0.71073","MoKα","","0.055","0.0328","","0.0788","0.0741","","","","0.923","1.046","1.046","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005133","10.004","0.003","10.168","0.002","12.166","0.004","75.02","0.03","88.21","0.03","61.36","0.03","1042.9","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aquotriglycinecerium(III) hexacyanoferrate(III) monohydrate.","","- C24 H38 Ce2 Fe2 N18 O16 -","- C24 H38 Ce2 Fe2 N18 O16 -","- C24 H38 Ce2 Fe2 N18 O16 -","1","0.5","JZ1110","García-Granda, S.; Morales, A. D.; Ruíz, E. R.; Fernández Bertrán, J.","Aqua(hexacyanoferrato-<i>N</i>)bis(μ-glycine)glycinecerium(III) Monohydrate","Acta Crystallographica Section C","1996","52","7","1679","1681","10.1107/S0108270196003149","","","0.71073","MoKα","","0.0234","0.0188","","0.0486","0.0471","","","","1.083","1.097","1.097","","","","","has coordinates","249787","2020-10-21","18:00:00",""
"2005134","8.699","0.001","26.465","0.001","7.769","0.001","90","","95.23","0.01","90","","1781.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-(tert-butyl)-4-methyl-2-phenyl-3-[(trimethylsilyl)oxy]oxetane","3-(1,1-dimethylethyl)-4-methyl-2-phenyl-3-[(trimethylsilyl)oxy]oxacyclobutane","","- C17 H28 O2 Si -","- C17 H28 O2 Si -","- C68 H112 O8 Si4 -","4","1","JZ1113","Kotila, S.; Jäntti, A.; Penttinen, S.; Bach, T.","3-<i>tert</i>-Butyl-4-methyl-2-phenyl-3-(trimethylsilyloxy)oxetane and 2-(2-Benzyloxyphenyl)-3-<i>tert</i>-butyl-3-(trimethylsilyloxy)oxetane","Acta Crystallographica Section C","1996","52","7","1722","1725","10.1107/S0108270196002740","","","1.54178","CuKα","","0.061","0.055","","0.181","0.163","","","","1.075","1.096","1.096","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005135","14.701","0.002","10.153","0.001","15.42","0.002","90","","96.26","0.01","90","","2287.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(2-Benzyloxyphenyl)-3-(tert-butyl)-3-[(trimethylsilyl)oxy]oxetane","2-(2-benzyloxyphenyl)-3-(1,1-dimethylethyl)-3-[(trimethylsilyl)oxy]- oxacyclobutane","","- C23 H32 O3 Si -","- C23 H32 O3 Si -","- C92 H128 O12 Si4 -","4","1","JZ1113","Kotila, S.; Jäntti, A.; Penttinen, S.; Bach, T.","3-<i>tert</i>-Butyl-4-methyl-2-phenyl-3-(trimethylsilyloxy)oxetane and 2-(2-Benzyloxyphenyl)-3-<i>tert</i>-butyl-3-(trimethylsilyloxy)oxetane","Acta Crystallographica Section C","1996","52","7","1722","1725","10.1107/S0108270196002740","","","0.71073","MoKα","","0.072","0.046","","0.147","0.123","","","","1.052","1.073","1.073","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005136","7.237","0.002","10.434","0.001","17.45","0.002","90","","99.42","0.01","90","","1299.9","0.4","123","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H13 Br N2 S Se -","- C11 H13 Br N2 S Se -","- C44 H52 Br4 N8 S4 Se4 -","4","1","KA1156","Billing, D. G.; Boeyens, J. C. A.; Lai, L.-L.; Reid, D. H.","5-Ethylamino-3-<i>p</i>-tolyl-1λ^4^,2,4-thiaselenazol-1-ylium Bromide: a New Heteroaromatic System","Acta Crystallographica Section C","1996","52","7","1718","1719","10.1107/S0108270195017252","","","0.71069","MoKα","","","0.0355","","","0.0969","","","","","0.983","0.983","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005137","3.916","0.0008","15.019","0.003","26.479","0.005","90","","94.83","0.02","90","","1551.8","0.5","291","2","291","2","","","","","","","","4","P 1 21 1","P 2yb","4","Solvent Violet 13, Disperse Blue 72","1-hydroxy-4-[(4-methylphenyl)amino]-9,10-anthracenedione","","- C21 H15 N O3 -","- C21 H15 N O3 -","- C84 H60 N4 O12 -","4","2","KA1165","Yatsenko, A. V.; Zhukov, S. G.; Medvedev, S. V.; Stalnaya, T. V.","Phase Transition and Expected Non-Linear Polarizability of 1-Hydroxy-4-(4-methylphenylamino)-9,10-anthraquinone","Acta Crystallographica Section C","1996","52","7","1853","1856","10.1107/S0108270196000625","","","0.71073","MoKα","","0.1117","0.042","","0.0853","0.0692","","","","0.888","1.218","1.218","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005138","11.0672","0.0008","17.685","0.0012","12.0475","0.0008","90","","111.945","0.005","90","","2187.1","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","morusin","2-(2,4-dihydroxyphenyl)-5-hydroxy-3-(3-methyl-2-butenyl)-4H-6,6-dimethylpyrano- [2,3-h]-1-benzopyran-4-one","","- C25 H24 O6 -","- C25 H24 O6 -","- C100 H96 O24 -","4","1","KA1170","Uchida, A.; Mizutani, H.; Ohshima, S.; Oonishi, I.; Hano, Y.; Fukai, T.; Nomura, T.","Morusin and Morusin Dimethyl Ether","Acta Crystallographica Section C","1996","52","7","1713","1716","10.1107/S0108270196001382","","","1.5418","CuKα","","0.08","0.0605","","0.2162","0.1848","","","","0.787","0.778","0.778","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005139","11.326","0.002","11.806","0.002","9.688","0.002","99.87","0.02","103.31","0.02","105.73","0.01","1175","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","morusindimethylether","2-(2,4-dimethoxyphenyl)-5-hydroxy-3-(3-methyl-2-butenyl)-4H-6,6-dimethylpyrano- [2,3-h]-1-benzopyran-4-one","","- C27 H28 O6 -","- C27 H28 O6 -","- C54 H56 O12 -","2","1","KA1170","Uchida, A.; Mizutani, H.; Ohshima, S.; Oonishi, I.; Hano, Y.; Fukai, T.; Nomura, T.","Morusin and Morusin Dimethyl Ether","Acta Crystallographica Section C","1996","52","7","1713","1716","10.1107/S0108270196001382","","","1.5418","CuKα","","0.0546","0.0495","","0.1539","0.1422","","","","0.699","0.693","0.693","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005140","10.08","0.007","12.972","0.007","19.874","0.013","90","","100.22","0.06","90","","2557","3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dicyanamidebis(1,10-phenanthroline)copper(II) Tricyanomethanide.","","- C30 H16 Cu N10 -","- C30 H16 Cu N10 -","- C120 H64 Cu4 N40 -","4","1","KA1175","Potočňák, I.; Dunaj-Jurčo, M.; Mikloš, D.; Jäger, L.","(Dicyanamido)bis(1,10-phenanthroline)copper(II) Tricyanomethanide","Acta Crystallographica Section C","1996","52","7","1653","1655","10.1107/S010827019600296X","","","0.71073","MoKα","","0.1095","0.0487","","0.1284","0.1013","","","","1.022","1.145","1.145","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005141","7.087","0.002","10.2878","0.0015","19.539","0.003","88.82","0.012","85.49","0.02","72.92","0.02","1357.5","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Sodium 1,12-dodecylene disulfate hydrate","","- C12 H25.33 Na2 O8.67 S2 -","- C12 H25.3333 Na2 O8.66667 S2 -","- C36 H76 Na6 O26 S6 -","3","1.5","KA1176","Rudert, R.; Czichocki, G.","Sodium 1,12-Dodecylene Disulfate Hydrate","Acta Crystallographica Section C","1996","52","7","1670","1673","10.1107/S0108270196003071","","","0.71073","MoKα","","0.0852","0.0504","","0.162","0.1366","","","","1.021","1.054","1.054","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005142","6.6813","0.0004","14.7787","0.0009","10.2608","0.0009","90","","96.29","0.02","90","","1007.06","0.13","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","His-Tyr dihydrochloride dihydrate","L-Histidyl-L-tyrosinium dichloride dihydrate","","- C15 H24 Cl2 N4 O6 -","- C15 H24 Cl2 N4 O6 -","- C30 H48 Cl4 N8 O12 -","2","1","KA1180","Steiner, Th.","<small>L</small>-Histidyl-<small>L</small>-tyrosinium Dichloride Dihydrate, C~15~H~20~N~4~O~4~^2+^.2Cl^{-^}.2H~2~O","Acta Crystallographica Section C","1996","52","7","1845","1847","10.1107/S0108270196002430","","","1.54176","CuKα","","0.0329","0.0257","","0.0825","0.066","","","","1.101","1.107","1.107","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005143","7.3732","0.0007","11.0354","0.0009","13.82","0.001","90","","90","","90","","1124.48","0.16","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 N6 -","- C12 H10 N6 -","- C48 H40 N24 -","4","1","KH1014","Liou, L.-S.; Chen, P.-S.; Sun, C.-H.; Wang, J.-C.","An Orthorhombic Phase of 3,6-Di(2-pyridyl)-1,4-dihydro-1,2,4,5-tetrazine","Acta Crystallographica Section C","1996","52","7","1841","1843","10.1107/S0108270195016635","","","0.71073","MoKα","","","0.0313","","","0.0379","","","","","0.91","0.91","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005144","10.4375","0.0007","15.835","0.001","11.0997","0.0008","90","","104.151","0.006","90","","1778.9","0.2","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[Cis-dichloro-trans-dimethyl-μ-(meso-1,2-bis(n-propilsulfinyl)ethane)tin(IV)]","","- C10 H24 Cl2 O2 S2 Sn -","- C10 H24 Cl2 O2 S2 Sn -","- C40 H96 Cl8 O8 S8 Sn4 -","4","1","KH1065","Carvalho, C. C.; Francisco, R. H. P.; do Gambardella, M. T.; de Sousa, G. F.; Filgueiras, C. A. L.","<i>catena</i>-Poly[<i>cis</i>-dichloro-<i>trans</i>-dimethyltin(IV)-μ-<i>meso</i>-1,2-bis(propylsulfinyl)ethane-<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","1996","52","7","1627","1629","10.1107/S0108270196002090","","","0.7107","MoKα","","","0.0325","","","0.0927","","","","","1.098","1.098","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005145","6.713","0.003","12.602","0.004","10.869","0.006","90","","94.1","0.05","90","","917.1","0.7","296","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H9 N O4 -","- C10 H9 N O4 -","- C40 H36 N4 O16 -","4","1","KH1080","Okabe, N.; Miura, J.; Shimosaki, A.","Kynurenic Acid Monohydrate","Acta Crystallographica Section C","1996","52","7","1827","1829","10.1107/S0108270196001734","","","0.71069","MoKα","","","0.096","","","0.079","","","","","1.62","1.62","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2005146","9.089","0.002","9.418","0.003","12.575","0.008","89.45","0.04","105.25","0.03","91.85","0.02","1038","0.8","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H24 In O P -","- C22 H24 In O P -","- C44 H48 In2 O2 P2 -","2","1","KH1081","Wang, W.; Pan, Y.; Huang, X.; Sun, H.; Lu, Z.; Sun, X.","(5-Benzyldibenzo[<i>b</i>,<i>d</i>]phosphole 5-oxide)trimethylindium","Acta Crystallographica Section C","1996","52","7","1661","1663","10.1107/S0108270196001606","","","0.71073","MoKα","","","0.044","","","0.057","","","","","1.9","1.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005147","12.71","0.004","20.41","0.006","7.325","0.004","99.86","0.03","99.44","0.03","92.55","0.02","1841.6","1.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","8OCB","4'-octyloxy-4-cyanobiphenyl","","- C21 H25 N O -","- C21 H25 N O -","- C84 H100 N4 O4 -","4","2","KH1089","Hori, K.; Kurosaki, M.; Wu, H.; Itoh, K.","Two Crystal Forms of 4'-octyloxy-4-cyanobiphenyl (8OCB)","Acta Crystallographica Section C","1996","52","7","1751","1754","10.1107/S0108270196003447","","","1.5418","CuKα","","0.2183","0.0845","","0.3781","0.2315","","","","0.911","0.906","0.906","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005148","8.551","0.003","36.14","0.01","5.857","0.002","90","","95.09","0.03","90","","1802.9","1","243","2","243","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","8OCB","4'-octyloxy-4-cyanobiphenyl","","- C21 H25 N O -","- C21 H25 N O -","- C84 H100 N4 O4 -","4","1","KH1089","Hori, K.; Kurosaki, M.; Wu, H.; Itoh, K.","Two Crystal Forms of 4'-octyloxy-4-cyanobiphenyl (8OCB)","Acta Crystallographica Section C","1996","52","7","1751","1754","10.1107/S0108270196003447","","","0.7107","MoKα","","0.1004","0.0674","","0.2524","0.2313","","","","0.682","0.735","0.735","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005149","10.004","0.001","10.273","0.001","14.719","0.001","90","","90","","90","","1512.7","0.2","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H20 O4 S -","- C15 H20 O4 S -","- C60 H80 O16 S4 -","4","1","LI1145","Zukerman-Schpector, J.; Monteiro, H. J.","Intermediates in the Synthesis of (+)-Grandisol. I","Acta Crystallographica Section C","1996","52","7","1767","1770","10.1107/S0108270196004222","","","0.71073","MoKα","","0.1035","0.0681","","0.2031","0.1613","","","","1.119","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005150","7.64","0.001","9.842","0.001","11.059","0.001","116.16","0.01","100.76","0.01","90.26","0.01","729.69","0.16","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H20 O4 S -","- C15 H20 O4 S -","- C30 H40 O8 S2 -","2","1","LI1145","Zukerman-Schpector, J.; Monteiro, H. J.","Intermediates in the Synthesis of (+)-Grandisol. I","Acta Crystallographica Section C","1996","52","7","1767","1770","10.1107/S0108270196004222","","","0.71073","MoKα","","0.0578","0.0448","","0.1304","0.1152","","","","1.084","1.063","1.063","","","","","has coordinates","190596","2020-10-21","18:00:00",""
"2005151","9.36","0.002","9.845","0.002","15.216","0.004","85.18","0.02","77.79","0.02","63.75","0.02","1229","0.5","118","1","","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H28 N2 O6 V -","- C28 H28 N2 O7 V -","- C56 H56 N4 O14 V2 -","2","1","MU1216","Hope, H.; Borer, L. L.","5,5'-(2-Hydroxy-1,3-propandiyldiamino)bis(1-phenyl-1,3-hexanedionato-<i>O</i>,<i>O</i>')oxovanadium(IV), [VO(C~27~H~28~N~2~O~5~)]","Acta Crystallographica Section C","1996","52","7","1621","1624","10.1107/S0108270196002636","","","1.54178","CuKα","","0.0908","0.065","","0.1668","0.147","","","","","1.054","1.054","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2005152","14.15","0.003","6.257","0.002","12.433","0.002","90","","109.4","0.01","90","","1038.3","0.4","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,5,6,7,8,9-Hexahydro-10-hydroxy-5,9-methano-4H-thieno[3,2-c]azonine, C~11~H~15~NOS","","- C11 H15 N O S -","- C11 H15 N O S -","- C44 H60 N4 O4 S4 -","4","1","MU1226","Kozísek, J.; Berkes, D.; Svoboda, I.; Decroix, B.","5,6,7,8,9,10-Hexahydro-10-hydroxy-5,9-methano-4<i>H</i>-thieno[3,2-<i>c</i>]azonine","Acta Crystallographica Section C","1996","52","7","1825","1826","10.1107/S0108270196002612","","","0.71069","MoKα","","0.0329","0.0305","","0.0831","0.0812","","","","1.082","1.096","1.096","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005153","9.3096","0.0008","7.9319","0.0009","10.4302","0.0008","90","","95.297","0.007","90","","766.91","0.12","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 Co N2 O10 -","- C14 H12 Co N2 O10 -","- C28 H24 Co2 N4 O20 -","2","0.5","MU1229","Okabe, N.; Miura, J.; Shimosaki, A.","A Hydrated Cobalt(II) Complex of Quinolinic Acid: <i>trans</i>-[Co(C~7~H~4~NO~4~)~2~(H~2~O)~2~]","Acta Crystallographica Section C","1996","52","7","1610","1612","10.1107/S0108270196002314","","","0.71069","MoKα","","","0.032","","","0.056","","","","","2.73","2.73","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005154","9.57","0.002","15.15","0.004","14.602","0.002","90","","99.21","0.02","90","","2089.8","0.8","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 Cd Cl2 N4 -","- C24 H16 Cd Cl2 N4 -","- C96 H64 Cd4 Cl8 N16 -","4","1","MU1246","Wang, H.; Xiong, R.-G.; Chen, H.-Y.; Huang, X.-Y.; You, X.-Z.","<i>cis</i>-Dichlorobis(1,10-phenanthroline-<i>N</i>^1^,<i>N</i>^10^)cadmium(II)","Acta Crystallographica Section C","1996","52","7","1658","1661","10.1107/S0108270196002326","","","0.71069","MoKα","","","0.04","","","0.053","","","","","1.63","1.63","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005155","16.363","0.002","5.8964","0.0004","16.347","0.001","90","","96.84","0.01","90","","1566","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Pentafluorophhenyl)diphenylphosphine.","","- C18 H10 F5 P -","- C18 H10 F5 P -","- C72 H40 F20 P4 -","4","1","MU1247","bin Shawkataly, O.; Chong, M.-L.; Fun, H.-K.; Sivakumar, K.","(Pentafluorophenyl)diphenylphosphine","Acta Crystallographica Section C","1996","52","7","1725","1727","10.1107/S0108270196001540","","","0.71073","MoKα","","0.0759","0.0402","","0.1266","0.1027","","","","0.921","0.972","0.972","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005156","8.222","0.002","12.244","0.003","17.277","0.004","90","","99","0.01","90","","1717.9","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 2-Methoxycarbonylamino-3,3-diphenylpropionate","","- C18 H19 N O4 -","- C18 H19 N O4 -","- C72 H76 N4 O16 -","4","1","MU1257","Cativiela, C.; Díaz-de-Villegas, M. D.; Gálvez, J. A.","Methyl 2-Methoxycarbonylamino-3,3-diphenylpropionate, an Interesting Diphenylalanine (DIP) Derivative","Acta Crystallographica Section C","1996","52","7","1789","1791","10.1107/S0108270196004052","","","0.71073","MoKα","","0.2105","0.0742","","0.2042","0.1431","","","","1.015","1.234","1.234","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005157","12.533","0.002","7.6536","0.0009","16.804","0.002","90","","101.03","0.01","90","","1582.1","0.4","293","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C15 H25 N3 O2 -","- C15 H25 N3 O2 -","- C60 H100 N12 O8 -","4","1","NA1214","Saviano, M.; Lombardi, A.; Pavone, V.; Yamada, T.; Yanagi, T.; Iwamoto, A.; Kuwata, S.","A Racemic Bicyclic Acylamidine from a Tripeptide Derivative","Acta Crystallographica Section C","1996","52","7","1705","1708","10.1107/S0108270196001102","","","1.54056","CuKα","","","0.045","","","0.042","","","","","0.802","0.802","","","","","has coordinates,has disorder","198895","2020-10-21","18:00:00",""
"2005158","9.835","0.001","13.484","0.001","5.44","0.001","93.51","0.01","93.68","0.01","91.462","0.01","718.27","0.16","293","","20","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H14 N2 O2 S -","- C15 H14 N2 O2 S -","- C30 H28 N4 O4 S2 -","2","1","NA1222","Cao, Y.; Zhao, B.; Zhang, Y.-Q.; Zhang, D.-C.","1-Benzoyl-3-(4-methoxyphenyl)thiourea","Acta Crystallographica Section C","1996","52","7","1772","1774","10.1107/S0108270196001989","","","0.7107","MoKα","","","0.033","","","0.048","","","","","1.51","1.51","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005159","10.156","0.001","10.751","0.002","13.007","0.002","90","","90","","90","","1420.2","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Z-2-Phenyl-4-[(S)-2,2-dimethyl-1,3-dioxolan-4-ylmethylen]-5(4H)-oxazolone.","","- C15 H15 N O4 -","- C15 H15 N O4 -","- C60 H60 N4 O16 -","4","1","NA1223","Buñuel, E.; Cativiela, C.; Díaz-de-Villegas, M. D.; Gálvez, J. A.; Jiménez, A. I.","(<i>Z</i>)-4-[(<i>S</i>)-2,2-Dimethyl-1,3-dioxolan-4-ylmethylidene]-2-phenyl-1,3-oxazol-5(4<i>H</i>)-one","Acta Crystallographica Section C","1996","52","7","1810","1813","10.1107/S0108270196004246","","","0.71073","MoKα","","0.0742","0.0483","","0.1561","0.1363","","","","1.051","1.086","1.086","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005160","4.809","0.003","17.846","0.004","8.825","0.005","90","","93.68","0.03","90","","755.8","0.7","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H19 N3 O3 -","- C14 H19 N3 O3 -","- C28 H38 N6 O6 -","2","1","NA1224","Puliti, R.; De Sena, C.; Mattia, C. A.","<i>N</i>-Acetyl-<small>L</small>-phenylalanyl-<small>L</small>-alaninamide","Acta Crystallographica Section C","1996","52","7","1820","1823","10.1107/S0108270196002910","","","1.54056","CuKα","","","0.047","","","0.045","","","","","0.93","0.93","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2005161","5.222","0.001","5.406","0.001","10.838","0.002","90.89","0.01","92.34","0.01","110.02","0.01","287.09","0.09","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","DL-Valine","","- C5 H11 N O2 -","- C5 H11 N O2 -","- C10 H22 N2 O4 -","2","1","NA1226","Dalhus, B.; Görbitz, C. H.","Triclinic Form of <small>DL</small>-Valine","Acta Crystallographica Section C","1996","52","7","1759","1761","10.1107/S0108270196002491","","","0.71069","MoKα","","0.0478","0.0452","","0.1201","0.1177","","","","1.141","1.163","1.163","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005162","9.441","0.002","5.222","0.001","11.337","0.004","90","","109","0.02","90","","528.5","0.2","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","L-cysteine","","- C3 H7 N O2 S -","- C3 H7 N O2 S -","- C12 H28 N4 O8 S4 -","4","2","NA1229","Görbitz, C. H.; Dalhus, B.","<small>L</small>-Cysteine, Monoclinic Form, Redetermination at 120K","Acta Crystallographica Section C","1996","52","7","1756","1759","10.1107/S0108270196003952","","","0.71069","MoKα","","0.0323","0.0311","","0.0836","0.0825","","","","1.066","1.071","1.071","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2005163","9.743","0.006","19.027","0.004","6.973","0.003","90","","100.68","0.04","90","","1270.3","1","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H10 Cl N3 O4 S2 -","- C7 H10 Cl N3 O4 S2 -","- C28 H40 Cl4 N12 O16 S8 -","4","1","PA1190","Pedregosa, J. C.; Borrás, J.; Fustero, S.; García-Granda, S.; Díaz, M. R.","A New Precursor of 1,3,4-Thiadiazolesulfonamides: 5-<i>tert</i>-Butyloxycarbonylamino-1,3,4-thiadiazole-2-sulfonyl Chloride","Acta Crystallographica Section C","1996","52","7","1849","1851","10.1107/S0108270196000017","","","0.71073","MoKα","","","0.036","","","0.036","","","","","2.027","2.027","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005164","33.979","0.007","6.398","0.001","16.999","0.003","90","","71.69","0.03","90","","3508.4","1.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Chromen","3,3-diphenyl-[3H]-naphto[2,1-b]pyrane","","- C25 H18 O -","- C25 H18 O -","- C200 H144 O8 -","8","1","PA1201","Aldoshin, S.; Chuev, I.; Utenyshev, A.; Filipenko, O.; Pozzo, J. L.; Lokshin, V.; Guglielmetti, R.","Specific Structural Features and Photochemical Properties of Three Benzo-Annulated 2,2-Diphenyl[2<i>H</i>]chromenes","Acta Crystallographica Section C","1996","52","7","1834","1838","10.1107/S0108270195016209","","","0.71069","MoKα","","0.0633","0.05","","0.0633","0.05","","","","1.052","1.052","1.052","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005165","12.554","0.008","10.631","0.007","17.393","0.009","90","","106.12","0.02","90","","2230","2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Chromen","1,3,3-triphenyl-[3H]-naphto[2,1-b]pyrane","","- C31 H22 O -","- C31 H22 O -","- C124 H88 O4 -","4","1","PA1201","Aldoshin, S.; Chuev, I.; Utenyshev, A.; Filipenko, O.; Pozzo, J. L.; Lokshin, V.; Guglielmetti, R.","Specific Structural Features and Photochemical Properties of Three Benzo-Annulated 2,2-Diphenyl[2<i>H</i>]chromenes","Acta Crystallographica Section C","1996","52","7","1834","1838","10.1107/S0108270195016209","","","0.71069","MoKα","","0.226","0.051","","0.226","0.051","","","","1.16","1.701","1.701","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005166","10.531","0.006","21.637","0.009","8.55","0.007","90","","99.98","0.02","90","","1919","2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Chromen","3,3-diphenyl-8,9-pentamethyl-[3H]-furano[3,2-f]chromene or 7,7-diphenyl-[7H]-benzofurano[2,3-g]chromene","","- C27 H18 O2 -","- C27 H18 O2 -","- C108 H72 O8 -","4","1","PA1201","Aldoshin, S.; Chuev, I.; Utenyshev, A.; Filipenko, O.; Pozzo, J. L.; Lokshin, V.; Guglielmetti, R.","Specific Structural Features and Photochemical Properties of Three Benzo-Annulated 2,2-Diphenyl[2<i>H</i>]chromenes","Acta Crystallographica Section C","1996","52","7","1834","1838","10.1107/S0108270195016209","","","1.54178","CuKα","","0.0551","0.0432","","0.0551","0.0432","","","","0.75","0.75","0.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005167","6.933","0.002","22.519","0.004","7.408","0.002","90","","94.6","0.03","90","","1152.8","0.5","293","","293","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","γ-Lactone","methyl 11-oxa-10-oxobicyclo[6.3.0]undec-2-ene-9-carboxylate","","- C12 H16 O4 -","- C12 H16 O4 -","- C48 H64 O16 -","4","1","PA1219","Pèpe, G.; Astier, J.-P.; Lamarque, L.; Méou, A.; Brun, P.","γ-Lactones: Methyl 11-Oxa-10-oxobicyclo[6.3.0]undec-4-ene-9-carboxylate, Methyl 11-Oxa-10-oxobicyclo[6.3.0]undec-2-ene-9-carboxylate and Methyl 9-Oxa-10-oxobicyclo[6.3.0]undecane-11-carboxylate","Acta Crystallographica Section C","1996","52","7","1695","1699","10.1107/S010827019600193X","","","1.5418","CuKα","","0.0479","0.0479","","0.0479","0.0479","","","","0.71","0.71","0.71","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2005168","7.116","0.002","23.074","0.004","7.266","0.002","90","","100.45","0.03","90","","1173.2","0.5","293","","293","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","γ-Lactone","methyl 11-oxa-10-oxobicyclo[6.3.0]undec-4-ene-9-carboxylate","","- C12 H16 O4 -","- C12 H16 O4 -","- C48 H64 O16 -","4","1","PA1219","Pèpe, G.; Astier, J.-P.; Lamarque, L.; Méou, A.; Brun, P.","γ-Lactones: Methyl 11-Oxa-10-oxobicyclo[6.3.0]undec-4-ene-9-carboxylate, Methyl 11-Oxa-10-oxobicyclo[6.3.0]undec-2-ene-9-carboxylate and Methyl 9-Oxa-10-oxobicyclo[6.3.0]undecane-11-carboxylate","Acta Crystallographica Section C","1996","52","7","1695","1699","10.1107/S010827019600193X","","","1.5418","CuKα","","0.0424","0.0424","","0.0424","0.0424","","","","0.64","0.64","0.64","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2005169","7.147","0.002","23.199","0.004","7.357","0.002","90","","100.5","0.03","90","","1199.4","0.5","293","","293","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","γ-Lactone","methyl 9-oxa-10-oxobicyclo[6.3.0]undecane-11-carboxylate","","- C12 H18 O4 -","- C12 H18 O4 -","- C48 H72 O16 -","4","1","PA1219","Pèpe, G.; Astier, J.-P.; Lamarque, L.; Méou, A.; Brun, P.","γ-Lactones: Methyl 11-Oxa-10-oxobicyclo[6.3.0]undec-4-ene-9-carboxylate, Methyl 11-Oxa-10-oxobicyclo[6.3.0]undec-2-ene-9-carboxylate and Methyl 9-Oxa-10-oxobicyclo[6.3.0]undecane-11-carboxylate","Acta Crystallographica Section C","1996","52","7","1695","1699","10.1107/S010827019600193X","","","1.5418","CuKα","","0.0442","0.0442","","0.0442","0.0442","","","","0.66","0.66","0.66","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2005170","14.424","0.004","14.424","0.004","9.996","0.006","90","","90","","120","","1801.1","1.3","120","2","120","2","","","","","","","","4","P 61","P 61","169","","","","- C8 H16 N2 O3 -","- C8 H16 N2 O3 -","- C48 H96 N12 O18 -","6","1","PA1220","Görbitz, C. H.; Gundersen, E.","<small>L</small>-Valyl-<small>L</small>-alanine","Acta Crystallographica Section C","1996","52","7","1764","1767","10.1107/S0108270196002302","","","0.71069","MoKα","","0.2111","0.0854","","0.1685","0.1326","","","","0.954","1.257","1.257","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005171","9.562","0.002","5.301","0.001","14.519","0.003","90","","94.2","0.02","90","","734","0.3","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-leucine","","- C6 H13 N O2 -","- C6 H13 N O2 -","- C24 H52 N4 O8 -","4","2","PA1221","Görbitz, C. H.; Dalhus, B.","Redetermination of <small>L</small>-Leucine at 120K","Acta Crystallographica Section C","1996","52","7","1754","1756","10.1107/S0108270196002296","","","0.71069","MoKα","","0.0491","0.0435","","0.1044","0.1015","","","","1.086","1.116","1.116","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005172","6.2084","0.0007","13.0294","0.0014","15.0456","0.0011","90","","95.709","0.006","90","","1211","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(Isopropylamino)-4-methyl-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-dioxide","","- C10 H14 N4 O2 S -","- C10 H14 N4 O2 S -","- C40 H56 N16 O8 S4 -","4","1","PA1225","Dupont, L.; Pirotte, B.; de Tullio, P.; Delarge, J.","3-Isopropylamino-4-methyl-4<i>H</i>-pyrido[4,3-<i>e</i>][1,2,4]thiadiazine 1,1-Dioxide","Acta Crystallographica Section C","1996","52","7","1741","1743","10.1107/S0108270196001941","","","1.5418","CuKα","","0.0588","0.0465","","0.1519","0.1458","","","","1.072","1.186","1.186","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005173","31.067","0.005","4.717","0.001","9.851","0.002","90","","91.37","0.02","90","","1443.2","0.5","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","DL-Norleucine","","- C6 H13 N O2 -","- C6 H13 N O2 -","- C48 H104 N8 O16 -","8","1","PA1228","Dalhus, B.; Görbitz, C. H.","<small>DL</small>-Norleucine, β Form at 120K","Acta Crystallographica Section C","1996","52","7","1761","1764","10.1107/S0108270196003642","","","0.71069","MoKα","","0.1023","0.0572","","0.121","0.1075","","","","0.914","1.035","1.035","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005174","22.934","0.005","21.728","0.004","11.217","0.002","90","","90","","90","","5589.5","1.9","193","2","193","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","6,9-Di(hydroxymethyl)-3',4,11-trimethoxy-5'-[2''-hydroxy-5''- hydroxymethyl-3''-methoxyphenyl]dibenzo[d,f][1,3]dioxepin-2-spiro- 4'-cyclohexa-2',5'-dienone","","- C31 H30 O11 -","- C31 H30 O11 -","- C248 H240 O88 -","8","1","PA1229","Pajunen, A.; Karhunen, P.; Brunow, G.","5'-(2-Hydroxy-5-hydroxymethyl-3-methoxyphenyl)-6,9-bis(hydroxymethyl)-3',4,11-trimethoxydibenzo[<i>d</i>,<i>f</i>][1,3]dioxepine-2-spiro-4'-cyclohexa-2',5'-dienone","Acta Crystallographica Section C","1996","52","7","1815","1817","10.1107/S0108270196003654","","","0.71073","MoKα","","0.0927","0.0547","","0.1379","0.1259","","","","0.861","1.138","1.138","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005175","10.788","0.006","8.748","0.004","8.966","0.004","103.91","0.04","111.14","0.03","103.85","0.05","714.7","0.7","293","","293","","","","","","","","","6","P 1","P 1","1","","","","- C12 H44 Co N8 O16 P3 -","- C12 H44 Co N8 O16 P3 -","- C12 H44 Co N8 O16 P3 -","1","1","PT1022","Bacchi, A.; Ferranti, F.; Pelizzi, G.","Conformation and Packing of Cobalt(III) Sepulchrate Dihydrogentriphosphate Hexahydrate","Acta Crystallographica Section C","1996","52","7","1624","1627","10.1107/S0108270196001412","","","0.7107","MoKα","","","0.0278","","","0.038","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005176","11.721","0.003","15.778","0.002","20.879","0.004","90","0.02","90","0.02","90","0.02","3861.2","1.3","293","","293","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C42 H42 O5 S2 -","- C42 H42 O5 S2 -","- C168 H168 O20 S8 -","4","1","PT1030","Kabaleeswaran, V.; Rajan, S. S.; Kannan, A.; Rajakumar, P.","A New Cyclophane","Acta Crystallographica Section C","1996","52","7","1729","1731","10.1107/S0108270196001400","","","1.5418","CuKα","","0.095","0.07","","0.101","0.077","","","","1.11","1.04","1.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005177","7.259","0.001","12.204","0.002","30.275","0.003","90","","90.779","0.009","90","","2681.8","0.6","296","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H3 Cl3 O2 -","- C7 H3 Cl3 O2 -","- C84 H36 Cl36 O24 -","12","3","PT1041","Lalancette, R. A.; Stringer, J. A.; Coté, M. L.","2,4,6-Trichlorobenzoic Acid: Structure and Hydrogen-Bonding Pattern","Acta Crystallographica Section C","1996","52","7","1801","1804","10.1107/S0108270196001369","","","0.71073","MoKα","","","0.045","","","0.047","","","","","1.03","1.03","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005178","13.671","0.003","13.671","0.003","11.4","0.003","90","","90","","120","","1845.2","0.8","223","","223","","","","","","","","","6","P 63","","","","dibromo(tris(diphenylamido)niobium(V)","","- C40 H38 Br2 N3 Nb O -","- C54 H30 Br2 N3 Nb -","- C108 H60 Br4 N6 Nb2 -","2","0.333333","SK1001","Hoffman, D. M.; Rangarajan, S. P.","A Diphenylamido‒Bromide Complex of Niobium: Dibromo[tris(diphenylamido)]niobium(V) Tetrahydrofuran Solvate","Acta Crystallographica Section C","1996","52","7","1616","1618","10.1107/S010827019600087X","","","0.71073","MolybdenumKα","","","0.029","","","0.026","","","","","2.2","2.2","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005179","13.473","0.002","25.444","0.004","16.158","0.004","90","","100.01","0.02","90","","5454.8","1.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","PNP tetrakis(pentafluorphenyl)gallat","Bis(triphenylphosphin)iminium tetrakis(pentafluorphenyl)gallat","","- C60 H30 F20 Ga N P2 -","- C60 H30 F20 Ga N P2 -","- C240 H120 F80 Ga4 N4 P8 -","4","1","SK1002","Tebbe, K.-F.; Gilles, T.; Conrad, F.; Tyrra, W.","Bis(triphenylphosphin)iminium-Tetrakis(pentafluorphenyl)gallat","Acta Crystallographica Section C","1996","52","7","1663","1666","10.1107/S0108270196001321","","","0.71069","MoKα","","0.2127","0.0741","","0.0871","0.0607","","","","0.986","1.218","1.218","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005180","9.808","0.001","11.591","0.002","17.86","0.001","90","","90","","90","","2030.4","0.4","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2,2'-biphenol monohydrate","","- C12 H12 O3 -","- C12 H12 O3 -","- C96 H96 O24 -","8","1","SK1012","Chen, X.-M.; Luo, G.-B.; Tong, M.-L.; Zhou, Z.-Y.","2,2'-Biphenol Monohydrate","Acta Crystallographica Section C","1996","52","7","1727","1729","10.1107/S0108270196002065","","","0.71073","MoKα","","0.0772","0.0474","","0.1422","0.1211","","","","1.022","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005181","10.903","0.001","10.903","0.001","14.813","0.002","90","","90","","90","","1760.9","0.3","173","1","173","1","","","","","","","","3","P 41","P 4w","76","","1,2:5,6-di-O-isopropylidene-3-C-ethoxycarbonylmethyl-α-D-allofuranose","","- C16 H26 O7 -","- C16 H26 O7 -","- C64 H104 O28 -","4","1","SX1012","Linden, A.; Lee, C. K.; Siew, K. F.","3-Deoxy-3-<i>C</i>-ethoxycarbonylmethyl-1,2:5,6-di-<i>O</i>-isopropylidene-α-<small>D</small>-allofuranose at 173K","Acta Crystallographica Section C","1996","52","7","1797","1799","10.1107/S0108270196001151","","","0.71069","MoKα","","0.0655","0.0418","","0.0377","0.0353","","","","","1.733","1.733","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005182","11.002","0.004","12.962","0.005","13.643","0.006","103.94","0.03","92.1","0.03","97.31","0.03","1868.4","1.3","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H11 N3 O4 -","- C12 H11 N3 O4 -","- C72 H66 N18 O24 -","6","3","SZ1002","Singh, P.; Izydore, R. A.","1,2-Diacetyl-4-phenyl-1,2,4-triazolidine-3,5-dione","Acta Crystallographica Section C","1996","52","7","1817","1820","10.1107/S0108270196000947","","","0.71073","MoKα","","","0.067","","","0.078","","","","","1.3","1.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005183","9.811","0.003","12.845","0.002","22.107","0.003","90","","96.65","0.03","90","","2767.2","1","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 N2 O3 S -","- C14 H12 N2 O3 S -","- C112 H96 N16 O24 S8 -","8","2","SZ1026","Pomés Hernández, R.; Duque Rodríguez, J.; Novoa de Armas, H.; Toscano, R. A.","Ethyl Cyano(4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene)acetate","Acta Crystallographica Section C","1996","52","7","1731","1733","10.1107/S0108270195017227","","","0.71073","MoKα","","","0.06","","","0.114","","","","","1.12","1.12","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005184","9.937","0.004","9.192","0.001","14.417","0.003","90","","90","","90","","1316.9","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","2-chlorobenzimidazole","","","- C7 H5 Cl N2 -","- C7 H5 Cl N2 -","- C56 H40 Cl8 N16 -","8","1","SZ1041","Panneerselvam, K.; Soriano-García, M.","2-Chlorobenzimidazole","Acta Crystallographica Section C","1996","52","7","1799","1801","10.1107/S0108270195017203","","","1.54178","CuKα","","0.0499","0.0482","","0.1736","0.1515","","","","1.231","1.259","1.259","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005185","6.322","0.001","13.476","0.001","9.115","0.002","90","","106.54","0.01","90","","744.4","0.2","213","1","213","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H11 Br4 N O2 -","- C12 H11 Br4 N O2 -","- C24 H22 Br8 N2 O4 -","2","1","TA1058","Banwell, M. G.; Forman, G. S.; Hockless, D. C. R.","(3a<i>R</i>,3b<i>S</i>,4a<i>R</i>,4b<i>R</i>,5a<i>R</i>,5b<i>S</i>)-4,4,8,8-Tetrabromo-2,2-dimethylperhydrodicyclopropa[<i>e</i>,<i>g</i>][1,3]benzodioxole-3b-carbonitrile","Acta Crystallographica Section C","1996","52","7","1804","1806","10.1107/S0108270195015319","","","1.5418","CuKα","","","0.0272","","","0.0325","","","","","2.798","2.798","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005186","7.623","0.002","9.046","0.002","15.768","0.003","80.06","0.02","86.19","0.02","72.03","0.01","1018.7","0.4","213","1","213","1","","","","","","","","5","P -1","-P 1","2","","","","- C20.5 H24 Br N O6.5 -","- C21.5 H27 Br N O7 -","- C43 H54 Br2 N2 O14 -","2","1","TA1059","Banwell, M. G.; Hockless, D. C. R.; Peters, S. C.","A C(10)-Oxygenated <i>ABC</i>-Ring Analogue of Paclitaxel (Taxol^T^^M^)","Acta Crystallographica Section C","1996","52","7","1832","1834","10.1107/S0108270195015332","","","1.5418","CuKα","","","0.0366","","","0.0461","","","","","2.904","2.904","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005187","5.894","0.002","7.234","0.003","8.307","0.003","90.68","0.03","102.81","0.03","103.45","0.03","335.1","0.2","158","2","158","2","","","","","","","","5","P -1","-P 1","2","5-BAP hydrochloride","2-Amino-5-bromopyrimidinium chloride","","- C4 H5 Br Cl N3 -","- C4 H5 Br Cl N3 -","- C8 H10 Br2 Cl2 N6 -","2","1","TA1066","Prince, B. J.; Turnbull, M. M.","2-Amino-5-bromopyrimidinium Chloride","Acta Crystallographica Section C","1996","52","7","1843","1844","10.1107/S0108270195016751","","","0.71073","MoKα","","0.116","0.063","","0.318","0.1365","","","","1.05","0.998","0.998","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005188","18.749","0.004","8.025","0.002","15.115","0.003","90","","95.84","0.02","90","","2262.4","0.9","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5,8,11,14-tetraoxa-2,17-dithiabicyclo[16.4.1]tricosa- 1(22),18,20-trien-23-one HgCl~2~ complex","","- C17 H24 Cl2 Hg O5 S2 -","- C17 H24 Cl2 Hg O5 S2 -","- C68 H96 Cl8 Hg4 O20 S8 -","4","1","TA1067","Kubo, K.; Mori, A.; Kato, N.; Takeshita, H.","Preferential Coordination of Mercury(II) to Oxygen over Sulfur Atoms in a Tropone-Attached Dithiocrown Ether","Acta Crystallographica Section C","1996","52","7","1656","1658","10.1107/S0108270196002077","","","1.54184","CuKα","","0.0777","0.0635","","0.1909","0.16","","","","1.136","1.119","1.119","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005189","10.387","0.005","17.411","0.007","8.1633","0.0008","90","","90","","90","","1476.3","0.9","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H17 N3 O3 -","- C15 H17 N3 O3 -","- C60 H68 N12 O12 -","4","1","TA1079","Hirayama, N.; Arai, H.; Kasai, M.","Structural Studies of Mitomycins. VII. Mitomycin G","Acta Crystallographica Section C","1996","52","7","1806","1808","10.1107/S0108270196000807","","","1.54184","CuKα","","","0.043","","","0.063","","","","","2.22","2.22","","","","","has coordinates","190560","2020-10-21","18:00:00",""
"2005190","11.641","0.006","12.245","0.008","26.446","0.005","90","","90","","90","","3770","3","296","1","296","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C40 H40 Cl2 P4 Ru -","- C40 H40 Cl2 P4 Ru -","- C160 H160 Cl8 P16 Ru4 -","4","1","TA1085","Hockless, D. C. R.; Wild, S. B.; McDonagh, A. M.; Whittall, I. R.; Humphrey, M. G.","<i>trans</i>-Dichlorobis[(<i>R</i>,<i>R</i>)-1,2-phenylenebis(methylphenylphosphine-<i>P</i>)]ruthenium(II)","Acta Crystallographica Section C","1996","52","7","1639","1641","10.1107/S0108270196003009","","","0.7107","MoKα","","","0.0251","","","0.019","","","","","1.874","1.874","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005191","10.664","0.003","14.088","0.005","12.494","0.002","90","","110.6","0.1","90","","1757","1.4","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","{1-[(2-Hydroxy-4-methylphenyl)iminomethyl]phenyl-2-olato-O,O',N}- piperidinenickel(II)","","- C19 H22 N2 Ni O2 -","- C19 H22 N2 Ni O2 -","- C76 H88 N8 Ni4 O8 -","4","1","AB1328","Atakol, O.; Kenar, A.; Ercan, F.; Sari, M.; Yaugbasan, R.","{4-Methyl-2-[(2-oxidobenzylidene)amino]phenol-ato(2‒)-<i>N</i>,<i>O</i>,<i>O</i>'}(piperidine-<i>N</i>)nickel(II)","Acta Crystallographica Section C","1996","52","8","1881","1884","10.1107/S0108270196003484","","","0.71073","MoKα","","","0.059","","","0.06","","","","","1.54","1.54","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005192","9.179","0.002","11.104","0.003","12.202","0.002","84.08","0.02","83.98","0.01","75.52","0.02","1193.7","0.5","120","2","120","2","","","","","","","","4","P 1","P 1","1","Gly-Leu-Tyr","Glysyl-L-Leucyl-L-Tyrosin 2 H~2~O 2-propanol","","- C20 H37 N3 O8 -","- C20 H37 N3 O8 -","- C40 H74 N6 O16 -","2","2","AB1338","Dalhus, B.; Görbitz, C. H.","Glycyl-<small>L</small>-Leucyl-<small>L</small>-Tyrosine Dihydrate 2-Propanol Solvate","Acta Crystallographica Section C","1996","52","8","2087","2090","10.1107/S0108270196002041","","","0.71069","MoKα","","0.1068","0.0789","","0.2492","0.222","","","","1.076","1.165","1.165","","","","","has coordinates,has disorder","194533","2020-10-21","18:00:00",""
"2005193","9.977","0.002","14.009","0.003","16.462","0.003","90","","91.21","0.03","90","","2300.3","0.8","103","2","103","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bromobis(diethyldithiocarbamato)-4-methoxyphenyltellurium(IV)","","- C17 H27 Br N2 O S4 Te -","- C17 H27 Br N2 O S4 Te -","- C68 H108 Br4 N8 O4 S16 Te4 -","4","1","AB1340","Husebye, S.; Engebretsen, T.; Rudd, M. D.; Lindeman, S. V.","Bromobis(diethyldithiocarbamato)(4-methoxyphenyl)tellurium(IV)","Acta Crystallographica Section C","1996","52","8","2022","2024","10.1107/S010827019600234X","","","0.71069","MoKα","","0.0333","0.0278","","0.088","0.0748","","","","1.028","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005194","5.251","0.004","7.782","0.004","7.592","0.005","90","","101.46","0.06","90","","304","0.3","295","","295","","","","","","","","","4","P 1 21 1","P 2yb","4","","sodium hydrogen L-tartrate","","- C4 H5 Na O6 -","- C4 H5 Na O6 -","- C8 H10 Na2 O12 -","2","1","AB1342","Matsumoto, S.; Kashino, S.","Sodium Hydrogen <small>L</small>-Tartrate","Acta Crystallographica Section C","1996","52","8","1948","1950","10.1107/S0108270196005288","","","0.71073","MoKα","","","0.026","","","0.033","","","","","2.18","2.18","","","","","has coordinates,has disorder","248647","2020-10-21","18:00:00",""
"2005195","8.959","0.003","13.677","0.008","9.777","0.003","90","","108.78","0.02","90","","1134.2","0.9","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H12 Br2 O2 Pt S2 -","- C4 Br2 O2 Pt S2 -","- C16 Br8 O8 Pt4 S8 -","4","1","AB1349","Lövqvist, K.","<i>cis</i>-Dibromobis(dimethyl sulfoxide-<i>S</i>)platinum(II) and <i>trans</i>-Bis(dimethyl sulfoxide-<i>S</i>)diiodoplatinum(II)","Acta Crystallographica Section C","1996","52","8","1921","1924","10.1107/S0108270196003824","","","0.7107","MoKα","","","0.0324","","","0.0413","","","","","1.713","1.713","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005196","5.2789","0.0009","7.089","0.002","8.709","0.003","110.42","0.02","94.5","0.02","93.48","0.02","303.13","0.15","295","","295","","","","","","","","","6","P -1","-P 1","2","","","","- C4 H12 I2 O2 Pt S2 -","- C4 I2 O2 Pt S2 -","- C4 I2 O2 Pt S2 -","1","0.5","AB1349","Lövqvist, K.","<i>cis</i>-Dibromobis(dimethyl sulfoxide-<i>S</i>)platinum(II) and <i>trans</i>-Bis(dimethyl sulfoxide-<i>S</i>)diiodoplatinum(II)","Acta Crystallographica Section C","1996","52","8","1921","1924","10.1107/S0108270196003824","","","0.7107","MoKα","","","0.0471","","","0.0568","","","","","2.67","2.67","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005197","10.068","0.001","21.731","0.002","11.293","0.001","90","","98.26","0.01","90","","2445.1","0.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H18 Br2 Cl Fe N2 O2 -","- C26 H18 Br2 Cl Fe N2 O2 -","- C104 H72 Br8 Cl4 Fe4 N8 O8 -","4","1","AB1355","Elerman, Y.; Paulus, H.","A Five-Coordinate Bis(<i>p</i>-bromophenylsalicylaldimino)chloroiron(III) Complex","Acta Crystallographica Section C","1996","52","8","1971","1973","10.1107/S0108270196005422","","","0.71069","MoKα","","0.049","0.035","","0.08","0.075","","","","1.049","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005198","6.177","0.0007","9.747","0.001","23.236","0.002","86.94","0.01","89.599","0.009","77.619","0.009","1364.5","0.2","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","N,N'-Bis[trans-2-phenyl-5-triphenylstannylmethoxymethyl-1,3-dioxan-5-yl]- ethanediamide.","","- C62 H60 N2 O8 Sn2 -","- C62 H60 N2 O8 Sn2 -","- C62 H60 N2 O8 Sn2 -","1","0.5","AB1356","Ross, J.-N.; Wardell, J. L.; Low, J. N.; Ferguson, G.","<i>N</i>,<i>N</i>'-Bis[<i>trans</i>-2-phenyl-5-(triphenylstannylmethoxymethyl)-1,3-dioxan-5-yl]ethanediamide","Acta Crystallographica Section C","1996","52","8","1961","1963","10.1107/S010827019600203X","","","0.7107","MoKα","","0.0384","0.0268","","0.0691","0.0657","","","","1.049","1.091","1.091","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005199","9.9456","0.0009","21.011","0.001","14.179","0.001","90","","90","","90","","2962.9","0.4","122","1","122","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-cyano-3-phenylazo-2-butenal carbazidoethylester-imin","","- C14 H15 N5 O2 -","- C14 H15 N5 O2 -","- C112 H120 N40 O16 -","8","1","AB1357","Flensburg, C.; Jensen, J.; Larsen, S.; Dehaen, W.","Ethyl 3-(2-Cyano-3-phenylazo-2-butenylidene)carbazoate at 122K","Acta Crystallographica Section C","1996","52","8","2093","2095","10.1107/S0108270196003095","","","1.54184","CuKα","","0.0501","0.035","","0.0829","0.0763","","","","1.014","1.051","1.051","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005200","8.783","0.001","11.679","0.001","13.194","0.002","81.14","0.01","71.85","0.01","85.672","0.008","1270.2","0.3","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","Furan-2,5-diylbis(diphenylmethanol)-dimethylformamide (2/1)","","- C31.5 H27.5 N0.5 O3.5 -","- C31.5 H27.5 N0.5 O3.5 -","- C63 H55 N O7 -","2","1","AB1360","Ferguson, G.; Glidewell, C.; Zakaria, C. M.","Host‒Guest Complexes of Furan-2,5-diylbis(diphenylmethanol): Structures of the 2:1 Adducts with Dimethylformamide, Dimethyl Sulfoxide and Pyridine","Acta Crystallographica Section C","1996","52","8","2009","2014","10.1107/S0108270196003101","","","0.7107","MolybdenumKα","","0.1348","0.0585","","0.1971","0.1695","","","","0.876","1.148","1.148","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005201","8.802","0.003","11.707","0.003","13.162","0.004","80.17","0.01","72.07","0.01","84.19","0.01","1269.7","0.7","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","Furan-2,5-diylbis(diphenylmethanol)-dimethylfsulfoxide (2/1)","","- C31 H27 O3.5 S0.5 -","- C31 H27 O3.5 S0.5 -","- C62 H54 O7 S -","2","1","AB1360","Ferguson, G.; Glidewell, C.; Zakaria, C. M.","Host‒Guest Complexes of Furan-2,5-diylbis(diphenylmethanol): Structures of the 2:1 Adducts with Dimethylformamide, Dimethyl Sulfoxide and Pyridine","Acta Crystallographica Section C","1996","52","8","2009","2014","10.1107/S0108270196003101","","","0.7107","MolybdenumKα","","0.0881","0.0426","","0.1093","0.0982","","","","0.999","1.203","1.203","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005202","8.979","0.001","11.814","0.003","13.329","0.003","96.55","0.02","109.47","0.02","102.4","0.02","1275.2","0.5","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","Furan-2,5-diylbis(diphenylmethanol)-pyridine (2/1)","","- C32.5 H26.5 N0.5 O3 -","- C32.5 H26.5 N0.5 O3 -","- C65 H53 N O6 -","2","1","AB1360","Ferguson, G.; Glidewell, C.; Zakaria, C. M.","Host‒Guest Complexes of Furan-2,5-diylbis(diphenylmethanol): Structures of the 2:1 Adducts with Dimethylformamide, Dimethyl Sulfoxide and Pyridine","Acta Crystallographica Section C","1996","52","8","2009","2014","10.1107/S0108270196003101","","","0.7107","MolybdenumKα","","0.1521","0.0412","","0.1278","0.1059","","","","0.879","1.219","1.219","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005203","9.685","0.0006","6.798","0.0007","15.183","0.001","90","","90","","90","","999.63","0.14","294","1","294","1","","","","","","","","5","P n m a","-P 2ac 2n","62","","6-acetylamino-4-methoxy-2-methylthiopyrimidine","","- C8 H11 N3 O2 S -","- C8 H10 N3 O2 S -","- C32 H40 N12 O8 S4 -","4","0.5","AB1363","Low, J. N.; Ferguson, G.; Cobo, J.; Melguizo, M.; Nogueras, M.; Sanchez, A.","6-Acetamido-4-methoxy-2-methylthiopyrimidine","Acta Crystallographica Section C","1996","52","8","2035","2037","10.1107/S0108270196003423","","","0.7107","MoKα","","0.0852","0.0367","","0.1088","0.0984","","","","0.996","1.195","1.195","","","","","has coordinates,has disorder","200174","2020-10-21","18:00:00",""
"2005204","8.536","0.001","11.805","0.002","14.672","0.002","91.43","0.01","105.97","0.01","93.79","0.01","1416.9","0.4","294","1","294","1","","","","","","","","3","P -1","-P 1","2","5,17-Dicarbethoxy-25,26,27,28-tetrahydroxycalix[4]arene","5,17-diethyloxycarbonylpentacyclo[19.3.1.1^3,7^.1^9,13^.1^15,19^]octacosa- 1(25),3,5,7(18),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetraol","","- C34 H32 O8 -","- C34 H32 O8 -","- C68 H64 O16 -","2","1","AB1366","Böhmer, V.; Ferguson, G.; Mogck, O.","5,17-Diethoxycarbonyl-25,26,27,28-tetrahydroxycalix[4]arene","Acta Crystallographica Section C","1996","52","8","2000","2002","10.1107/S0108270196003496","","","0.7107","MolybdenumKα","","0.0861","0.0464","","0.1385","0.1267","","","","1.068","1.28","1.28","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005205","20.733","0.002","35.97","0.003","14.66","0.001","90","","90","","90","","10932.9","1.6","160","2","160","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C28 H38 B2 O6 -","- C28 H38 B2 O6 -","- C448 H608 B32 O96 -","16","1","AB1368","Clegg, W.; Scott, A. J.; Lesley, G.; Marder, T. B.; Norman, N. C.","The Product of Catalysed Diboration of Bis(4-methoxyphenyl)ethyne by Bis(pinacolato-<i>O</i>,<i>O</i>')diboron","Acta Crystallographica Section C","1996","52","8","1989","1991","10.1107/S0108270196003836","","","0.71073","MoKα","","0.0353","0.0304","","0.0771","0.0726","","","","1.051","1.036","1.036","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005206","12.556","0.006","14.408","0.007","14.996","0.008","90","","91.56","0.02","90","","2712","2","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[(N-2,6-Diisopropylphenyl-N-trimethylsilyl)amido-N](pyridine-N)- (Diethyl ether-O)lithium","","- C24 H41 Li N2 O Si -","- C24 H41 Li N2 O Si -","- C96 H164 Li4 N8 O4 Si4 -","4","1","AB1370","Blake, A. J.; Mountford, P.; Nikonov, G. I.","(Diethyl ether-<i>O</i>)[<i>N</i>-(2,6-diisopropylphenyl)-<i>N</i>-(trimethylsilyl)amido-<i>N</i>](pyridine-<i>N</i>)lithium","Acta Crystallographica Section C","1996","52","8","1911","1913","10.1107/S010827019600409X","","","0.71073","MoKα","","","0.0749","","","0.0655","","","","","1.0673","1.0673","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2005207","10.0809","0.0009","12.1757","0.0009","19.115","0.001","90","","91.443","0.009","90","","2345.5","0.3","294","1","294","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Tetrabenzylgermanium","","- C28 H28 Ge -","- C28 H28 Ge -","- C112 H112 Ge4 -","4","1","AB1377","Ferguson, G.; Glidewell, C.","Tetrabenzylgermanium","Acta Crystallographica Section C","1996","52","8","1889","1891","10.1107/S0108270196004878","","","0.7107","MoKα","","0.1731","0.0564","","0.1171","0.0967","","","","0.828","1.12","1.12","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005208","7.571","0.001","7.161","0.0007","16.535","0.002","90","","91.81","0.01","90","","896.01","0.18","111","2","111","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Ethyl-3-(3-pyridyl)isoxazolin-5-one","","- C10 H10 N2 O2 -","- C10 H10 N2 O2 -","- C40 H40 N8 O8 -","4","1","AB1380","Frydenvang, K.; Brehm, L.; di Biase, R.; Falch, E.","2-Ethyl-3-(3-pyridyl)-5(2<i>H</i>)-isoxazolone","Acta Crystallographica Section C","1996","52","8","2102","2105","10.1107/S0108270196006142","","","1.54184","CuKα","","0.0454","0.0371","","0.1065","0.0971","","","","1.071","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005209","9.5156","0.0009","22.206","0.002","11.619","0.001","90","","108.059","0.002","90","","2334.2","0.4","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-1,2-bis(benzo-1',3',2'-dioxaborolan-2'-yl)-1,2-bis(4'-methylphenyl)ethene","","- C28 H22 B2 O4 -","- C28 H22 B2 O4 -","- C112 H88 B8 O16 -","4","1","AB1383","Clegg, W.; Scott, A. J.; Lesley, G.; Marder, T. B.; Norman, N. C.","The Products of Catalysed Diboration of Bis(<i>p</i>-tolyl)ethyne and of 4-Cyanophenylethyne by Bis(catecholato-<i>O</i>,<i>O</i>')diboron","Acta Crystallographica Section C","1996","52","8","1991","1995","10.1107/S0108270196006622","","","0.71073","MoKα","","0.0487","0.0385","","0.0999","0.0902","","","","1.07","1.062","1.062","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005210","16.253","0.001","13.023","0.001","8.5856","0.0008","90","","104.92","0.002","90","","1756","0.2","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-1,2-bis(benzo-1',3',2'-dioxaborolan-2'-yl)-1-(4'-cyanophenyl)ethene","","- C21 H13 B2 N O4 -","- C21 H13 B2 N O4 -","- C84 H52 B8 N4 O16 -","4","1","AB1383","Clegg, W.; Scott, A. J.; Lesley, G.; Marder, T. B.; Norman, N. C.","The Products of Catalysed Diboration of Bis(<i>p</i>-tolyl)ethyne and of 4-Cyanophenylethyne by Bis(catecholato-<i>O</i>,<i>O</i>')diboron","Acta Crystallographica Section C","1996","52","8","1991","1995","10.1107/S0108270196006622","","","0.71073","MoKα","","0.0416","0.0354","","0.0963","0.0882","","","","1.031","1.032","1.032","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005211","14.062","0.004","12.046","0.002","11.697","0.002","90","","102.63","0.02","90","","1933.4","0.7","291","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 N3 O5 -","- C21 H17 N3 O5 -","- C84 H68 N12 O20 -","4","1","BK1124","Barrett, D. M. Y.; Kahwa, I. A.; Williams, D. J.","Formylation <i>versus</i> Alkylation of Secondary Amines in DMF","Acta Crystallographica Section C","1996","52","8","2069","2071","10.1107/S010827019600056X","","","1.54178","CuKα","","","0.0464","","","0.0539","","","","","2.47","2.47","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005212","5.534","0.002","12.759","0.002","5.74","0.002","90","","104.77","0.02","90","","391.9","0.2","296","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C3 H8 Ca N O7 P -","- C3 H8 Ca N O7 P -","- C6 H16 Ca2 N2 O14 P2 -","2","1","BK1190","Suga, T.; Okabe, N.","Aqua(<small>L</small>-<i>O</i>-serine phosphato)calcium(II)","Acta Crystallographica Section C","1996","52","8","1894","1896","10.1107/S0108270196002648","","","0.71069","MoKα","","","0.024","","","0.029","","","","","1.22","1.22","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005213","7.08","0.002","10.007","0.001","16.482","0.002","90","","90.3","0.02","90","","1167.7","0.4","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ-chloro-bis[chloro(2-(N-propylaminomethyl)pyridine)copper(II)]","","- C18 H28 Cl4 Cu2 N4 -","- C18 H28 Cl4 Cu2 N4 -","- C36 H56 Cl8 Cu4 N8 -","2","0.5","BK1213","Wahnon, D.; Keith, C.; Chin, J.; Hynes, R. C.","Di-μ-chloro-bis{chloro[2-(<i>N</i>-propylaminomethyl)pyridine-<i>N</i>,<i>N</i>']copper(II)}","Acta Crystallographica Section C","1996","52","8","1877","1879","10.1107/S0108270196003459","","","0.7107","MolybdenumKα","","0.05","0.032","","0.032","0.031","","","","","1.55","1.55","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005214","8.439","0.001","16.864","0.002","11.01","0.001","90","","109.56","0.01","90","","1476.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(μ-thiosulphato-S,O)-bis(dimethylphenanthrolyne cadmium(II))","","- C28 H24 Cd2 N4 O6 S4 -","- C28 H24 Cd2 N4 O6 S4 -","- C56 H48 Cd4 N8 O12 S8 -","2","0.5","BK1214","Baggio, R.; Baggio, S.; Pardo, M. I.; Garland, M. T.","Bis(μ-thiosulfato)-1κ<i>O</i>,1:2κ^2^<i>S</i>;2κ<i>O</i>,1:2κ^2^<i>S</i>-bis[(2,9-dimethyl-1,10-phenanthroline-<i>N</i>,<i>N</i>')cadmium(II)]","Acta Crystallographica Section C","1996","52","8","1939","1942","10.1107/S0108270196003502","","","0.71073","MoKα","","0.0311","0.0252","","0.0638","0.0591","","","","1.056","1.067","1.067","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2005215","9.003","0.003","8.896","0.005","24.832","0.004","90","","94.29","0.03","90","","1983.2","1.3","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","calcium o-tolidine-6,6'-disulfonate tetrahydrate","","- C14 H22 Ca N2 O10 S2 -","- C14 H22 Ca N2 O10 S2 -","- C56 H88 Ca4 N8 O40 S8 -","4","1","BK1220","Gunderman, B. J.; Squattrito, P. J.","Two Calcium Salts of <i>o</i>-Tolidine-6,6'-disulfonate","Acta Crystallographica Section C","1996","52","8","1896","1901","10.1107/S0108270196004957","","","0.7107","MoKα","","0.078","0.036","","0.068","0.037","","","","","1.87","1.87","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005216","13.163","0.007","16.122","0.007","11.814","0.005","93.23","0.04","112.97","0.04","106.5","0.04","2173","2","296","","296","","","","","","","","","6","P -1","-P 1","2","","calcium o-tolidine-6,6'-disulfonate dodecahydrate","","- C28 H54 Ca N4 O24 S4 -","- C28 H44 Ca N4 O24 S4 -","- C56 H88 Ca2 N8 O48 S8 -","2","1","BK1220","Gunderman, B. J.; Squattrito, P. J.","Two Calcium Salts of <i>o</i>-Tolidine-6,6'-disulfonate","Acta Crystallographica Section C","1996","52","8","1896","1901","10.1107/S0108270196004957","","","0.7107","MoKα","","0.16","0.049","","0.062","0.05","","","","","1.87","1.87","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005217","15.754","0.001","19.29","0.001","13.205","0.001","90","","92.1","0.01","90","","4010.2","0.4","296","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H23 N5 O3 -","- C21 H22 N5 O3 -","- C168 H176 N40 O24 -","8","2","BM1044","Das, A. K.; Dutta, M.; Mazumdar, S. K.; Mazumdar, B.; Mukhopadhyay, A.; Talapatra, S. K.","9-Benzyl-7-[(<i>E</i>)-2-butenyl]-2,3-dihydro-6-hydroxy-1,3-dimethylpyrimido[2,1-<i>f</i>]purine-4,8(1<i>H</i>,9<i>H</i>)-dione","Acta Crystallographica Section C","1996","52","8","2076","2078","10.1107/S0108270196002946","","","1.54184","CuKα","","","0.056","","","0.062","","","","","1.98","1.98","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005218","32.41","0.01","32.41","0.01","6.056","0.003","90","","90","","90","","6361","4","298","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C14 H17.5 Cl N4 O1.25 S -","- C14 H17.5 Cl N4 O1.25 S -","- C224 H280 Cl16 N64 O20 S16 -","16","1","BM1047","Kovala-Demertzi, D.; Varagi, V.; Demertzis, M. A.; Raptopoulou, C. P.; Terzis, A.","2-Acetylpyridinium 4<i>N</i>-Phenylthiosemicarbazone Chloride 1.25-Hydrate","Acta Crystallographica Section C","1996","52","8","2027","2029","10.1107/S010827019600176X","","","0.7107","MoKα","","","0.0351","","","0.035","","","","","2.35","2.35","","","","","has coordinates","190703","2020-10-21","18:00:00",""
"2005219","10.214","0.001","9.361","0.002","19.097","0.002","90","","99.34","0.04","90","","1801.7","0.5","295","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 N2 Ni O S -","- C21 H20 N2 Ni O S -","- C84 H80 N8 Ni4 O4 S4 -","4","1","BM1064","Ülkü, D.; Tahir, M. N.; Üçar, G.; Atakol, O.","(Pyrrolidine-<i>N</i>)[1-(2-thiophenyliminomethyl)-2-naphtholato(2‒)-<i>N</i>,<i>O</i>,<i>S</i>]nickel(II)","Acta Crystallographica Section C","1996","52","8","1884","1885","10.1107/S0108270196003848","","","0.71069","MoKα","","","0.039","","","0.039","","","","","1.3","1.3","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005220","12.893","0.004","6.215","0.002","18.8","0.008","90","","95.06","0.03","90","","1500.6","0.9","150","","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Cholesteryl p-Toluenesulfonate","","- C34 H52 O3 S -","- C34 H52 O3 S -","- C68 H104 O6 S2 -","2","1","BM1066","Cox, P. J.; Buchanan, H. J.; Wardell, J. L.","Redetermination of Cholesteryl <i>p</i>-Toluenesulfonate at 150K","Acta Crystallographica Section C","1996","52","8","2111","2113","10.1107/S0108270196003150","","","0.71073","MoKα","","0.0981","0.0494","","0.1066","0.096","","","","0.659","0.888","0.888","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005221","11.851","0.006","15.298","0.009","27.35","0.02","90","","90","","90","","4958","5","303","2","303","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","N-p-Tolyl-2-chloro-5-p-tolouylamino-4-p-tolylamino-6-pyrimidinecarboxyamide","N-p-Tolyl-2-chloro-5-p-tolouylamino-4-p-tolylamino-6-pyrimidinecarboxyamide","","- C27 H24 Cl N5 O2 -","- C27 H24 Cl N5 O2 -","- C216 H192 Cl8 N40 O16 -","8","1","BM1069","Mazurek, J.; Lis, T.; Jasztold-Howorko, R.","Orthorhombic and Triclinic Forms of 2-Chloro-5-<i>p</i>-toluoylamino-<i>N</i>-<i>p</i>-tolyl-4-<i>p</i>-tolylamino-6-pyrimidinecarboxamide and 2-Chloro-5-(<i>p</i>-chlorobenzoylamino)-<i>N</i>-<i>p</i>-tolyl-4-<i>p</i>-tolylamino-6-pyrimidinecarboxamide","Acta Crystallographica Section C","1996","52","8","2106","2111","10.1107/S0108270196005616","","","1.5418","CuKα","","0.0425","0.0425","","0.1161","0.1161","","","","1.039","1.039","1.039","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005222","7.375","0.002","11.888","0.006","14.103","0.006","101.34","0.04","94.75","0.03","91.2","0.03","1207.3","0.9","298","2","293","2","","","","","","","","5","P -1","-P 1","2","N-p-Tolyl-2-chloro-5-p-toluylamino-4-p-tolylamino-6-pyrimidinecarboxyamide","N-p-Tolyl-2-chloro-5-p-toluylamino-4-p-tolylamino-6-pyrimidinecarboxyamide","","- C27 H24 Cl N5 O2 -","- C27 H24 Cl N5 O2 -","- C54 H48 Cl2 N10 O4 -","2","1","BM1069","Mazurek, J.; Lis, T.; Jasztold-Howorko, R.","Orthorhombic and Triclinic Forms of 2-Chloro-5-<i>p</i>-toluoylamino-<i>N</i>-<i>p</i>-tolyl-4-<i>p</i>-tolylamino-6-pyrimidinecarboxamide and 2-Chloro-5-(<i>p</i>-chlorobenzoylamino)-<i>N</i>-<i>p</i>-tolyl-4-<i>p</i>-tolylamino-6-pyrimidinecarboxamide","Acta Crystallographica Section C","1996","52","8","2106","2111","10.1107/S0108270196005616","","","1.5418","CuKα","","0.0393","0.0393","","0.1083","0.1083","","","","1.048","1.048","1.048","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005223","7.411","0.002","11.784","0.002","13.989","0.004","101.61","0.02","94.29","0.02","92.15","0.02","1191.6","0.5","294","1","294","1","","","","","","","","5","P -1","-P 1","2","N-p-Tolyl-2-chloro-5-(p-chloro)-benzoylamino-4-p-tolylamino- 6-pyrimidinecarboxyamide","N-p-Tolyl-2-chloro-5-(p-chloro)-benzoylamino-4-p-tolylamino- 6-pyrimidinecarboxyamide","","- C26 H21 Cl2 N5 O2 -","- C26 H21 Cl2 N5 O2 -","- C52 H42 Cl4 N10 O4 -","2","1","BM1069","Mazurek, J.; Lis, T.; Jasztold-Howorko, R.","Orthorhombic and Triclinic Forms of 2-Chloro-5-<i>p</i>-toluoylamino-<i>N</i>-<i>p</i>-tolyl-4-<i>p</i>-tolylamino-6-pyrimidinecarboxamide and 2-Chloro-5-(<i>p</i>-chlorobenzoylamino)-<i>N</i>-<i>p</i>-tolyl-4-<i>p</i>-tolylamino-6-pyrimidinecarboxamide","Acta Crystallographica Section C","1996","52","8","2106","2111","10.1107/S0108270196005616","","","1.5418","CuKα","","0.0504","0.046","","0.1232","0.1188","","","","1.068","1.07","1.07","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005224","6.594","0.001","10.763","0.002","11.649","0.002","90","","105.36","0.01","90","","797.2","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Di-mu-chloro-dichlorobis(trimethylphosphine)diplatinum(II)","","- C6 H18 Cl4 P2 Pt2 -","- C6 H18 Cl4 P2 Pt2 -","- C12 H36 Cl8 P4 Pt4 -","2","0.5","BM1079","Boag, N. M.; Ravetz, M. S.","<i>trans</i>-Di-μ-chloro-bis[chloro(trimethylphosphine-<i>P</i>)platinum(II)]","Acta Crystallographica Section C","1996","52","8","1942","1943","10.1107/S0108270196004301","","","0.71073","MoKα","","0.0629","0.0426","","0.1131","0.1014","","","","1.032","1.063","1.063","","","","","has coordinates","196234","2020-10-21","18:00:00",""
"2005225","4.655","0.002","8.565","0.003","9.103","0.003","90","","97.8","0.01","90","","359.6","0.2","298","","298","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Lithium dicobalt tripolyphosphate","","- Co2 Li O10 P3 -","- Co2 Li O10 P3 -","- Co4 Li2 O20 P6 -","2","0.5","BR1124","Erragh, F.; Boukhari, A.; Holt, E. M.","Lithium Dicobalt Tripolyphosphate and Lithium Dinickel Tripolyphosphate","Acta Crystallographica Section C","1996","52","8","1867","1869","10.1107/S010827019501643X","","","0.71073","MoKα","","","0.034","","","0.046","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005226","4.576","0.001","8.356","0.001","8.921","0.001","90","","98.08","0.01","90","","337.73","0.09","298","","298","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Lithium dinickel tripolyphosphate","","- Li Ni2 O10 P3 -","- Li Ni2 O10 P3 -","- Li2 Ni4 O20 P6 -","2","0.5","BR1124","Erragh, F.; Boukhari, A.; Holt, E. M.","Lithium Dicobalt Tripolyphosphate and Lithium Dinickel Tripolyphosphate","Acta Crystallographica Section C","1996","52","8","1867","1869","10.1107/S010827019501643X","","","0.71073","MoKα","","","0.052","","","0.063","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005227","9.473","0.004","7.802","0.003","6.755","0.002","78.14","0.02","75.58","0.02","77.21","0.02","465.5","0.3","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- Cl3 H2 O13 Yb -","- Cl3 H2 O13 Yb -","- Cl6 H4 O26 Yb2 -","2","1","BR1135","Belin, C.; Favier, F.; Pascal, J. L.; Tillard-Charbonnel, M.","Triperchloratoytterbium(III) Monohydrate, Yb(ClO~4~)~3~.H~2~O","Acta Crystallographica Section C","1996","52","8","1872","1874","10.1107/S0108270196001709","","","0.71073","MoKα","","","0.0313","","","0.0389","","","","","0.84","0.84","","","","","has coordinates","199744","2020-10-21","18:00:00",""
"2005228","8.348","0.002","10.326","0.002","9.929","0.002","90","","97.06","0.02","90","","849.4","0.3","294","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Ammonium Uranyl Hydrogenselenite Selenite","","","- H5 N O8 Se2 U -","- N O8 Se2 U -","- N4 O32 Se8 U4 -","4","1","BR1138","Koskenlinna, M.; Valkonen, J.","Ammonium Uranyl Hydrogenselenite Selenite","Acta Crystallographica Section C","1996","52","8","1857","1859","10.1107/S0108270196002053","","","0.71073","Mo_Kα","","","0.028","","","0.032","","","","","0.503","0.503","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005229","7.947","0.002","11.949","0.003","7.749","0.002","106.19","0.02","96.79","0.02","84.7","0.02","700.3","0.3","293","","293","","","","","","","","","3","P -1","-P 1","2","tetraline","1-hydroxy-1-propynyl-2,2-spiro-(1-cyclohex-2 -ene-1-one)-1(2H)-tetraline","","- C18 H18 O2 -","- C18 H18 O2 -","- C36 H36 O4 -","2","1","CF1014","Kabaleeswaran, V.; Rajan, S. S.; Janarthanam, S.; Rajagopalan, K.","A Tetralin Derivative","Acta Crystallographica Section C","1996","52","8","1983","1985","10.1107/S0108270195009711","","","1.5418","CuKα","","0.052","0.039","","0.06","0.046","","","","0.958","0.888","0.888","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2005230","11.212","0.002","8.43","0.0008","19.384","0.002","90","","90.81","0.01","90","","1831.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","rel-(1R,4R,7S,10R)-7-tert.-butyl-dimethyl-silyloxy- tetracyclo[5.4.1.0^4,12^.0^10,12^]dodecan-2-one","","- C18 H30 O2 Si -","- C18 H30 O2 Si -","- C72 H120 O8 Si4 -","4","1","CF1072","Thommen, M.; Keese, R.; Förtsch, M.","A <i>cis</i>,<i>trans</i>,<i>cis</i>,<i>cis</i>-[4.5.5.5]Fenestrane Derivative","Acta Crystallographica Section C","1996","52","8","2051","2053","10.1107/S0108270196002120","","","0.71069","MoKα","","0.0718","0.0421","","0.1246","0.1071","","","","1.062","1.094","1.094","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005231","8.814","0.001","10.329","0.002","13.248","0.005","74.19","0.03","88.31","0.02","85.65","0.02","1157.1","0.5","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C23 H26 Cl2 N4 O3 -","- C23 H26 Cl2 N4 O3 -","- C46 H52 Cl4 N8 O6 -","2","2","CF1077","Bolte, M.","Nearly Centrosymmetric (<i>S</i>)-7-(2,6-Dichlorobenzyl)-8-(3-oxocyclopentyl)-1,3-dipropyl-7<i>H</i>-purine-2,6-dione","Acta Crystallographica Section C","1996","52","8","1985","1987","10.1107/S0108270196002570","","","1.5418","CuKα","","0.0639","0.0627","","0.2054","0.193","","","","1.128","1.121","1.121","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005232","10.58","0.001","13.784","0.003","15.218","0.003","66.59","0.01","86.91","0.03","75.93","0.01","1973.3","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3,6-diaza-4,5-diethoxy-9,9-dimethyl-10-hydroxy-10-isopropyl-9,10- dihydroanthracene","","- C21 H28 N2 O3 -","- C21 H28 N2 O3 -","- C84 H112 N8 O12 -","4","2","CF1097","Ianelli, S.; Nardelli, M.; Belletti, D.; Pasquier, K.; Caubère, P.","Unusual Hetarynic Condensation of 3-Bromo-2-ethoxypyridine with Diisopropyl Ketone Enolate in the Presence of a Complex Base","Acta Crystallographica Section C","1996","52","8","2097","2100","10.1107/S010827019600501X","","","0.71073","MoKα","","","0.0527","","0.1067","0.0643","","","","0.965","1.524","1.524","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005233","7.6314","0.0006","10.452","0.002","11.229","0.001","90","","90","","90","","895.7","0.2","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Cyanoferrocene","","- C11 H9 Fe N -","- C11 H9 Fe N -","- C44 H36 Fe4 N4 -","4","1","CF1114","Bell, W.; Ferguson, G.; Glidewell, C.","Cyanoferrocene: a Two-Dimensional Network Generated by Short C—H···N Hydrogen Bonds","Acta Crystallographica Section C","1996","52","8","1928","1930","10.1107/S0108270196006233","","","0.7107","MoKα","","0.0554","0.0375","","0.1039","0.0978","","","","0.934","1.015","1.015","","","","","has coordinates","192285","2020-10-21","18:00:00",""
"2005234","4.029","0.001","11.125","0.002","11.775","0.001","97.339","0.009","99.948","0.009","90.04","0.01","515.45","0.16","300","","","","","","","","","","","4","P -1","-P 1","2","","","","- C11 H7 Br O3 -","- C11 H7 Br O3 -","- C22 H14 Br2 O6 -","2","1","CR1164","Kokila, M. K.; Puttaraja; Kulkarni, M. V.; Shivaprakash, N. C.","3-Acetyl-6-bromocoumarin","Acta Crystallographica Section C","1996","52","8","2078","2081","10.1107/S0108270195010493","","","0.7093","MoKα","","","0.067","","","0.067","","","","","1.298","1.298","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005235","11.9292","0.0005","8.8839","0.0005","14.214","0.001","90","","105.089","0.004","90","","1454.43","0.15","295","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H14 O3 -","- C19 H14 O3 -","- C76 H56 O12 -","4","1","CR1187","Goeta, A. E.; Punte, G.; Jios, J. L.; Autino, J. C.","2-Acetylphenyl 1-Naphthoate","Acta Crystallographica Section C","1996","52","8","2045","2047","10.1107/S0108270196001266","","","0.71073","MoKα","","","0.0342","","","0.0411","","","","","1.15","1.15","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005236","7.1551","0.0007","13.528","0.001","9.9826","0.0009","90","","90.748","0.008","90","","966.18","0.15","183","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H22 N4 O8 -","- C18 H22 N4 O8 -","- C36 H44 N8 O16 -","2","1","CR1202","Freeman, F.; Scheuerman, R. A.; Ziller, J. W.","1-(4-Amino-6-methyl[1,3]oxazolo[5,4-<i>d</i>]pyrimidin-2-yl)-1-deoxy-<small>D</small>-ribose 5-Benzoate Dihydrate","Acta Crystallographica Section C","1996","52","8","2006","2008","10.1107/S0108270196001242","","","0.71073","MoKα","","","0.048","","","0.062","","","","","1.95","1.95","","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2005237","7.101","0.002","12.521","0.003","8.877","0.002","90","","110.6","0.03","90","","738.8","0.4","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H24 Br2 Cu N4 -","- C10 H24 Br2 Cu N4 -","- C20 H48 Br4 Cu2 N8 -","2","0.5","CR1206","Chen, X.; Long, G.; Willett, R. D.; Hawks, T.; Molnar, S.; Brewer, K.","Three Metal (1,4,8,11-Tetraazacyclotetradecane) Halide Salts","Acta Crystallographica Section C","1996","52","8","1924","1928","10.1107/S0108270195016829","","","0.71073","MoKα","","","0.057","","","0.053","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005238","9.892","0.002","6.508","0.002","16.648","0.003","90","","107.16","0.03","90","","1024","0.5","295","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C10 H36 Cl2 Mn0.66 N4 Ni0.34 O6 -","- C10 H36 Cl2 Mn0.66 N4 Ni0.34 O6 -","- C20 H72 Cl4 Mn1.32 N8 Ni0.68 O12 -","2","0.5","CR1206","Chen, X.; Long, G.; Willett, R. D.; Hawks, T.; Molnar, S.; Brewer, K.","Three Metal (1,4,8,11-Tetraazacyclotetradecane) Halide Salts","Acta Crystallographica Section C","1996","52","8","1924","1928","10.1107/S0108270195016829","","","0.71073","MoKα","","","0.077","","","0.13","","","","","1.2","1.2","","","","","has coordinates","176342","2020-10-21","18:00:00",""
"2005239","6.415","0.002","7.427","0.002","21.074","0.004","90","","90.99","0.03","90","","1003.9","0.5","295","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H35 Cl2.5 Co0.5 Mn0.5 N4 O5.5 -","- C10 H32 Cl3 Co0.5 Mn0.5 N4 O5 -","- C20 H64 Cl6 Co Mn N8 O10 -","2","0.5","CR1206","Chen, X.; Long, G.; Willett, R. D.; Hawks, T.; Molnar, S.; Brewer, K.","Three Metal (1,4,8,11-Tetraazacyclotetradecane) Halide Salts","Acta Crystallographica Section C","1996","52","8","1924","1928","10.1107/S0108270195016829","","","0.71073","MoKα","","","0.065","","","0.073","","","","","1.23","1.23","","","","","has coordinates","176342","2020-10-21","18:00:00",""
"2005240","15.082","0.003","9.19","0.0003","26.499","0.005","90","","90.533","0.009","90","","3672.7","1","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Ga3 Mo26 O48 Sr4 -","- Ga3 Mo26 O48 Sr4 -","- Ga12 Mo104 O192 Sr16 -","4","1","DU1150","Tortelier, J.; Gougeon, P.","Sr~4~Ga~3~Mo~26~O~48~ Containing Mo~7~ Clusters and Infinite Mo~7~‒Mo~10~‒Mo~7~ Chains","Acta Crystallographica Section C","1996","52","8","1862","1867","10.1107/S0108270196002727","","","0.71073","MoKα","","","0.036","","","0.039","","","","","1.325","1.325","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005241","9.711","0.001","10.907","0.002","20.669","0.003","89.58","0.01","84.04","0.01","85.54","0.01","2170.8","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(2,2'(1,2'-bicyclohexenyl))bis(triphenylphosphine)platinum(0) Tetrahydrofuran Solvate","","- C51.4 H52.8 O0.85 P2 Pt -","- C48 H46 P2 Pt -","- C96 H92 P4 Pt2 -","2","1","FG1046","Abboud, K. A.; Lu, Z.; Jones, W. M.","[2,2'-(1,3'-Bicyclohexenyl)]bis(triphenylphosphine)platinum(0) Tetrahydrofuran Solvate","Acta Crystallographica Section C","1996","52","8","1909","1911","10.1107/S0108270196000133","","","0.71073","MoKα","","0.0492","0.0367","","0.0827","0.0786","","","","0.995","1.052","1.052","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005242","15.557","0.009","13.138","0.004","17.899","0.005","90","","90","","90","","3658","3","296","","296","","","","","","","","","4","P b c n","-P 2n 2ab","60","","5,5-diethyl-1-methyl-(1H,2H,3H,5H)-hexahydropyrimidine-4,6-dione-2- spiro-9'-fluorene","","- C21 H22 N2 O2 -","- C21 H22 N2 O2 -","- C168 H176 N16 O16 -","8","1","FG1159","Gong, Y.; Robinson, P. D.; Bausch, M. J.","5,5-Diethyl-1-methyl-1<i>H</i>,2<i>H</i>,3<i>H</i>,5<i>H</i>-pyrimidine-2-spiro-9'-fluorene-4,6-dione","Acta Crystallographica Section C","1996","52","8","2081","2084","10.1107/S0108270196001485","","","0.71069","MoKα","","","0.048","","","0.044","","","","","1.38","1.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005243","6.553","0.004","10.893","0.004","20.492","0.002","90","","94.09","0.02","90","","1459","1","296","","296","","","","","","","","","2","P 1 21 1","P 2yb","4","","","","- C35 H50 -","- C35 H50 -","- C70 H100 -","2","1","FG1167","Parvez, M.; Nicholson, R.; Simion, D.; Sorensen, T. S.","Naphtho[2,3-<i>b</i>]cholestane","Acta Crystallographica Section C","1996","52","8","2113","2115","10.1107/S0108270196003599","","","0.71069","MoKα","","","0.0595","","","0.0611","","","","","3.158","3.158","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005244","10.223","0.003","14.096","0.003","21.454","0.008","90","","90","","90","","3091.6","1.6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(OC-6-2'3'-C)-Chlorobis[2-(diphenylphosphino)phenolato]oxorhenium(V)","","- C36 H28 Cl O3 P2 Re -","- C36 H28 Cl O3 P2 Re -","- C144 H112 Cl4 O12 P8 Re4 -","4","1","FG1173","Loiseau, F.; Lucchese, Y.; Dartiguenave, M.; Bélanger-Gariépy, F.; Beauchamp, A. L.","Chlorobis[2-(diphenylphosphino)phenolato-<i>O</i>,<i>P</i>]oxorhenium(V)","Acta Crystallographica Section C","1996","52","8","1968","1971","10.1107/S0108270196004106","","","1.54056","CopperKα","","0.0393","0.031","","0.065","0.0625","","","","0.74","0.781","0.781","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005245","13.511","0.001","8.72","0.001","13.972","0.002","90","","102.177","0.009","90","","1609.1","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[di(2-aminoethyl)amine]nickel(II) chloride monohydrate","","- C8 H28 Cl2 N6 Ni O -","- C8 H28 Cl2 N6 Ni O -","- C32 H112 Cl8 N24 Ni4 O4 -","4","1","FG1177","Hynes, R. C.; Willis, C. J.; Vittal, J. J.","Bis[di(2-aminoethyl)amine-<i>N</i>,<i>N</i>',<i>N</i>'']nickel(II) Chloride Monohydrate, a Redetermination","Acta Crystallographica Section C","1996","52","8","1879","1881","10.1107/S0108270196005835","","","0.71073","MoKα","","0.0488","0.035","","0.0833","0.077","","","","1.034","1.064","1.064","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005246","17.381","0.004","18.414","0.003","9.591","0.002","90","","90","","90","","3069.6","1.1","294","","294","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C40 H30 P2 -","- C40 H30 P2 -","- C160 H120 P8 -","4","1","FG1181","Fu, T. Y.; Scheffer, J. R.; Trotter, J.","(+)-(4b<i>R</i>,8b<i>R</i>,8c<i>R</i>,8d<i>R</i>)-Tetrahydrodibenzo[<i>a</i>,<i>f</i>]cyclopropa[<i>cd</i>]pentalene-8b,8c-bis(diphenylphosphine)","Acta Crystallographica Section C","1996","52","8","2095","2097","10.1107/S0108270196004477","","","1.5418","CuKα","","","0.031","","0.051","0.033","","","","0.035","1.9","1.9","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005247","8.427","0.002","9.043","0.002","10.195","0.002","115.61","0.02","102.39","0.02","90.07","0.02","680.4","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","{trans-2,2,4,4-Tetrafluoro-1,3-diphenyl-1,3-diphosphetane} -bis(pentacarbonylchromium(0))","","- C24 H10 Cr2 F4 O10 P2 -","- C24 H10 Cr2 F4 O10 P2 -","- C24 H10 Cr2 F4 O10 P2 -","1","0.5","FG1186","Jones, P. G.","<i>trans</i>-2,2,4,4-Tetrafluoro-1,3-diphenyl-1,3-diphosphetanediyl-1,3-bis[pentacarbonylchromium(0)]","Acta Crystallographica Section C","1996","52","8","1919","1921","10.1107/S0108270196004817","","","0.71073","MoKα","","0.0232","0.0219","","0.0632","0.059","","","","1.08","1.087","1.087","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005248","14.817","0.003","17.322","0.004","16.788","0.003","90","","107.24","0.02","90","","4115.2","1.5","143","2","143","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(3',5'-Bis-trifluoromethyl-phenyl)-8-(4""-methoxy-phenyl)-naphthalene","","- C25 H16 F6 O -","- C25 H16 F6 O -","- C200 H128 F48 O8 -","8","2","FG1206","Bahl, A.; Grahn, W.; Jones, P. G.","1-[3,5-Bis(trifluoromethyl)phenyl]-8-(4-methoxyphenyl)naphthalene: a Novel Three-Dimensional Non-Linear Optical Chromophore","Acta Crystallographica Section C","1996","52","8","2014","2017","10.1107/S0108270196007834","","","0.71073","MoKα","","0.0968","0.0535","","0.1365","0.1027","","","","1.078","1.076","1.076","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005249","9.376","0.001","9.187","0.002","22.287","0.005","90","","94.62","0.01","90","","1913.5","0.6","143","2","143","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl-{4-[8-(4-trifluoromethyl-phenyl)-naphthalen-1-yl]-phenyl}-selane","","- C24 H17 F3 Se -","- C24 H17 F3 Se -","- C96 H68 F12 Se4 -","4","1","FG1208","Bahl, A.; Grahn, W.; Jones, P. G.","Methyl {4-[8-(4-Trifluoromethylphenyl)naphthalen-1-yl]phenyl} Selenide","Acta Crystallographica Section C","1996","52","8","2017","2020","10.1107/S0108270196007846","","","0.71073","MoKα","","0.064","0.0492","","0.1327","0.1132","","","","1.038","1.03","1.03","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005250","11.815","0.003","19.334","0.002","8.839","0.002","90","","90","","90","","2019.1","0.7","294.2","","294.2","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C11 H27 Cl2 Cu N5 O8 -","- C11 H27 Cl2 Cu N5 O8 -","- C44 H108 Cl8 Cu4 N20 O32 -","4","1","FG1210","Dittler-Klingemann, A. M.; Hahn, F. E.; Orvig, C.; Rettig, S. J.","(Acetonitrile)[<i>N</i>,<i>N</i>-bis(3-aminopropyl)-1,3-propanediamine-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']copper(II) Diperchlorate","Acta Crystallographica Section C","1996","52","8","1957","1959","10.1107/S0108270196007858","","","0.7107","MoKα","","0.2274","0.0392","","0.0473","0.0339","","","","","1.581","1.581","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005251","14.605","0.003","9.877","0.002","7.569","0.001","90","","92.44","0.02","90","","1090.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H30 N2 S4 Zn2 -","- C14 H30 N2 S4 Zn2 -","- C28 H60 N4 S8 Zn4 -","2","0.5","HU1091","Malik, M. A.; O'Brien, P.; Motevalli, M.","Bis(μ-diethyldithiocarbamato)-1κ<i>S</i>,1:2κ^2^<i>S</i>';2κ<i>S</i>,1:2κ^2^<i>S</i>'-bis(ethylzinc)","Acta Crystallographica Section C","1996","52","8","1931","1933","10.1107/S0108270196002831","","","0.71069","MoKα","","0.05","0.0337","","0.0918","0.0886","","","","1.024","1.138","1.138","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005252","9.387","0.0004","10.0616","0.0004","21.722","0.001","90","","90","","90","","2051.6","0.15","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1'R,2R,2'S,4""S)-3-(4""-Benzyl-oxazolidin-2""-one-3""-yl) -3-oxo-2-(2'-vinyl-cyclohexyl)-propionic acid methyl ester","","- C22 H27 N O5 -","- C22 H27 N O5 -","- C88 H108 N4 O20 -","4","1","JZ1097","Schäfer, M.; Herbst-Irmer, R.; Pohl, E.; Schünke, C.; Tietze, L. F.","(2<i>R</i>)-3-[(4<i>S</i>)-4-Benzyl-2-oxo-3-oxazolidinyl]-3-oxo-2-[(1<i>R</i>,2<i>S</i>)-2-vinylcyclohexyl]propionic Acid Methyl Ester and (2<i>R</i>)-3-[(4<i>S</i>)-4-Benzyl-2-oxo-3-oxazolidinyl]-3-oxo-2-[(1<i>R</i>,2<i>S</i>)-2-vinylcyclopentyl]propionic Acid Methyl Ester","Acta Crystallographica Section C","1996","52","8","2029","2032","10.1107/S010827019600159X","","","1.54178","CuKα","","0.0491","0.0429","","0.1122","0.1072","","","","1.044","1.064","1.064","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005253","9.272","0.005","9.699","0.002","21.21","0.006","90","","90","","90","","1907.4","1.2","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1'R,2R,2'S,4''S)-3-(4''-Benzyl-oxazolidin-2''-one-3''-yl) -3-oxo-2-(2'-vinyl-cyclopentyl)-propionic acid methyl ester","","- C21 H25 N O5 -","- C21 H25 N O5 -","- C84 H100 N4 O20 -","4","1","JZ1097","Schäfer, M.; Herbst-Irmer, R.; Pohl, E.; Schünke, C.; Tietze, L. F.","(2<i>R</i>)-3-[(4<i>S</i>)-4-Benzyl-2-oxo-3-oxazolidinyl]-3-oxo-2-[(1<i>R</i>,2<i>S</i>)-2-vinylcyclohexyl]propionic Acid Methyl Ester and (2<i>R</i>)-3-[(4<i>S</i>)-4-Benzyl-2-oxo-3-oxazolidinyl]-3-oxo-2-[(1<i>R</i>,2<i>S</i>)-2-vinylcyclopentyl]propionic Acid Methyl Ester","Acta Crystallographica Section C","1996","52","8","2029","2032","10.1107/S010827019600159X","","","0.71073","MoKα","","0.0495","0.0415","","0.1072","0.0979","","","","1.079","1.042","1.042","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005254","9.364","0.001","10.457","0.001","11.311","0.002","71.47","0.01","76.13","0.01","75.27","0.01","1000.3","0.2","170","2","170","2","","","","","","","","3","P -1","-P 1","2","","Dicyano[7,7-dimethyl-2,5-di-p-tolyl-3,4-diazabicyclo[4.1.0] hept-2,4-diene-3-ium-3-yl]methanide","","- C24 H22 N4 -","- C24 H22 N4 -","- C48 H44 N8 -","2","1","JZ1114","Breu, J.; Range, K.-J.; Riebel, P.; Weber, A.; Sauer, J.","Dicyano(7,7-dimethyl-2,5-di-<i>p</i>-tolyl-3,4-diazabicyclo[4.1.0]hepta-2,4-dien-3-ium-3-yl)methanide and (4-Benzoyl-5,5-dimethyl-2-phenyl-1-azacyclopenta-1,3-dien-1-ium-1-yl)dicyanomethanide, Two Stable Azomethine Ylides","Acta Crystallographica Section C","1996","52","8","2053","2056","10.1107/S0108270196001084","","","0.71069","MoKα","","0.144","0.0574","","0.1442","0.0947","","","","0.97","1.392","1.392","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005255","8.978","0.001","9.367","0.001","12.043","0.002","76.54","0.01","76.58","0.01","63.662","0.009","873","0.2","170","2","170","2","","","","","","","","4","P -1","-P 1","2","","Dicyano[4-benzoyl-5,5-dimethyl-2-phenyl-1-azacyclopenta-1,3-diene-1-ium-1-yl] methanide","","- C22 H17 N3 O -","- C22 H17 N3 O -","- C44 H34 N6 O2 -","2","1","JZ1114","Breu, J.; Range, K.-J.; Riebel, P.; Weber, A.; Sauer, J.","Dicyano(7,7-dimethyl-2,5-di-<i>p</i>-tolyl-3,4-diazabicyclo[4.1.0]hepta-2,4-dien-3-ium-3-yl)methanide and (4-Benzoyl-5,5-dimethyl-2-phenyl-1-azacyclopenta-1,3-dien-1-ium-1-yl)dicyanomethanide, Two Stable Azomethine Ylides","Acta Crystallographica Section C","1996","52","8","2053","2056","10.1107/S0108270196001084","","","0.71069","MoKα","","0.0638","0.0329","","0.0714","0.0652","","","","0.839","0.969","0.969","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005256","7.646","0.004","7.646","0.004","26.29","0.01","90","","90","","120","","1331","1.1","293","2","293","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- Cl7 Cs4 Yb -","- Cl7.02 Cs4 Yb -","- Cl21.06 Cs12 Yb3 -","3","0.0833333","JZ1121","Reuter, G.; Sebastian, J.; Frenzen, G.","Tetracaesium Ytterbium Heptachloride with Partly Disordered Chloride Ions","Acta Crystallographica Section C","1996","52","8","1859","1862","10.1107/S0108270196003137","","","0.71073","MoKα","","0.0409","0.0395","","0.0921","0.0914","","","","1.27","1.272","1.272","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005257","14.0585","0.0009","7.6504","0.0004","18.655","0.001","90","","93.599","0.006","90","","2002.4","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diiodo-bis(nicotinamide-N^1^-acetato)zinc(II)","","- C16 H16 I2 N4 O6 Zn -","- C16 H16 I2 N4 O6 Zn -","- C64 H64 I8 N16 O24 Zn4 -","4","0.5","JZ1127","Zelenák, V.; Györyová, K.; Císarová, I.; Loub, J.","Diiodobis(nicotinamide-<i>N</i>^1^-acetate-<i>O</i>)zinc(II)","Acta Crystallographica Section C","1996","52","8","1917","1919","10.1107/S0108270196004295","","","0.71069","MoKα","","0.0221","0.0208","","0.0537","0.0531","","","","1.113","1.126","1.126","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005258","7.345","0.003","10.532","0.003","15.129","0.004","102","0.02","100.16","0.02","80.99","0.03","1118","0.6","293","","","","","","","","","","","4","P 1","P 1","1","","","","- C26 H31 N O3 -","- C26 H29 N O3 -","- C52 H58 N2 O6 -","2","2","KA1137","Stankovic, S.; Lazar, D.; Miljkovic, D.; Medic-Mijacevic, L.; Gasi, K.; Kovacevic, R.; Courseille, C.","17α-Benzyl-17β-hydroxy-16-hydroxyimino-3-methoxyestra-1,3,5(10)-triene","Acta Crystallographica Section C","1996","52","8","2037","2040","10.1107/S0108270195011309","","","1.54184","CuKα","","","0.067","","","0.068","","","","","2.42","2.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005259","12.032","0.001","7.742","0.001","15.148","0.001","90","","90.92","0.01","90","","1410.9","0.2","296","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C32 H52 O2 -","- C32 H52 O2 -","- C64 H104 O4 -","2","1","KA1168","Kiyotani, T.; Kitajima, J.; Tanaka, Y.; Ageta, H.","Rhoiptelenyl Acetate, a New Pentacyclic Triterpenoid from <i>Ficus thunbergii</i>","Acta Crystallographica Section C","1996","52","8","2024","2026","10.1107/S0108270196001588","","","0.71073","MoKα","","","0.056","","","0.049","","","","","1.38","1.38","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005260","5.432","0.001","3.769","0.001","21.959","0.004","90","","95.66","0.03","90","","447.38","0.17","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H12 N8 O4 -","- C2 H14 N8 O4 -","- C4 H28 N16 O8 -","2","0.5","KA1171","Bircher, H.-R.; Ochsenbein, P.; Hauser, J.; Bürgi, H.-B.","Bis(hydrazinium) <i>N</i>,<i>N</i>'-Dinitroethylenediaminate(2 ‒)","Acta Crystallographica Section C","1996","52","8","2002","2004","10.1107/S0108270196002521","","","0.71073","MoKα","","0.0482","0.0318","","0.1006","0.0897","","","","1.034","1.073","1.073","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005261","8.481","0.002","7.584","0.002","14.917","0.003","90","","100.6","0.2","90","","943.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(4,6-Dichloro-[1,3,5]triazin-2-ylethynyl)-dimethyl-amine","","- C7 H6 Cl2 N4 -","- C7 H6 Cl2 N4 -","- C28 H24 Cl8 N16 -","4","1","KA1174","Wilhelm, P.; Boss, C.; Pfammatter, M.; Thommen, M.; Ploom, T.; Schauder, S.; Berger, U.; Vanhelmont, F.; Förtsch, M.; Hauser, J.; Bürgi, H.-B.","(4,6-Dichloro-1,3,5-triazin-2-ylethynyl)dimethylamine","Acta Crystallographica Section C","1996","52","8","2004","2006","10.1107/S0108270196002545","","","0.71069","MoKα","","0.0715","0.0308","","0.0876","0.0797","","","","1.014","1.153","1.153","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005262","11.773","0.003","11.408","0.001","14.83","0.003","90","","112.32","0.02","90","","1842.5","0.7","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H23 N3 O S -","- C19 H23 N3 O S -","- C76 H92 N12 O4 S4 -","4","1","KA1178","Sudha, L.; Selvan, J. S.; Subramanian, K.; Steiner, Th.; Koellner, G.; Srinivasan, N.; Ramdas, K.","1,3-Bis(2-methylphenyl)-2-(4-morpholino)isothiourea","Acta Crystallographica Section C","1996","52","8","2047","2049","10.1107/S0108270196002429","","","1.54184","CuKα","","","0.058","","0.175","0.141","","","","1.138","1.138","1.138","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005263","6.41","0.003","13.34","0.004","23.851","0.005","90","","90","","90","","2039.5","1.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","β-Estradiol 3-benzoate","(17β)-Estra-1,3,5(10)-triene-3,17-diol 3-benzoate","","- C25 H28 O3 -","- C25 H28 O3 -","- C100 H112 O12 -","4","1","KA1186","Bolaños-García, V. M.; Juárez-Martínez, G.; Panneerselvam, K.; Soriano-García, M.","17β-Estradiol 3-Benzoate","Acta Crystallographica Section C","1996","52","8","1997","2000","10.1107/S0108270196002752","","","1.54178","CuKα","","0.0369","0.0348","","0.0958","0.0936","","","","1.039","1.052","1.052","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005264","7.665","0.001","14.816","0.001","13.237","0.001","90","","93.83","0.001","90","","1499.9","0.2","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-phenyl-2-(propyl-amino)-penthane","","- C14 H24 Cl N -","- C14 H24 Cl N -","- C56 H96 Cl4 N4 -","4","2","KA1192","Simon, K.; Harmat, V.; Török, Z.; Böcskei, Z.; Hermecz, I.","1-Phenyl-2-(propylamino)pentane, a Memory Enhancer","Acta Crystallographica Section C","1996","52","8","2090","2092","10.1107/S0108270196005148","","","1.5418","CuKα","","0.1074","0.0528","","0.1654","0.1568","","","","1.024","1.207","1.207","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005265","10.303","0.002","23.585","0.003","5.335","0.003","90","","90","","90","","1296.4","0.8","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","trimethylsilyl N-p-bromo phenyl carbamate","","- C10 H14 Br N O2 Si -","- C10 H14 Br N O2 Si -","- C40 H56 Br4 N4 O8 Si4 -","4","1","KA1195","Böcskei, Z.; Rohonczy, J.; Szalay, R.; Knausz, D.","Two <i>N</i>-Aryl-Substituted Silyl Carbamates","Acta Crystallographica Section C","1996","52","8","2063","2066","10.1107/S0108270196006439","","","1.54178","CuKα","","0.0743","0.0417","","0.1257","0.0985","","","","1.098","1.06","1.06","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005266","18.508","0.005","6.24","0.009","28.128","0.006","90","","94.57","0.02","90","","3238","5","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","trimethylsilyl N-phenyl N-tert-buthyl carbamate","","- C14 H23 N O2 Si -","- C14 H23 N O2 Si -","- C112 H184 N8 O16 Si8 -","8","2","KA1195","Böcskei, Z.; Rohonczy, J.; Szalay, R.; Knausz, D.","Two <i>N</i>-Aryl-Substituted Silyl Carbamates","Acta Crystallographica Section C","1996","52","8","2063","2066","10.1107/S0108270196006439","","","1.54178","CuKα","","0.1177","0.0434","","0.1435","0.1027","","","","1.082","1.093","1.093","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005267","8.398","0.002","9.858","0.002","12.781","0.003","94.89","0.01","103.94","0.02","113.36","0.02","923.2","0.4","293","2","293","2","","","","","","","","3","P 1","P 1","1","","β-zearalenol sesquihydrate","","- C18 H27 O6.5 -","- C18 H27 O6.5 -","- C36 H54 O13 -","2","2","KA1204","Panneerselvam, K.; Rudiño-Piñera, E.; Soriano-García, M.","β-Zearalenol Sesquihydrate","Acta Crystallographica Section C","1996","52","8","1995","1997","10.1107/S0108270196006415","","","1.54178","CuKα","","0.0361","0.0342","","0.091","0.0886","","","","1.068","1.07","1.07","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005268","11.364","0.002","8.485","0.002","9.868","0.002","90","","109.24","0.03","90","","898.4","0.4","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H8 N8 O3 -","- C4 H8 N8 O3 -","- C16 H32 N32 O12 -","4","1","KH1062","Dong, S.; Zhang, G.; Chen, B.; Ou, Y.; Jai, H.","A New Energetic Material: an Azidoethylamine Salt of Triazole","Acta Crystallographica Section C","1996","52","8","2057","2058","10.1107/S0108270196004921","","","0.71073","MoKα","","","0.0501","","","0.0551","","","","","1.65","1.65","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005269","8.387","0.008","12.111","0.002","12.619","0.002","111.27","0.02","102.06","0.03","99.81","0.05","1124.7","1.2","296","","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H25 Dy O -","- C28 H25 Dy O -","- C56 H50 Dy2 O2 -","2","1","KH1066","Zhou, X.; Ma, H.; Wu, Z.; You, X.; Xu, Z.; Zhang, Y.; Huang, X.","Benzophenone Adduct of Tris(cyclopentadienyl)dysprosium","Acta Crystallographica Section C","1996","52","8","1875","1877","10.1107/S0108270196002934","","","0.71073","MoKα","","","0.03","","","0.039","","","","","1.34","1.34","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005270","7.793","0.002","12.448","0.002","13.021","0.003","82.1","0.03","75.06","0.03","86.06","0.03","1208.1","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","bis (2-carboxyl-9-dihydroxymethyl-1,10-phenanthroline) copper(II) hydrate","","- C28 H20 Cu N4 O9 -","- C28 H20 Cu N4 O9 -","- C56 H40 Cu2 N8 O18 -","2","1","KH1071","Sabel, D. M.; Thompson, J. A.; Butcher, R.; Smith, P. H.","2-Carboxy-9-dihydroxymethyl-1,10-phenanthroline Complexes of Cobalt(II) and Copper(II)","Acta Crystallographica Section C","1996","52","8","1950","1954","10.1107/S010827019600443X","","","0.71073","MoKα","","0.2333","0.1053","","0.278","0.1202","","","","3.6","3.6","3.6","","","","","has coordinates,has disorder","200176","2020-10-21","18:00:00",""
"2005271","7.778","0.002","12.219","0.002","12.93","0.003","83.24","0.03","75.71","0.03","86.45","0.03","1181.9","0.5","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","bis(2-carboxyl-9-dihydroxymethyl-1,10-phenanthroline) cobalt(II) hydrate","","- C28 H20 Co N4 O9 -","- C28 H20 Co N4 O9 -","- C56 H40 Co2 N8 O18 -","2","1","KH1071","Sabel, D. M.; Thompson, J. A.; Butcher, R.; Smith, P. H.","2-Carboxy-9-dihydroxymethyl-1,10-phenanthroline Complexes of Cobalt(II) and Copper(II)","Acta Crystallographica Section C","1996","52","8","1950","1954","10.1107/S010827019600443X","","","0.71073","MoKα","","0.1242","0.0644","","0.1056","0.0868","","","","1.14","1.14","1.14","","","","","has coordinates,has disorder","200176","2020-10-21","18:00:00",""
"2005272","8.683","0.003","16.309","0.005","9.216","0.004","90","","99.25","0.03","90","","1288.1","0.8","296","","","","","","","","","","","6","P 1 21 1","","","","","","- C18 H41 Cl N4 O7 Zn -","- C18 H41 Cl N4 O7 Zn -","- C36 H82 Cl2 N8 O14 Zn2 -","2","1","KH1072","H.-M. Hu; H.-S. Sun; X.-Z. You; X.-Y. Huang","(Acetato-<i>O</i>)(<i>meso</i>-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')zinc(II) Perchlorate Monohydrate","Acta Crystallographica Section C","1996","52","8","1946","1948","10.1107/S0108270196004945","","","0.71073","MoKα","","","0.034","","","0.044","","","","","1.47","1.47","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005273","12.221","0.003","20.75","0.003","13.902","0.002","90","","106.94","0.02","90","","3372.4","1.1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Tetrachlorotin Bis(diphenylphosphonato)ferrocene.","","- C34 H28 Cl4 Fe O2 P2 Sn -","- C34 H28 Cl4 Fe O2 P2 Sn -","- C136 H112 Cl16 Fe4 O8 P8 Sn4 -","4","1","KH1088","Yamin, B. M.; bin Shawkataly, O.; Fun, H.-K.; Sivakumar, K.","[1,1'-Bis(diphenylphosphonato-<i>O</i>)ferrocene]tetrachlorotin","Acta Crystallographica Section C","1996","52","8","1966","1968","10.1107/S0108270196001758","","","0.71073","MoKα","","0.0451","0.0331","","0.0912","0.0865","","","","0.98","1.052","1.052","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005274","10.845","0.001","7.773","0.001","24.018","0.001","90","","97.37","0.01","90","","2007.9","0.3","299","","299","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1R*,2R*)-2-[(S*)-1-benzyloxyethyl]-1-(1-[(Z)-(2,4-dinitrophenylhydrazono] ethyl)cyclopropane","","- C20 H22 N4 O5 -","- C20 H22 N4 O5 -","- C80 H88 N16 O20 -","4","1","KH1094","Ohba, S.","(1<i>R</i>*,2<i>R</i>*)-2-[(<i>S</i>*)-1-Benzyloxyethyl]-1-cyclopropyl Methyl Ketone (<i>Z</i>)-2,4-Dinitrophenylhydrazone","Acta Crystallographica Section C","1996","52","8","2118","2119","10.1107/S0108270196004283","","","0.71073","MoKα","","","0.0566","","","0.0541","","","","","1.89","1.89","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2005275","15.328","0.007","15.621","0.006","12.427","0.004","103.18","0.03","93.98","0.04","110.49","0.03","2677","2","296","","","","","","","","","","","7","P -1","-P 1","2","","","","- C18 H28 N2 O4 P2 S4 Zn -","- C20 H28 N2 O4 P2 S4 Zn -","- C80 H112 N8 O16 P8 S16 Zn4 -","4","2","MU1140","Zhu, D.-L.; Yu, Y.-P.; Guo, G.-C.; Zhuang, H.-H.; Huang, J.-S.; Liu, Q.; Xu, Z.; You, X.-Z.","<i>catena</i>-Poly[bis(<i>O</i>,<i>O</i>'-diethyldithiophosphato-<i>S</i>)zinc(II)-μ-4,4'-bipyridyl-<i>N</i>:<i>N</i>']","Acta Crystallographica Section C","1996","52","8","1963","1966","10.1107/S010827019600368X","","","0.71073","MoKα","","","0.055","","","0.07","","","","","1.68","1.68","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005276","9.942","0.002","9.245","0.002","20.982","0.004","90","0.02","99.12","0.02","90","0.02","1904.2","0.7","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Zinc-meso-tetra-p-tolylporphyrin","","- C48 H36 N4 Zn -","- C48 H36 N4 Zn -","- C96 H72 N8 Zn2 -","2","0.5","MU1248","Dastidar, P.; Goldberg, I.","Zinc‒<i>meso</i>-tetra-<i>p</i>-tolylporphyrin and its Chlorotoluene Channel-Type Clathrate with π‒π and C—H···π Interaction Modes Stabilizing the Porphyrin Host Lattice","Acta Crystallographica Section C","1996","52","8","1976","1980","10.1107/S0108270196002338","","","0.7107","MoKα","","0.0594","0.0473","","0.1461","0.1352","","","","1.012","1.034","1.034","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005277","32.468","0.009","9.532","0.001","15.048","0.002","90","0.01","112.03","0.02","90","0.01","4317.1","1.5","297","2","297","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","zinc-meso-tetra-p-tolylporphyrin m-chlorotoluene solvate","","- C55 H43 Cl N4 Zn -","- C48 H36 N4 Zn -","- C192 H144 N16 Zn4 -","4","0.5","MU1248","Dastidar, P.; Goldberg, I.","Zinc‒<i>meso</i>-tetra-<i>p</i>-tolylporphyrin and its Chlorotoluene Channel-Type Clathrate with π‒π and C—H···π Interaction Modes Stabilizing the Porphyrin Host Lattice","Acta Crystallographica Section C","1996","52","8","1976","1980","10.1107/S0108270196002338","","","0.7107","MoKα","","0.1391","0.0975","","0.2834","0.2656","","","","1.405","1.669","1.669","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005278","6.397","0.001","10.405","0.001","12.347","0.001","69.78","0.01","85.58","0.01","78.77","0.01","756.37","0.16","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bis(N,N'-dimethylthiourea)silver(I) Perchlorate.","","- C6 H16 Ag Cl N4 O4 S2 -","- C6 H16 Ag Cl N4 O8 S2 -","- C12 H32 Ag2 Cl2 N8 O16 S4 -","2","1","MU1251","Pakawatchai, C.; Sivakumar, K.; Fun, H.-K.","Bis(<i>N</i>,<i>N</i>'-dimethylthiourea-<i>S</i>)silver(I) Perchlorate and Tris(<i>N</i>,<i>N</i>'-dimethylthiourea-<i>S</i>)silver(I) Perchlorate","Acta Crystallographica Section C","1996","52","8","1954","1957","10.1107/S0108270196002971","","","0.71073","MoKα","","0.046","0.0384","","0.1148","0.1104","","","","1.044","1.114","1.114","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005279","9.887","0.001","10.096","0.001","10.687","0.001","90.96","0.01","105.68","0.01","95.15","0.01","1021.99","0.18","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Tris(N,N'-dimethylthiourea)silver(I) Perchlorate.","","- C9 H24 Ag Cl N6 O4 S3 -","- C9 H24 Ag Cl N6 O4 S3 -","- C18 H48 Ag2 Cl2 N12 O8 S6 -","2","1","MU1251","Pakawatchai, C.; Sivakumar, K.; Fun, H.-K.","Bis(<i>N</i>,<i>N</i>'-dimethylthiourea-<i>S</i>)silver(I) Perchlorate and Tris(<i>N</i>,<i>N</i>'-dimethylthiourea-<i>S</i>)silver(I) Perchlorate","Acta Crystallographica Section C","1996","52","8","1954","1957","10.1107/S0108270196002971","","","0.71073","MoKα","","0.035","0.0318","","0.0861","0.0844","","","","1.08","1.118","1.118","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005280","13.329","0.002","13.647","0.001","14.467","0.001","89.7","0.01","79.47","0.01","80.09","0.01","2547.7","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Isothiocyanatotris(triphenylphosphine)silver(I) chloroform solvate","","- C56 H46 Ag Cl3 N P3 S -","- C56 H46 Ag Cl3 N P3 S -","- C112 H92 Ag2 Cl6 N2 P6 S2 -","2","1","MU1253","Othman, A. H.; Fun, H.-K.; Sivakumar, K.; Farina, Y.; Baba, I.","(Thiocyanato-<i>N</i>)tris(triphenylphosphine)silver(I) Chloroform Solvate","Acta Crystallographica Section C","1996","52","8","1933","1935","10.1107/S0108270196003733","","","0.71073","MoKα","","0.0672","0.0513","","0.1641","0.1541","","","","1.059","1.144","1.144","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005281","8.3934","0.0008","10.009","0.001","11.954","0.001","71.137","0.008","94.378","0.008","93.974","0.009","946.48","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aqua[bis(3-aminopropyl)amine-N,N',N''](glutarato)copper tetrahydrate","","- C11 H33 Cu N3 O9 -","- C11 H33 Cu N3 O9 -","- C22 H66 Cu2 N6 O18 -","2","1","MU1258","Pajunen, A.; Pajunen, S.; Kivikoski, J.; Valkonen, J.","Aqua[bis(3-aminopropyl)amine-<i>N</i>,<i>N</i>',<i>N</i>''](glutarato-<i>O</i>)copper(II) Tetrahydrate","Acta Crystallographica Section C","1996","52","8","1901","1903","10.1107/S0108270196004064","","","0.71069","MoKα","","0.0604","0.0335","","0.0889","0.0807","","","","1.038","1.082","1.082","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005282","14.405","0.002","15.805","0.002","20.644","0.005","90","","99.61","0.02","90","","4634.1","1.4","293","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H48 Cl14 Cu4 N8 O5 -","- C22 H36 Cl14 Cu4 N8 O5 -","- C88 H144 Cl56 Cu16 N32 O20 -","4","0.5","NA1210","Jackson, G. E.; Voyé, A.; Bourne, S. A.","Bis[5,5-dichloro-4,6-dioxo-3,7-diaza-1,9-nonanediylbis(dimethylammonium)] Tetrachlorohexa-μ-chloro-μ~4~-oxo-tetracuprate(II)","Acta Crystallographica Section C","1996","52","8","1907","1908","10.1107/S0108270196002764","","","0.71073","MoKα","","","0.049","","","0.059","","","","","1.094","1.094","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005283","5.935","0.004","11.358","0.001","10.49","0.002","90","","94.66","0.01","90","","704.8","0.5","292","","292","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bisthiourea-cadmium perrhenate","","- C2 H8 Cd N4 O8 Re2 S2 -","- C2 H8 Cd N4 O8 Re2 S2 -","- C4 H16 Cd2 N8 O16 Re4 S4 -","2","0.5","NA1219","Petrova, R.; Angelova, O.; Macícek, J.","Molecular Adducts of Inorganic Salts. VI. The Dimorphism of Cd(ReO~4~)~2~.2tu (tu = Thiourea)","Acta Crystallographica Section C","1996","52","8","1935","1939","10.1107/S010827019600412X","","","0.71073","MoKα","","0.038","0.031","","0.044","0.044","","","","0.98","0.996","0.996","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005284","8.931","0.002","9.066","0.003","10.125","0.001","76.46","0.02","67.08","0.01","66.39","0.03","688.9","0.3","292","","292","","","","","","","","","7","P -1","-P 1","2","","Bisthiourea-cadmium perrhenate","","- C2 H8 Cd N4 O8 Re2 S2 -","- C2 H8 Cd N4 O8 Re2 S2 -","- C4 H16 Cd2 N8 O16 Re4 S4 -","2","1","NA1219","Petrova, R.; Angelova, O.; Macícek, J.","Molecular Adducts of Inorganic Salts. VI. The Dimorphism of Cd(ReO~4~)~2~.2tu (tu = Thiourea)","Acta Crystallographica Section C","1996","52","8","1935","1939","10.1107/S010827019600412X","","","0.71073","MoKα","","0.064","0.038","","0.057","0.054","","","","1.091","1.041","1.041","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005285","12.987","0.002","24.929","0.002","15.472","0.002","90","","92","0.02","90","","5006.1","1.1","293","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C57 H54 Cl3 N P2 Ru -","- C57 H54 Cl3 N P2 Ru -","- C228 H216 Cl12 N4 P8 Ru4 -","4","1","NA1221","Bianchini, C.; Masi, D.; Peruzzini, M.; Romerosa, A.; Zanobini, F.","<i>anti</i>,<i>mer</i>-[Bis(2-diphenylphosphinoethyl)(<i>n</i>-propyl)amine-<i>N</i>,<i>P</i>,<i>P</i>'](phenylethynyl)[(<i>Z</i>)-1-<i>p</i>-tolyl-4-phenyl-η^3^-but-1-en-3-ynyl]ruthenium(II) Chloroform Solvate","Acta Crystallographica Section C","1996","52","8","1973","1976","10.1107/S0108270196002776","","","0.71073","MoKα","","","0.0625","","","0.1516","","","","","1.017","1.017","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005286","8.566","0.002","14.191","0.004","7.246","0.002","91.63","0.02","114.41","0.09","91.42","0.02","801.1","0.7","295","","298","","","","","","","","","5","P -1","-P 1","2","","3,4-dihydro-6-(3'-methylbenzyl)-2-(2-methylpropyl)thio-4-oxopyrimidine","","- C16 H20 N2 O S -","- C16 H20 N2 O S -","- C32 H40 N4 O2 S2 -","2","1","NA1234","Ettorre, A.; Mai, A.; Artico, M.; Massa, S.; De Montis, A.; La Colla, P.","6-(3-Methylbenzyl)-2-(2-methylpropyl)thio-4(3<i>H</i>)-pyrimidinone (DABO 622)","Acta Crystallographica Section C","1996","52","8","2115","2117","10.1107/S0108270196006117","","","1.54178","CuKα","","","0.056","","","0.067","","","","","1.9","1.9","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2005287","17.0543","0.0007","9.6959","0.0006","35.025","0.002","90","","96.813","0.004","90","","5750.7","0.5","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(4-Chlorophenyl)-4-hydroxy-N,N-dimethyl-α,α-diphenyl- 1-piperidinebutanamide-N-oxide","","- C29 H37.5 Cl N2 O5.25 -","- C29 H39 Cl N2 O7 -","- C232 H312 Cl8 N16 O56 -","8","1","NA1244","Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","4-(4-Chlorophenyl)-4-hydroxy-<i>N</i>,<i>N</i>-dimethyl-α,α-diphenyl-1-piperidinebutanamide <i>N</i>-Oxide Hydrate (Loperamide <i>N</i>-Oxide Hydrate)","Acta Crystallographica Section C","1996","52","8","2100","2102","10.1107/S0108270196005884","","","1.54184","CuKα","","0.0637","0.0489","","0.1407","0.1403","","","","1.057","1.054","1.054","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005288","10.622","0.002","18.234","0.001","10.4","0.002","95.31","0.01","120.16","0.01","96.62","0.01","1703.2","0.5","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- H34 Mo9 N6 O35 -","- Mo9 N6 O35 -","- Mo18 N12 O70 -","2","1","OH1091","Yamase, T.; Sugeta, M.; Ishikawa, E.","Zigzag Chain Structure of Hexaammonium Enneamolybdate Pentahydrate","Acta Crystallographica Section C","1996","52","8","1869","1872","10.1107/S010827019501585X","","","0.71069","MoKα","","","0.0414","","","0.0337","","","","","1.826","1.826","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005289","8.349","0.0007","17.725","0.002","10.129","0.002","90","","90.866","0.009","90","","1498.8","0.4","293","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H17 Ag Cu N2 O10 -","- C10 H17 Ag Cu N2 O10 -","- C40 H68 Ag4 Cu4 N8 O40 -","4","1","PA1208","Brouca-Cabarrecq, C.; Marrot, B.; Mosset, A.","A New Bimetallic Complex of Ethylenediaminetetraacetic Acid: Ag[Cu(C~10~H~13~N~2~O~8~)(H~2~O)].H~2~O","Acta Crystallographica Section C","1996","52","8","1903","1906","10.1107/S0108270195014715","","","1.54184","CuKα","","","0.0297","","","0.0331","","","","","0.883","0.883","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005290","13.401","0.004","9.103","0.002","12.375","0.008","90","","103.84","0.03","90","","1465.8","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Nitro-4-methylaniline","","- C7 H8 N2 O2 -","- C7 H8 N2 O2 -","- C56 H64 N16 O16 -","8","1","PA1210","Ellena, J.; Punte, G.; Rivero, B. E.","4-Methyl-2-nitroaniline","Acta Crystallographica Section C","1996","52","8","2074","2076","10.1107/S0108270195016234","","","0.71073","MoKα","","0.1097","0.0533","","0.0937","0.0729","","","","1.38","1.458","1.458","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005291","9.285","0.003","18.287","0.008","19.427","0.006","90","","99.55","0.04","90","","3253","2","296","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H37 Au Cl Fe N P -","- C36 H37 Au Cl Fe N P -","- C144 H148 Au4 Cl4 Fe4 N4 P4 -","4","1","PA1217","Viotte, M.; Gautheron, B.; Parish, R. G.; Pritchard, R. G.","Chloro[(α-dimethylamino[3]ferrocenophan-2-yl)diphenylphosphino]gold(I) Benzene Solvate","Acta Crystallographica Section C","1996","52","8","1891","1894","10.1107/S0108270196001928","","","0.71069","MoKα","","","0.068","","","0.064","","","","","2.97","2.97","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005292","9.8355","0.0004","8.2688","0.0004","14.7126","0.0008","90","","107.567","0.004","90","","1140.74","0.1","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","trimethyl(10E,12E)-cis-bicyclo[12.3.0] heptadeca10,12-diene-4,17-dione-1,8,8-tricarboxylate","","- C23 H30 O8 -","- C23 H30 O8 -","- C46 H60 O16 -","2","1","PT1020","Drouin, M.; Couturier, M.; Crevisy, C.; Dory, Y. L.; Deslongchamps, P.","Two 14-Membered Macrocycles with <i>trans</i>-<i>trans</i> and <i>trans</i>-<i>cis</i> Dienes. Trimethyl (2<i>E</i>,4<i>E</i>)-<i>cis</i>- and Trimethyl (2<i>Z</i>,4<i>E</i>)-<i>trans</i>-11,15-Dioxobicyclo[12.3.0]heptadeca-2,4-diene-7,7,14-tricarboxylate","Acta Crystallographica Section C","1996","52","8","2084","2087","10.1107/S0108270195016817","","","1.54184","CuKα","","0.0505","0.0413","","0.1121","0.1055","","","","1.049","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005293","13.6059","0.0006","15.6454","0.0006","10.684","0.0005","90","","95.735","0.004","90","","2262.92","0.17","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","trimethyl(10E,12Z)-trans-bicyclo[12.3.0] heptadeca10,12-diene-4,17-dione-1,8,8-tricarboxylate","","- C23 H30 O8 -","- C23 H30 O8 -","- C92 H120 O32 -","4","1","PT1020","Drouin, M.; Couturier, M.; Crevisy, C.; Dory, Y. L.; Deslongchamps, P.","Two 14-Membered Macrocycles with <i>trans</i>-<i>trans</i> and <i>trans</i>-<i>cis</i> Dienes. Trimethyl (2<i>E</i>,4<i>E</i>)-<i>cis</i>- and Trimethyl (2<i>Z</i>,4<i>E</i>)-<i>trans</i>-11,15-Dioxobicyclo[12.3.0]heptadeca-2,4-diene-7,7,14-tricarboxylate","Acta Crystallographica Section C","1996","52","8","2084","2087","10.1107/S0108270195016817","","","1.54184","CuKα","","0.152","0.072","","0.1","0.077","","","","","1.32","1.32","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005294","13.183","0.006","7.833","0.002","27.8","0.01","90","","90.56","0.04","90","","2870.6","1.8","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Tetrakis(1,2-dihydro-1-methyl-azine-2-thione)copper(I)tetrafluoroborate","","- C24 H28 B Cu F4 N4 S4 -","- C24 H28 B Cu F4 N4 S4 -","- C96 H112 B4 Cu4 F16 N16 S16 -","4","1","SK1022","Giusti, G.; Geier, G.; Currao, A.; Nesper, R.","Thione Compounds of Copper and Silver: Tetrakis[1-methyl-2(1<i>H</i>)-pyridinethione-<i>S</i>]copper(I) Tetrafluoroborate and Tetrakis-[1-methyl-2(1<i>H</i>)-pyridinethione-<i>S</i>]silver(I) Tetrafluoroborate","Acta Crystallographica Section C","1996","52","8","1914","1917","10.1107/S0108270196003666","","","0.71073","MoKα","","0.0565","0.0493","","0.1541","0.1326","","","","1.049","1.049","1.049","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005295","13.35","0.003","7.755","0.003","28.028","0.008","90","","90.15","0.02","90","","2901.7","1.5","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Tetrakis(1,2-dihydro-1-methyl-azine-2-thione)silver(I)tetrafluoroborat","","- C24 H28 Ag B F4 N4 S4 -","- C24 H28 Ag B F4 N4 S4 -","- C96 H112 Ag4 B4 F16 N16 S16 -","4","1","SK1022","Giusti, G.; Geier, G.; Currao, A.; Nesper, R.","Thione Compounds of Copper and Silver: Tetrakis[1-methyl-2(1<i>H</i>)-pyridinethione-<i>S</i>]copper(I) Tetrafluoroborate and Tetrakis-[1-methyl-2(1<i>H</i>)-pyridinethione-<i>S</i>]silver(I) Tetrafluoroborate","Acta Crystallographica Section C","1996","52","8","1914","1917","10.1107/S0108270196003666","","","0.71073","MoKα","","0.0502","0.0452","","0.1282","0.1215","","","","1.075","1.075","1.075","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005296","8.704","0.001","12.636","0.001","17.819","0.002","90","","90","","90","","1959.8","0.4","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[2R,2(1S),4S]-2-(2-Oxocyclopentyl)-4-phenyl-3-(p-toluenesulfonyl)- 1,3-oxazolidine","","- C21 H23 N O4 S -","- C21 H23 N O4 S -","- C84 H92 N4 O16 S4 -","4","1","SK1036","Bolte, M.; Berger, B.","An Arylsulfonyloxazolidine","Acta Crystallographica Section C","1996","52","8","1987","1989","10.1107/S0108270196007718","","","1.5418","CuKα","","0.029","0.0286","","0.0815","0.0811","","","","1.018","1.026","1.026","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005297","11.916","0.003","6.132","0.001","17.832","0.003","90","","101.88","0.01","90","","1275.1","0.4","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 N3 O2 S -","- C13 H14 N3 O2 S2 -","- C52 H56 N12 O8 S8 -","4","1","SZ1014","Henry, R.; Copp, R. R.; Wong, C. F.","<i>N</i>-[1-(2-Benzo[<i>b</i>]thienyl)ethyl]-<i>N</i>'-carbamoylurea and 1-[1-(2-Benzo[<i>b</i>]thienyl)ethyl][1,3,5]triazine-2,4,6-trione Methanol Solvate","Acta Crystallographica Section C","1996","52","8","2032","2035","10.1107/S0108270195017215","","","1.54178","CuKα","","","0.043","","","0.042","","","","","2.91","2.91","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005298","17.124","0.002","5.7739","0.0009","15.34","0.01","90","","91.2","0.02","90","","1516.4","1","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 N3 O4 S -","- C14 H15 N3 O4 S -","- C56 H60 N12 O16 S4 -","4","1","SZ1014","Henry, R.; Copp, R. R.; Wong, C. F.","<i>N</i>-[1-(2-Benzo[<i>b</i>]thienyl)ethyl]-<i>N</i>'-carbamoylurea and 1-[1-(2-Benzo[<i>b</i>]thienyl)ethyl][1,3,5]triazine-2,4,6-trione Methanol Solvate","Acta Crystallographica Section C","1996","52","8","2032","2035","10.1107/S0108270195017215","","","1.54178","CuKα","","","0.05","","","0.064","","","","","3","3","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005299","10.144","0.004","10.962","0.003","15.683","0.003","90","","90","","90","","1743.9","0.9","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 O5 -","- C20 H26 O5 -","- C80 H104 O20 -","4","1","SZ1020","Sivaraman, J.; Subramanian, K.; Vasanth, S.","Leonotinin","Acta Crystallographica Section C","1996","52","8","2043","2045","10.1107/S0108270195010195","","","0.71073","MoKα","","","0.057","","","0.058","","","","","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005300","26.287","0.005","7.44","0.002","17.775","0.004","90","","127.64","0.02","90","","2752.8","1.3","273","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 O3 -","- C16 H20 O3 -","- C128 H160 O24 -","8","1","SZ1027","Kabaleeswaran, V.; Rajan, S. S.; Kalena, G. P.; Pradhan, P.; Banerji, A.","(1α,3α,11α)-2,2,11-Trimethyl-14-oxatetracyclo[6.5.0.1^7,11^.0^3,8^]tetradec-6-ene-5,9-dione","Acta Crystallographica Section C","1996","52","8","1981","1983","10.1107/S0108270195010201","","","1.5418","CuKα","","","0.041","","","0.051","","","","","0.75","0.75","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005301","10.563","0.002","16.902","0.002","9.297","0.002","90","","90","","90","","1659.8","0.5","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-(1',3'-dioxolan-2'-yl)-2-methyl-6-nitro -4-(2'-oxopyrrolidin-1'-yl)-2H-1-benzopyran","","- C17 H18 N2 O6 -","- C17 H18 N2 O6 -","- C68 H72 N8 O24 -","4","1","TA1029","Shin, W.; Chae, C. H.; Yoo, S. E.","Antihypertensive 2-(1,3-Dioxolan-2-yl)-2-methyl-6-nitro-4-(2-oxo-1-pyrrolidinyl)-2<i>H</i>-1-benzopyran","Acta Crystallographica Section C","1996","52","8","2058","2060","10.1107/S010827019600248X","","","1.54184","CuKα","","0.0486","0.0341","","0.1335","0.0907","","","","1.495","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005302","8.809","0.001","10.42","0.001","9.642","0.001","90","","90","","90","","885.04","0.16","291","2","291","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4,4'-Oxybispyridine","","- C10 H8 N2 O -","- C10 H8 N2 O -","- C40 H32 N8 O4 -","4","1","TA1056","Dunne, S. J.; von Nagy-Felsobuki, E. I.; Mackay, M. F.","4,4'-Oxybispyridine and 4,4'-Selenobispyridine","Acta Crystallographica Section C","1996","52","8","2040","2042","10.1107/S0108270195014843","","","1.5418","CuKα","","","0.048","","0.098","0.078","","","","0.838","0.838","0.838","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005303","8.609","0.002","5.769","0.002","10.478","0.003","72.81","0.04","70.12","0.02","80.92","0.03","466.6","0.3","291","1","291","2","","","","","","","","4","P -1","-P 1","2","","4,4'-Selenobispyridine","","- C10 H8 N2 Se -","- C10 H8 N2 Se -","- C20 H16 N4 Se2 -","2","1","TA1056","Dunne, S. J.; von Nagy-Felsobuki, E. I.; Mackay, M. F.","4,4'-Oxybispyridine and 4,4'-Selenobispyridine","Acta Crystallographica Section C","1996","52","8","2040","2042","10.1107/S0108270195014843","","","1.5418","CuKα","","0.039","0.039","","0.105","0.094","","","","1.068","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005304","6.7134","0.0008","9.8931","0.0009","17.485","0.001","90","","92.101","0.008","90","","1160.51","0.19","294","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 O2 -","- C16 H14 O2 -","- C64 H56 O8 -","4","1","TA1064","Linetsky, M.; Zaragoza, F.; Bott, S. G.; Marchand, A. P.","Two Methylated Hexacyclic Cage Diketones","Acta Crystallographica Section C","1996","52","8","2061","2063","10.1107/S0108270196001667","","","0.71073","MoKα","","","0.0384","","","0.0416","","","","","1.36","1.36","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005305","7.175","0.001","12.0275","0.0008","7.275","0.001","90","","95.51","0.009","90","","624.91","0.13","294","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C17 H16 O2 -","- C17 H16 O2 -","- C34 H32 O4 -","2","0.5","TA1064","Linetsky, M.; Zaragoza, F.; Bott, S. G.; Marchand, A. P.","Two Methylated Hexacyclic Cage Diketones","Acta Crystallographica Section C","1996","52","8","2061","2063","10.1107/S0108270196001667","","","0.71073","MoKα","","","0.0676","","","0.0805","","","","","2.1","2.1","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005306","9.932","0.001","35.972","0.006","30.363","0.004","90","","90","","90","","10848","3","293","1","293","1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C31 H25 N O Se Sn -","- C31 H25 N O Se Sn -","- C496 H400 N16 O16 Se16 Sn16 -","16","2","TA1069","Fong, M. C.; Gable, R. W.; Schiesser, C. H.","<i>N</i>-Phenyl-2-(triphenylstannylseleno)benzamide and 2-Methylseleno-<i>N</i>-phenylbenzamide","Acta Crystallographica Section C","1996","52","8","1886","1889","10.1107/S0108270196000790","","","0.71073","MoKα","","0.0779","0.039","","0.0786","0.0625","","","","1.022","1.141","1.141","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005307","9.777","0.002","16.692","0.002","15.82","0.001","90","","90","","90","","2581.8","0.6","293","1","293","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-methylseleno-N-phenylbenzamide","","- C14 H13 N O Se -","- C14 H13 N O Se -","- C112 H104 N8 O8 Se8 -","8","1","TA1069","Fong, M. C.; Gable, R. W.; Schiesser, C. H.","<i>N</i>-Phenyl-2-(triphenylstannylseleno)benzamide and 2-Methylseleno-<i>N</i>-phenylbenzamide","Acta Crystallographica Section C","1996","52","8","1886","1889","10.1107/S0108270196000790","","","1.5418","CuKα(nickelfiltered)","","0.0392","0.029","","0.0795","0.0731","","","","1.049","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005308","8.754","0.002","8.91","0.001","12.992","0.002","90","","90","","90","","1013.4","0.3","158","2","158","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,2,6,6-Tetramethylpiperidinium chloride","","- C9 H20 Cl N -","- C9 H20 Cl N -","- C36 H80 Cl4 N4 -","4","1","TA1077","Kaplan, R. W.; Turnbull, M. M.","2,2,6,6-Tetramethylpiperidinium Chloride","Acta Crystallographica Section C","1996","52","8","2049","2051","10.1107/S0108270196001679","","","0.71073","MoKα","","0.0551","0.0405","","0.0845","0.0804","","","","0.819","0.889","0.889","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005309","11.663","0.002","10.187","0.002","27.703","0.005","90","","102.3","0.1","90","","3215.9","1.6","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(3α,3aβ,5α,6α)-(+/-)-3,5-Bis-(methoxycarbonyl)-3a-methyl-6-phenyl tetrahydro-2H-pyran-2-one","","- C16 H18 O6 -","- C16 H18 O6 -","- C128 H144 O48 -","8","2","TA1078","Fallon, G. D.; Lawrence, R. M.; Perlmutter, P.","(±)-3α,5α-Bis(methoxycarbonyl)-3β-methyl-6α-phenyltetrahydro-2<i>H</i>-pyran-2-one","Acta Crystallographica Section C","1996","52","8","2067","2069","10.1107/S0108270196002089","","","1.5418","CuKα","","","0.0677","","","0.0628","","","","","1.584","1.584","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005310","8.971","0.001","15.511","0.002","8.329","0.001","102.85","0.01","111.46","0.01","73.67","0.01","1025.8","0.2","293","","296","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H46 N4 O12 V4 -","- C36 H46 N4 O12 V4 -","- C36 H46 N4 O12 V4 -","1","0.5","TA1088","Kumagai, H.; Endo, M.; Kawata, S.; Kitagawa, S.","A Mixed-Valence Tetranuclear Vanadium(IV, V) Complex, [V~4~O~4~(μ-OEt)~2~(μ-O)~2~(OEt)~4~(phen)~2~]","Acta Crystallographica Section C","1996","52","8","1943","1945","10.1107/S0108270196005781","","","0.7107","MoKα","","","0.06","","","0.054","","","","","3.53","3.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005311","7.471","0.004","21.635","0.004","10.346","0.003","90","","104.32","0.03","90","","1620.3","1.1","193","","193","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 O6 Sn -","- C16 H16 O6 Sn -","- C64 H64 O24 Sn4 -","4","1","TA1090","Basu Baul, T. S.; Tiekink, E. R. T.","Bis(2-hydroxybenzoato-<i>O</i>,<i>O</i>')dimethyltin","Acta Crystallographica Section C","1996","52","8","1959","1961","10.1107/S0108270196005057","","","0.7107","MoKα","","0.064","0.064","","0.085","0.085","","","","1.267","1.267","1.267","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005312","20.992","0.002","6.948","0.001","10.083","0.001","90","","102.15","0.01","90","","1437.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C8 H16 N8 O5 S -","- C8 H16 N8 O5 S -","- C32 H64 N32 O20 S4 -","4","1","VJ1008","Gomes, A. C.; Biswas, G.; Pain (Biswas), S.; Ghosh, S.; Ghosh, D.; Iitaka, Y.; Banerjee, A.","Bis(2,4-diaminopyrimidinium) Sulfate Monohydrate, 2C~4~H~7~N~4~^+^.SO~4~^2{-^}.H~2~O","Acta Crystallographica Section C","1996","52","8","2020","2022","10.1107/S0108270195009656","","","1.5418","CuKα","","0.0568","0.0549","","0.1631","0.1514","","","","1.087","1.096","1.096","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005313","9.5704","0.0009","13.364","0.002","8.748","0.002","90","","108.83","0.01","90","","1059","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Ferron","7-Iodo-8-hydroxyquinoline-5-sulfonic Acid","","- C9 H6 I N O4 S -","- C9 H6 I N O4 S -","- C36 H24 I4 N4 O16 S4 -","4","1","VJ1024","Balasubramanian, T.; Muthiah, P. T.","Hydrogen-Bonding Patterns in Substituted Oxines. Redetermination of 8-Hydroxy-7-iodoquinoline-5-sulfonic Acid","Acta Crystallographica Section C","1996","52","8","2072","2073","10.1107/S0108270195010286","","","0.71073","MoKα","","0.0398","0.0298","","0.0743","0.0689","","","","1.077","1.097","1.097","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005314","5.84","0.003","8.063","0.006","12.923","0.007","90","","101.74","0.06","90","","595.8","0.6","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Methyl 6-O-[(R)-1-Carboxyethyl]-α-D-galactopyranoside","","- C10 H18 O8 -","- C10 H18 O8 -","- C20 H36 O16 -","2","1","AB1291","Eriksson, L.; Pilotti, Å.; Stenutz, R.; Widmalm, G.","Methyl 6-<i>O</i>-[(<i>R</i>)-1-Carboxyethyl]-α-<small>D</small>-galactopyranoside","Acta Crystallographica Section C","1996","52","9","2285","2287","10.1107/S0108270196003411","","","1.54184","CuKα","","0.0817","0.0562","","0.16","0.1411","","","","1.072","1.111","1.111","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005315","5.6286","0.0007","10.257","0.001","12.0111","0.0005","100.924","0.007","100.118","0.006","101.45","0.01","650.72","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H12 N2 O5 -","- C13 H11.55 N2 O5 -","- C26 H23.1 N4 O10 -","2","1","AB1339","Vencato, I.; Gallardo, H.; Meyer, E.","4-(5-Methyl-1,3,4-oxadiazol-2-yl)-1,3-phenylene Diacetate","Acta Crystallographica Section C","1996","52","9","2301","2303","10.1107/S0108270196004039","","","0.71073","MoKα","","0.0548","0.0417","","0.1421","0.123","","","","1.083","1.047","1.047","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005316","10.898","0.0013","7.6993","0.0006","20.713","0.002","90","","103.971","0.008","90","","1686.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","meta-diphenylcarborane","1,7-diphenyl-1,7-dicarbadodecaborane","","- C14 H20 B10 -","- C14 H20 B10 -","- C56 H80 B40 -","4","1","AB1346","Rosair, G. M.; Welch, A. J.; Weller, A. S.","Redetermination of 1,7-Diphenyl-1,7-dicarba-<i>closo</i>-dodecaborane(12)","Acta Crystallographica Section C","1996","52","9","2221","2222","10.1107/S0108270196002107","","","0.71073","MoKα","","0.0945","0.0601","","0.2465","0.1477","","","","1.02","1.068","1.068","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005317","9.673","0.001","20.021","0.002","10.571","0.002","90","","90.89","0.01","90","","2047","0.5","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H29 B10 P -","- C14 H29 B10 P -","- C56 H116 B40 P4 -","4","1","AB1350","Sillanpää, R.; Kivekäs, R.; Teixidor, F.; Viñas, C.; Nuñez, R.","1-Diisopropylphosphino-2-phenyl-1,2-dicarba-<i>closo</i>-dodecaborane(12)","Acta Crystallographica Section C","1996","52","9","2223","2225","10.1107/S0108270196004349","","","0.71073","MoKα","","","0.057","","","0.058","","","","","1.626","1.626","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005318","8.999","0.001","18.174","0.002","7.857","0.001","90","","109.86","0.01","90","","1208.6","0.3","290","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H44 Cl2 Cu N4 O2 -","- C20 H44 Cl2 Cu N4 O2 -","- C40 H88 Cl4 Cu2 N8 O4 -","2","0.5","AS1220","Choi, K.-Y.; Kim, J. C.; Jensen, W. P.; Suh, I.-H.; Choi, S.-S.","Copper(II) and Nickel(II) Complexes with 3,14-Dimethyl-2,6,13,17-tetraazatricyclo[16.4.0.0^7,12^]docosane, [<i>M</i>(C~20~H~40~N~4~)]Cl~2~.2H~2~O (<i>M</i> = Cu^II^ and Ni^II^)","Acta Crystallographica Section C","1996","52","9","2166","2168","10.1107/S0108270196002600","","","0.71073","MoKα","","","0.026","","","0.021","","","","","2.67","2.67","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2005319","9.376","0.001","16.042","0.001","8.177","0.002","90","","102.51","0.01","90","","1200.7","0.3","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H44 Cl2 N4 Ni O2 -","- C20 H44 Cl2 N4 Ni O2 -","- C40 H88 Cl4 N8 Ni2 O4 -","2","0.5","AS1220","Choi, K.-Y.; Kim, J. C.; Jensen, W. P.; Suh, I.-H.; Choi, S.-S.","Copper(II) and Nickel(II) Complexes with 3,14-Dimethyl-2,6,13,17-tetraazatricyclo[16.4.0.0^7,12^]docosane, [<i>M</i>(C~20~H~40~N~4~)]Cl~2~.2H~2~O (<i>M</i> = Cu^II^ and Ni^II^)","Acta Crystallographica Section C","1996","52","9","2166","2168","10.1107/S0108270196002600","","","0.71073","MoKα","","","0.039","","","0.024","","","","","1.45","1.45","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2005320","9.748","0.002","19.08","0.003","9.955","0.002","90","","109.14","0.01","90","","1749.2","0.6","291","","291","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H10 F8 -","- C20 H10 F8 -","- C80 H40 F32 -","4","1","BK1151","Swenson, D. C.; Morken, P. A.; Burton, D. J.","C~20~H~10~F~8~, a Divinyl Acetylene","Acta Crystallographica Section C","1996","52","9","2349","2351","10.1107/S0108270196004441","","","1.54184","CuKα","","0.078","0.05","","","0.076","","","","","1.46","1.46","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2005321","41.121","0.002","7.039","0.002","7.085","0.002","90","","94.9","0.01","90","","2043.3","0.8","296","","296","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Biphenyl-3-carboxylic acid","","","- C13 H10 O2 -","- C13 H10 O2 -","- C104 H80 O16 -","8","1","BK1218","Blackburn, A. C.; Dobson, A. J.; Gerkin, R. E.","Biphenyl-3-carboxylic Acid at 296 and 203K","Acta Crystallographica Section C","1996","52","9","2320","2323","10.1107/S0108270196003514","","","0.71073","MoKα","","","0.044","","","0.056","","","","","1.98","1.98","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005322","41.065","0.003","6.965","0.003","7.051","0.003","90","","94.83","0.02","90","","2009.5","1.2","203","","203","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Biphenyl-3-carboxylic acid","","","- C13 H10 O2 -","- C13 H10 O2 -","- C104 H80 O16 -","8","1","BK1218","Blackburn, A. C.; Dobson, A. J.; Gerkin, R. E.","Biphenyl-3-carboxylic Acid at 296 and 203K","Acta Crystallographica Section C","1996","52","9","2320","2323","10.1107/S0108270196003514","","","0.71073","MoKα","","","0.039","","","0.049","","","","","1.79","1.79","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005323","18.244","0.006","5.403","0.002","24.48","0.008","90","","106.94","0.05","90","","2308.3","1.5","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,4,6-tri-O-benzyl-myo-inositol","","- C27 H30 O6 -","- C27 H28 O6 -","- C108 H112 O24 -","4","1","BK1230","Graingeot, V.; Brigando, C.; Benlian, D.","2,4,6-Tri-<i>O</i>-benzyl-<i>myo</i>-inositol","Acta Crystallographica Section C","1996","52","9","2283","2285","10.1107/S0108270196004684","","","0.71073","MoKα","","","0.048","","","0.06","","","","","2.1","2.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005324","18.13","0.006","12.194","0.004","8.461","0.003","90","","108.82","0.03","90","","1770.5","1.1","160","2","160","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","3,5-(o-tolyl)-1,2-dithia-4-azolylium hexafluoroarsenate(V)","","- C16 H14 As F6 N S2 -","- C16 H14 As F6 N S2 -","- C64 H56 As4 F24 N4 S8 -","4","0.5","BK1238","Clegg, W.; Elsegood, M. R. J.; Banister, A. J.; Hibbert, T. G.","The AsF~6~^{-^} Salt of a 1,2-Dithia-4-azolylium Cation with Sterically Demanding Substituents","Acta Crystallographica Section C","1996","52","9","2148","2150","10.1107/S010827019600563X","","","0.71073","MoKα","","0.0417","0.0362","","0.0971","0.094","","","","1.091","1.117","1.117","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005325","8.785","0.004","15.306","0.007","14.573","0.003","90","","97","0.03","90","","1944.9","1.3","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H13 Cl2 N3 O3 -","- C22 H12 Cl2 N3 O4 -","- C88 H48 Cl8 N12 O16 -","4","1","BM1017","Qi, F.; Yu, W.-T.; Hong, L.; Lin, X.-Y.; Yu, Z.-P.","The Charge-Transfer Complex 4-(2-Hydroxyethyl)carbazole‒2,3-Dichloro-5,6-dicyano-1,4-benzoquinone (1/1) (HEK‒DDQ)","Acta Crystallographica Section C","1996","52","9","2274","2277","10.1107/S0108270196002375","","","0.71073","MoKα","","","0.0614","","","0.064","","","","","1.588","1.588","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005326","9.543","0.004","10.279","0.001","12.231","0.005","90","","90","","90","","1199.8","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-amino-1-(2-deoxy-β-D-ribofuranosyl)-5,6,7-1H- cyclopentapyridine-2-one","","- C12 H17 N3 O4 -","- C12 H17 N3 O4 -","- C48 H68 N12 O16 -","4","1","BM1048","Neidle, S.; Capaldi, D. C.; Reese, C. B.; Roselt, P. D.","4-Amino-1-(2-deoxy-β-<small>D</small>-ribofuranosyl)-6,7-dihydro-1<i>H</i>,5<i>H</i>-cyclopentapyrimidine-2-one","Acta Crystallographica Section C","1996","52","9","2332","2334","10.1107/S0108270196002582","","","0.71073","MoKα","","0.059","0.0493","","0.1124","0.1103","","","","0.969","1.059","1.059","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005327","14.293","0.001","5.98","0.001","21.66","0.002","90","","106.58","0.04","90","","1774.4","0.5","295","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H22 N2 Ni O S -","- C25 H9 N2 Ni O S -","- C100 H36 N8 Ni4 O4 S4 -","4","1","BM1052","Tahir, M. N.; Ülkü, D.; Atakol, O.; Kenar, A.","(Cyclohexylamine-<i>N</i>){2-[(2-thiophenyl)iminomethyl]phenolato-<i>O</i>,<i>N</i>,<i>S</i>}nickel(II)","Acta Crystallographica Section C","1996","52","9","2178","2180","10.1107/S0108270196006130","","","0.71073","MoKα","","","0.052","","","0.058","","","","","1.04","1.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005328","6.93","0.004","9.597","0.006","10.169","0.007","80.1","0.03","89.94","0.06","73.22","0.02","637","0.7","296","","","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H17 N O3 -","- C12 H17 N O3 -","- C24 H34 N2 O6 -","2","1","BM1059","Hussain, M. S.; Ul-Haque, M.","<i>O</i>-Acetyl-<i>N</i>-(<i>o</i>-hydroxybenzyl)-<i>N</i>-isopropylhydroxylamine","Acta Crystallographica Section C","1996","52","9","2343","2345","10.1107/S0108270196003332","","","0.71073","MoKα","","","0.038","","","0.045","","","","","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005329","19.685","0.001","11.023","0.002","8.881","0.003","90","0.2","98.4","0.3","90","0.3","1906.4","1.6","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H18 Cl N3 O -","- C23 H18 Cl N3 O -","- C92 H72 Cl4 N12 O4 -","4","1","BM1067","Baouid, A.; Hasnaoui, A.; Benharref, A.; Giorgi, M.; Pierrot, M.","1-(4-Chlorophenyl)-3a-methyl-5-phenyl-3a,4-dihydro-1,2,4-oxadiazolo[4,5-<i>a</i>][1,5]benzodiazepine","Acta Crystallographica Section C","1996","52","9","2281","2282","10.1107/S0108270196004003","","","0.71073","Mo-Kα","","0.09","0.045","","","0.056","","","","","1.941","1.941","","","","","has coordinates,has Fobs","208377","2020-10-21","18:00:00",""
"2005330","7.326","0.001","12.868","0.001","14.098","0.001","90","","94.49","0.01","90","","1325","0.2","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(2-aminoethyl)piperaziniumtetrachloroindium(III)","","- C6 H16 Cl4 In N3 -","- C6 H16 Cl4 In N3 -","- C24 H64 Cl16 In4 N12 -","4","1","BM1077","Chippindale, A. M.; Brech, S. J.; Cowley, A. R.; Chernega, A. N.","[<i>N</i>-(2-Amino-κ<i>N</i>-ethyl)piperaziniumyl-<i>N</i>^1^]tetrachloroindium(III)","Acta Crystallographica Section C","1996","52","9","2180","2183","10.1107/S0108270196006002","","","0.71073","MoKα","","","0.0211","","","0.0206","","","","","1.1659","1.1659","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005331","11.609","0.008","5.717","0.003","15.293","0.008","90","","92.63","0.05","90","","1013.9","1","240","2","240","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[3-(4-Methylphenyl)-5-isoxazolyl]acetonitrile","","- C12 H10 N2 O -","- C12 H10 N2 O -","- C48 H40 N8 O4 -","4","1","BM1078","Kumar, N.; Mukherjee, S.; Parmar, V. S.; Errington, W.","[3-(4-Methylphenyl)-5-isoxazolyl]acetonitrile","Acta Crystallographica Section C","1996","52","9","2294","2296","10.1107/S010827019600491X","","","0.71073","MoKα","","0.0588","0.0501","","0.1532","0.1398","","","","1.041","1.058","1.058","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005332","9.686","0.003","17.512","0.004","15.47","0.005","90","","96.35","0.02","90","","2607.9","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H30 Mo N4 S7 -","- C15 H30 Mo N4 S7 -","- C60 H120 Mo4 N16 S28 -","4","1","BM1082","Coffey, T. A.; Forster, G. D.; Hogarth, G.","Tris(<i>N</i>,<i>N</i>-diethyldithiocarbamato-<i>S</i>,<i>S</i>')(thionitrosyl-<i>N</i>)molybdenum(III), [Mo(η^2^-S~2~CNEt~2~)~3~(NS)]","Acta Crystallographica Section C","1996","52","9","2157","2159","10.1107/S010827019600707X","","","0.71073","MoKα","","0.0623","0.041","","0.1033","0.0858","","","","0.979","1.006","1.006","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005333","5.364","0.008","12.148","0.009","7.922","0.004","90","","108.87","0.06","90","","488.5","0.9","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Trilanthanum Trichloride Pyrosilicate","","- Cl3 La3 O7 Si2 -","- Cl3 La3 O7 Si2 -","- Cl6 La6 O14 Si4 -","2","1","BR1087","Chen, J.-T.; Guo, G.-C.; Huang, J.-S.; Zhang, Q.-E.","La~3~(Si~2~O~7~)Cl~3~","Acta Crystallographica Section C","1996","52","9","2123","2125","10.1107/S010827019501506X","","","0.71073","MoKα","","","0.0605","","","0.0918","","","","","1.5","1.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005334","13.377","0.004","5.589","0.004","10.983","0.003","90","","100.61","0.02","90","","807.1","0.7","293","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Tetra Neodymium bis-Pyrosilicate Penta Vanadium Octa Oxygen","","- Nd4 O22 Si4 V5 -","- Nd4 O22 Si4 V5 -","- Nd8 O44 Si8 V10 -","2","0.25","BR1112","Chen, J.-T.; Guo, G.-C.; Zhuang, H.-H.; Huang, J.-S.; Zhang, Q.-E.","Nd~4~V~5~Si~4~O~22~","Acta Crystallographica Section C","1996","52","9","2125","2127","10.1107/S0108270195015058","","","0.71073","MoKα","","","0.0463","","","0.0585","","","","","1.17","1.17","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005335","13.4121","0.0001","13.6816","0.0001","13.8558","0.0001","90","","90","","90","","2542.53","0.03","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Cd O12 Rb2 Si5 -","- Cd O12 Rb2 Si5 -","- Cd8 O96 Rb16 Si40 -","8","1","BR1125","Bell, A. M. T.; Henderson, C. M. B.","Rietveld Refinement of the Orthorhombic <i>Pbca</i> Structures of Rb~2~CdSi~5~O~12~, Cs~2~MnSi~5~O~12~, Cs~2~CoSi~5~O~12~ , and Cs~2~NiSi~5~O~12~ Leucites by Synchrotron X-ray Powder Diffraction","Acta Crystallographica Section C","1996","52","9","2132","2139","10.1107/S0108270196003162","","","1.40285","synchrotron","","","0.073","","","0.165","","","","","0.903","0.903","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005336","13.6878","0.0003","13.7931","0.0003","13.7575","0.0003","90","","90","","90","","2597.38","0.1","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Cs2 Mn O12 Si5 -","- Cs2 Mn O12 Si5 -","- Cs16 Mn8 O96 Si40 -","8","1","BR1125","Bell, A. M. T.; Henderson, C. M. B.","Rietveld Refinement of the Orthorhombic <i>Pbca</i> Structures of Rb~2~CdSi~5~O~12~, Cs~2~MnSi~5~O~12~, Cs~2~CoSi~5~O~12~ , and Cs~2~NiSi~5~O~12~ Leucites by Synchrotron X-ray Powder Diffraction","Acta Crystallographica Section C","1996","52","9","2132","2139","10.1107/S0108270196003162","","","1.29969","synchrotron","","","0.126","","","0.14","","","","","1.019","1.019","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005337","13.6487","0.0004","13.712","0.0004","13.6828","0.0004","90","","90","","90","","2560.75","0.13","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Co Cs2 O12 Si5 -","- Co Cs2 O12 Si5 -","- Co8 Cs16 O96 Si40 -","8","1","BR1125","Bell, A. M. T.; Henderson, C. M. B.","Rietveld Refinement of the Orthorhombic <i>Pbca</i> Structures of Rb~2~CdSi~5~O~12~, Cs~2~MnSi~5~O~12~, Cs~2~CoSi~5~O~12~ , and Cs~2~NiSi~5~O~12~ Leucites by Synchrotron X-ray Powder Diffraction","Acta Crystallographica Section C","1996","52","9","2132","2139","10.1107/S0108270196003162","","","1.30138","synchrotron","","","0.059","","","0.128","","","","","0.821","0.821","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005338","13.6147","0.0003","13.6568","0.0005","13.6583","0.0005","90","","90","","90","","2539.53","0.14","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Cs2 Ni O12 Si5 -","- Cs2 Ni O12 Si5 -","- Cs16 Ni8 O96 Si40 -","8","1","BR1125","Bell, A. M. T.; Henderson, C. M. B.","Rietveld Refinement of the Orthorhombic <i>Pbca</i> Structures of Rb~2~CdSi~5~O~12~, Cs~2~MnSi~5~O~12~, Cs~2~CoSi~5~O~12~ , and Cs~2~NiSi~5~O~12~ Leucites by Synchrotron X-ray Powder Diffraction","Acta Crystallographica Section C","1996","52","9","2132","2139","10.1107/S0108270196003162","","","0.9982","synchrotron","","","0.057","","","0.091","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005339","23.608","0.008","6.825","0.009","5.4908","0.0013","90","","90","","90","","884.7","1.2","293","2","293","2","","","","","","","","5","P n n m","-P 2 2n","58","","Caesium Chloride - di caesium - bis(tellurium di vanadium heptaoxide)","","- Cl Cs3 O14 Te2 V4 -","- Cl Cs3 O14 Te2 V4 -","- Cl2 Cs6 O28 Te4 V8 -","2","0.25","BR1139","Marrot, J.; Savariault, J.-M.","Tricaesium Ditellurium Tetravanadium Chloride Tetradecaoxide","Acta Crystallographica Section C","1996","52","9","2129","2132","10.1107/S0108270196003198","","","0.71069","MoKα","","0.0422","0.0407","","0.1011","0.1001","","","","1.196","1.199","1.199","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005340","5.33","0.02","9.6","0.05","7.18","0.05","90","","105.16","0.01","90","","355","3","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Deuterated copper flurosilicate tetrahydrate","","- Cu D8 F6 O4 Si -","- Cu D8 F6 O4 Si -","- Cu2 D16 F12 O8 Si2 -","2","0.5","BR1141","Chevrier, G.; Goukassov, A.","The Hydrogen-Bonding System in Deuterated Copper Fluorosilicate Tetrahydrate: a Neutron Diffraction Study","Acta Crystallographica Section C","1996","52","9","2121","2123","10.1107/S0108270196003927","","neutron","1.52","neutron","","","0.0647","","","0.0465","","","","","5.713","5.713","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005341","10.128","0.002","3.5707","0.0006","9.868","0.002","90","","90","","90","","356.87","0.12","293","2","293","2","","","","","","","","2","P n m a","-P 2ac 2n","62","hafniumphoshide","Trihafniumdiphosphide","","- Hf3 P2 -","- Hf3 P2 -","- Hf12 P8 -","4","0.5","BR1144","Kleinke, H.; Franzen, H. F.","The Binary Hafnium Phosphide Hf~3~P~2~","Acta Crystallographica Section C","1996","52","9","2127","2129","10.1107/S0108270196004969","","","0.71069","MoKα","","0.0428","0.0293","","0.0574","0.0548","","","","1.085","1.16","1.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005342","5.7712","0.0003","10.513","0.001","21.633","0.002","94.09","0.01","90.114","0.006","105.871","0.006","1258.97","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis[S-Methyl-β-N-(4-dimethylaminophenyl)methylenedithiocarbazido]- nickel(II).","","- C22 H28 N6 Ni S4 -","- C22 H28 N6 Ni S4 -","- C44 H56 N12 Ni2 S8 -","2","1","CF1065","Tian, Y.-P.; Duan, C.-Y.; Lu, Z.-L.; You, X.-Z.; Fun, H.-K.; Sivakumar, K.","Bis[methyl <i>N</i>^{β^}-(4-dimethylaminophenylmethylene)dithiocarbazato]nickel(II)","Acta Crystallographica Section C","1996","52","9","2150","2153","10.1107/S010827019600385X","","","0.71073","MoKα","","0.0546","0.0388","","0.1002","0.0944","","","","0.938","1.032","1.032","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005343","21.2695","0.001","10.376","0.002","12.054","0.002","90","","117.297","0.01","90","","2364","0.6","180","","180","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis(1-(2-pyridyl)-2-(2-thienyl)ethyne-N)-bis(nitrato-O,O')-cobalt(II)","","- C22 H14 Co N4 O6 S2 -","- C22 H14 Co N4 O6 S2 -","- C88 H56 Co4 N16 O24 S8 -","4","0.5","CF1076","Kooijman, H.; Spek, A. L.; Neenan, T. X.; Driessen, W. L.","Bis(nitrato-<i>O</i>,<i>O</i>')bis{2-[2-(2-thienyl)ethynyl]pyridine-<i>N</i>}cobalt(II)","Acta Crystallographica Section C","1996","52","9","2191","2193","10.1107/S0108270196005008","","","0.71073","MoKα","","","0.0697","","0.1725","0.1725","","","","0.977","0.97","0.97","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005344","5.618","0.004","7.995","0.004","13.428","0.006","77.85","0.04","85.55","0.06","80.46","0.04","580.9","0.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","rel-(1S, 4R, 7R, 9S)-tetracyclo[5.4.1.0^4,12^.0^9,12^]dodec-10- enylacetic acid","","- C14 H18 O2 -","- C14 H18 O2 -","- C28 H36 O4 -","2","1","CF1078","Wang, J.; Thommen, M.; Keese, R.","A Substituted <i>cis</i>,<i>trans</i>,<i>cis</i>,<i>cis</i>-[4.5.5.5]Fenestrene","Acta Crystallographica Section C","1996","52","9","2311","2313","10.1107/S0108270196003861","","","0.71073","MoKα","","0.0639","0.0419","","0.1181","0.1029","","","","1.029","1.092","1.092","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005345","13.44","0.009","7.205","0.009","22.388","0.009","90","","92.36","0.01","90","","2166","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(η^5-trimethylsilylcyclopentadienyl)-diiodo-titanium(IV)","","- C16 H26 I2 Si2 Ti -","- C16 H26 I2 Si2 Ti -","- C64 H104 I8 Si8 Ti4 -","4","0.5","CF1088","Drew, M. G. B.; Delgado, E.; Hernandez, E.; Baker, P. K.; Mansilla, N.","Diiodobis(η^5^-trimethylsilylcyclopentadienyl)titanium(IV)","Acta Crystallographica Section C","1996","52","9","2168","2170","10.1107/S0108270196006221","","","0.7107","MoKα","","0.1449","0.0653","","0.2789","0.1948","","","","0.609","0.563","0.563","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005346","13.272","0.002","9.2251","0.001","17.2566","0.001","90","0.06","90.39","0.01","90","0.06","2112.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2,10-dichloro-6-(2,4 dimethyl phenoxy)-dibenzo [d,g][1,3,6,2] dioxathiaphosphocin-6-oxide.","","- C20 H15 Cl2 O3 P S2 -","- C20 H15 Cl2 O3 P S2 -","- C80 H60 Cl8 O12 P4 S8 -","4","1","DE1030","Krishnaiah, M.; Kumar, N. J.; Narasaiah, T. V.; Reddy, B. S.; Reddy, C. D.","2,10-Dichloro-6-(2,4-dimethylphenoxy)dibenzo[<i>d</i>,<i>g</i>][1,3,6,2]dioxathiaphosphocine 6-Sulfide","Acta Crystallographica Section C","1996","52","9","2298","2301","10.1107/S0108270196004908","","","0.71069","MoKα","","0.0387","0.0359","","0.085","0.083","","","","1.095","1.097","1.097","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005347","8.407","0.002","9.181","0.002","10.95","0.003","69.03","0.01","68.57","0.02","77.71","0.01","731.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N,N,N',N'-Tetramethylethylenediammonium Dihydrogendiphosphate Dihydrate","","- C6 H24 N2 O9 P2 -","- C6 H24 N2 O9 P2 -","- C12 H48 N4 O18 P4 -","2","1","DU1151","Gharbi, A.; Charfi, M.; Jouini, A.","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylethylenediammonium Dihydrogendiphosphate Dihydrate","Acta Crystallographica Section C","1996","52","9","2246","2248","10.1107/S0108270196003356","","","0.71069","MoKα","","0.033","0.0277","","0.0786","0.0754","","","","1.051","1.074","1.074","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005348","8.243","0.002","9.079","0.001","12.039","0.001","92.93","0.01","93.31","0.01","104.466","0.008","869","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tris(1,4-butanediyldiammonium) bis(cyclotriphosphate) tetrahydrate ?","","- C12 H50 N6 O22 P6 -","- C12 H50 N6 O22 P6 -","- C12 H50 N6 O22 P6 -","1","0.5","DU1152","Thabet, H.; Jouini, A.","Tris(1,4-butanediyldiammonium) Bis(cyclotriphosphate) Tetrahydrate","Acta Crystallographica Section C","1996","52","9","2248","2250","10.1107/S0108270196002922","","","0.71069","MoKα","","0.0297","0.0263","","0.0766","0.0745","","","","1.076","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005349","11.085","0.003","11.678","0.004","8.995","0.004","112.98","0.03","87.85","0.03","104.9","0.02","1033.4","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1,6-Diammoniumhexane cyclohexaphosphate hexahydrate","","- C18 H66 N6 O24 P6 -","- C18 H66 N6 O24 P6 -","- C18 H66 N6 O24 P6 -","1","0.5","DU1153","Charfi, M.; Jouini, A.","1,6-Hexanediammonium <i>cyclo</i>-Hexaphosphate Hexahydrate","Acta Crystallographica Section C","1996","52","9","2250","2253","10.1107/S0108270196003344","","","0.71069","MoKα","","0.0432","0.0282","","0.0954","0.0709","","","","0.955","0.778","0.778","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005350","29.282","0.006","12.478","0.002","14.476","0.003","90","","107.43","0.03","90","","5046.4","1.9","198","2","198","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[{di-μ-nitrato-1:2κ^4^O-bis[(triphenylphosphine-P)copper(I)]}- μ-4,4'-bipyridyl-μ] Tetrahydrofuran Solvate","","- C27 H27 Cu N2 O4 P -","- C27 H27 Cu N2 O4 P -","- C216 H216 Cu8 N16 O32 P8 -","8","1","FG1111","Prest, P.-J.; Moore, J. S.","<i>catena</i>-Poly[{di-μ-nitrato-1:2κ^4^<i>O</i>-bis[(triphenylphosphine-<i>P</i>)copper(I)]}-μ-4,4'-bipyridyl-<i>N</i>:<i>N</i>'] Tetrahydrofuran Solvate","Acta Crystallographica Section C","1996","52","9","2176","2178","10.1107/S0108270196006087","","","0.71073","MoKα","","0.0662","0.0379","","0.1042","0.0907","","","","1.069","1.073","1.073","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005351","13.314","0.008","9.983","0.005","13.45","0.007","90","","117.63","0.02","90","","1583.8","1.5","158","2","158","2","","","","","","","","8","P 1 21 1","P 2yb","4","","2[1-(R)-(N,N-dimethylamino)-ethyl],2'[1-(R)(N,N-dimethylammonium)-ethyl] -1,1'(S,S)biferrocene trichloro(dimethylsulfoxide)platinate(II). ?","","- C30 H43 Cl3 Fe2 N2 O Pt S -","- C30 H43 Cl3 Fe2 N2 O Pt S -","- C60 H86 Cl6 Fe4 N4 O2 Pt2 S2 -","2","1","FG1112","Robinson, B. H.; Simpson, J.; Wilson, D. J.","1-(<i>R</i>)-{2-[1-(<i>R</i>)-(<i>N</i>,<i>N</i>-Dimethylamino)ethyl]-1,1'-(<i>S</i>,<i>S</i>)-biferrocen-2'-yl}ethyl-<i>N</i>,<i>N</i>-dimethylammonium Trichloro(dimethyl sulfoxide-<i>S</i>)platinate(II)","Acta Crystallographica Section C","1996","52","9","2196","2198","10.1107/S0108270196004118","","","0.71073","MoKα","","0.0621","0.0489","","0.1097","0.106","","","","0.941","1.024","1.024","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2005352","9.9019","0.0014","12.2972","0.0015","8.9716","0.0012","108.28","0.02","110.66","0.02","86.16","0.02","969.4","0.3","293","2","293","2","","","","","","","","6","P 1","P 1","1","","[1,1,1,5,5,5-hexafluoro-2,4-bis(trifluoromethyl)3-oxa- 2,4-diolatopentane][N,N,N,N-tetramethylethylenediamine]copper(II)","","- C12 H16 Cu F12 N2 O3 -","- C12 H16 Cu F12 N2 O3 -","- C24 H32 Cu2 F24 N4 O6 -","2","2","FG1118","Hynes, R. C.; Willis, C. J.; Payne, N. C.","A Condensed Dialkoxide Complex of Copper(II), [(CH~3~)~2~NCH~2~CH~2~N(CH~3~)~2~]Cu[{OC(CF~3~)~2~}~2~O]","Acta Crystallographica Section C","1996","52","9","2173","2176","10.1107/S0108270196005811","","","0.71073","MoKα","","0.0552","0.0401","","0.1022","0.0936","","","","1.035","1.03","1.03","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005353","7.275","0.001","9.002","0.002","19.503","0.004","90","","100.61","0.01","90","","1255.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ALENDRONATE","Monosodium 4-amino-1-hydroxy-1,1'-bisphosphonate, trihydrate (Alendronate)","","- C4 H18 N Na O10 P2 -","- C4 H18 N Na O10 P2 -","- C16 H72 N4 Na4 O40 P8 -","4","1","FG1158","Vega, D.; Baggio, R.; Garland, M. T.","Monosodium 4-Amino-1-hydroxy-1,1-butanediyldiphosphonate Trihydrate (Alendronate)","Acta Crystallographica Section C","1996","52","9","2198","2201","10.1107/S0108270196006105","","","0.71073","MoKα","","0.0316","0.0284","","0.0828","0.0744","","","","1.114","1.134","1.134","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005354","20.154","0.005","3.843","0.001","11.787","0.003","90","","90","","90","","912.9","0.4","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","2-Carboxy-4,5-benzotropone","2-Carboxy-4,5-benzocycloheptatrienone","","- C12 H8 O3 -","- C12 H8 O3 -","- C48 H32 O12 -","4","1","FG1171","Thompson, H. W.; Lalancette, R. A.; Coté, M. L.","2-Carboxy- and 2,7-Dicarboxy-4,5-benzotropone: Hydrogen-Bonding Patterns of a β-Keto Acid and a Related β-Keto 1,5-Diacid","Acta Crystallographica Section C","1996","52","9","2372","2376","10.1107/S0108270196004933","","","0.71073","MoKα","","0.0647","0.0531","","0.1229","0.1185","","","","0.985","1.096","1.096","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005355","7.191","0.007","9.912","0.005","14.43","0.009","90","","95.53","0.05","90","","1023.7","1.3","296","1","296","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,7-Dicarboxy-4,5-benzotropone","2,7-Dicarboxy-4,5-benzocycloheptatrienone","","- C13 H8 O5 -","- C13 H8 O5 -","- C52 H32 O20 -","4","1","FG1171","Thompson, H. W.; Lalancette, R. A.; Coté, M. L.","2-Carboxy- and 2,7-Dicarboxy-4,5-benzotropone: Hydrogen-Bonding Patterns of a β-Keto Acid and a Related β-Keto 1,5-Diacid","Acta Crystallographica Section C","1996","52","9","2372","2376","10.1107/S0108270196004933","","","0.71073","MoKα","","0.0739","0.0544","","0.134","0.1252","","","","0.939","1.103","1.103","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005356","9.9062","0.001","9.838","0.001","24.061","0.003","90","","90","","90","","2344.9","0.4","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Cyclophosphamide","N,N-Bis(2-chloroethyl)-tetrahydro-2H-1,3,2-oxazaphosphorin-2-amine-2-oxide","","- C7 H15 Cl2 N2 O2 P -","- C7 H15 Cl2 N2 O2 P -","- C56 H120 Cl16 N16 O16 P8 -","8","1","FG1178","Jones, P. G.; Thönnessen, H.; Fischer, A.; Neda, I.; Schmutzler, R.; Engel, J.; Kutscher, B.; Niemeyer, U.","The Anhydrous Racemate of the Carcinostatic Agent Cyclophosphamide and the Bicyclic Degradation Product 1-(2-Chloroethyl)tetrahydro-1<i>H</i>,5<i>H</i>-1,3,2-diazaphospholo[2,1-<i>b</i>][1,3,2]oxazaphosphorine 9-Oxide","Acta Crystallographica Section C","1996","52","9","2359","2363","10.1107/S0108270196004866","","","0.71073","MoKα","","0.0513","0.0351","","0.0901","0.0839","","","","0.971","1.069","1.069","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005357","10.58","0.002","10.021","0.002","10.779","0.002","90","","118.95","0.02","90","","1000","0.4","143","2","143","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-(2-chloroethyl)tetrahydro-1H,5H- [1.3.2]diazaphospholo[2.1-b][1.3.2]oxazaphosphorine 9-oxide","","- C7 H14 Cl N2 O2 P -","- C7 H14 Cl N2 O2 P -","- C28 H56 Cl4 N8 O8 P4 -","4","1","FG1178","Jones, P. G.; Thönnessen, H.; Fischer, A.; Neda, I.; Schmutzler, R.; Engel, J.; Kutscher, B.; Niemeyer, U.","The Anhydrous Racemate of the Carcinostatic Agent Cyclophosphamide and the Bicyclic Degradation Product 1-(2-Chloroethyl)tetrahydro-1<i>H</i>,5<i>H</i>-1,3,2-diazaphospholo[2,1-<i>b</i>][1,3,2]oxazaphosphorine 9-Oxide","Acta Crystallographica Section C","1996","52","9","2359","2363","10.1107/S0108270196004866","","","0.71073","MoKα","","0.0293","0.0278","","0.0753","0.0732","","","","1.077","1.081","1.081","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005358","8.956","0.002","10.322","0.002","5.905","0.002","101.04","0.02","95.46","0.02","68.42","0.02","498","0.2","296","","296","","","","","","","","","4","P -1","-P 1","2","","Acetone 4,4-Dimethyl-2-pyrazoline-5-one-3ylhydrazone","","- C8 H14 N4 O -","- C8 H14 N4 O -","- C16 H28 N8 O2 -","2","1","FG1180","Meyers, C. Y.; Lutfi, H. G.; Kolb, V. M.; Hou, Y.; Robinson, P. D.","Acetone 4,4-Dimethyl-5-oxo-2-pyrazolin-3-ylhydrazone","Acta Crystallographica Section C","1996","52","9","2367","2370","10.1107/S0108270196004428","","","0.71069","MoKα","","","0.045","","","0.052","","","","","1.93","1.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005359","12.298","0.001","15.685","0.002","27.851","0.004","90","","100.51","0.01","90","","5282.2","1.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chlorobis[1,2-bis-(diphenylphosphino)ethane]osmium(II) Hexafluorophosphate Dichoromethane Solvate","","- C53.5 H51 Cl4 F6 Os P5 -","- C53.5 H51 Cl4 F6 Os P5 -","- C214 H204 Cl16 F24 Os4 P20 -","4","1","FG1187","Lough, A. J.; Morris, R. H.; Schlaf, M.","Bis[1,2-bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']chloroosmium(II) Hexafluorophosphate Dichloromethane Solvate","Acta Crystallographica Section C","1996","52","9","2193","2196","10.1107/S0108270196006208","","","0.71073","MoKα","","0.0577","0.034","","0.0797","0.0697","","","","1.042","1.054","1.054","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2005360","14.153","0.006","14.054","0.004","17.959","0.004","90","","102.9","0.02","90","","3482","2","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Racemic 1,1'-o-Xylylene-bis[3,5-dimethyl-hexahydro- s-triazine-2,4(1H,3H)-dione-6-spiro-9''-fluorene]","","- C42 H36 N6 O4 -","- C42 H36 N6 O4 -","- C168 H144 N24 O16 -","4","1","FG1188","Robinson, P. D.; Gong, Y.; Bausch, M. J.","Racemic α,α'-<i>o</i>-Xylylene-1,1'-bis[(3,5-dimethyl-5,6-dihydro-1,3,5-triazine-6-spiro-9'-fluorene)-2,4(1<i>H</i>,3<i>H</i>)-dione]","Acta Crystallographica Section C","1996","52","9","2337","2340","10.1107/S010827019600621X","","","0.71069","MoKα","","","0.063","","","0.056","","","","","1.57","1.57","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005361","9.969","0.002","15.883","0.001","19.369","0.002","90","","95.2","0.01","90","","3054.2","0.7","294","","294","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C42 H30 O -","- C42 H30 O -","- C168 H120 O4 -","4","1","FG1189","Fu, T. Y.; Olovsson, G.; Scheffer, J. R.; Trotter, J.","9,10,12,14-Tetrahydro-12,12,14,14-tetraphenyl-9,10[3',4']-furanoanthracene","Acta Crystallographica Section C","1996","52","9","2347","2349","10.1107/S0108270196006245","","","1.5418","CuKα","","","0.039","","","0.035","","","","","1.85","1.85","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005362","11.798","0.003","10.259","0.003","13.326","0.004","90","","92.38","0.07","90","","1611.5","0.8","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7.5 H22.5 Cl0.5 Mo2 O9.5 -","- C7.51 H22.53 Cl0.49 Mo2 O9.51 -","- C30.04 H90.12 Cl1.96 Mo8 O38.04 -","4","1","FG1191","Clegg, W.; Elsegood, M. R. J.; Errington, R. J.; Bakri, R.","A 3:1 Disordered Solid Solution of Di-μ-methoxo-<i>O</i>:<i>O</i>-bis[trimethoxooxomolybdenum(VI)] and Di-μ-methoxo-<i>O</i>:<i>O</i>-bis[chlorodimethoxooxomolybdenum(VI)]","Acta Crystallographica Section C","1996","52","9","2145","2148","10.1107/S0108270196006257","","","0.71073","MoKα","","0.0394","0.0303","","0.0783","0.071","","","","1.122","1.125","1.125","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005363","9.743","0.002","11.574","0.002","12.184","0.002","79.89","0.02","69.17","0.02","81.32","0.02","1258.3","0.4","276","","","","","","","","","","","6","P -1","-P 1","2","","","","- C29 H24 Cl Ni P S -","- C34 H19 Cl Ni P S -","- C68 H38 Cl2 Ni2 P2 S2 -","2","1","HA1150","Darkwa, J.; Milius, W.","(4-Chlorobenzenethiolato-<i>S</i>)(η^5^-cyclopentadienyl)(triphenylphosphine-<i>P</i>)nickel(II)","Acta Crystallographica Section C","1996","52","9","2159","2161","10.1107/S0108270196005896","","","0.71073","MoKα","","","0.0696","","","0.037","","","","","1.37","1.37","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005364","9.013","0.003","7.055","0.004","18.118","0.002","90","","98.51","0.02","90","","1139.4","0.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2-saccharinperethanoic acid monohydrate","3-oxo-1,2-benzisothiazole-2(3H)-perethanoic acid monohydrate","","- C9 H9 N O7 S -","- C9 H6 N O7 S -","- C36 H24 N4 O28 S4 -","4","1","HA1157","Feeder, N.; Jones, W.","<i>N</i>-Saccharinperacetic Acid Monohydrate and <i>N</i>-Saccharinpentanoic Acid Monohydrate","Acta Crystallographica Section C","1996","52","9","2323","2326","10.1107/S0108270196003769","","","0.71069","MoKα","","0.0634","0.0466","","0.134","0.1222","","","","1.046","1.089","1.089","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005365","8.412","0.003","9.19","0.003","10.88","0.006","66.74","0.03","88.86","0.03","64.67","0.03","687.1","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","5-saccharinpentanoic acid monohydrate","3-oxo-1,2-benzisothiazole-2(3H)-pentanoic acid 1,1-dioxide monohydrate","","- C12 H15 N O6 S -","- C12 H12 N O6 S -","- C24 H24 N2 O12 S2 -","2","1","HA1157","Feeder, N.; Jones, W.","<i>N</i>-Saccharinperacetic Acid Monohydrate and <i>N</i>-Saccharinpentanoic Acid Monohydrate","Acta Crystallographica Section C","1996","52","9","2323","2326","10.1107/S0108270196003769","","","0.71073","MoKα","","0.0627","0.0455","","0.1473","0.1344","","","","1.121","1.172","1.172","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005366","8.248","0.003","9.593","0.003","10.943","0.003","90","","99.48","0.01","90","","854","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(2R,3S)-3-benzamido-3-methoxycarbonylbicyclo[2.2.2]octane-2-carboxylic acid","","- C18 H21 N O5 -","- C18 H21 N O5 -","- C36 H42 N2 O10 -","2","1","HA1159","Buñuel, E.; Cativiela, C.; Díaz-de-Villegas, M. D.; Gálvez, J. A.","A New Conformationally Restricted Aspartic Acid Analogue with a Bicyclo[2.2.2]octane Skeleton","Acta Crystallographica Section C","1996","52","9","2292","2294","10.1107/S0108270196004696","","","0.71073","MoKα","","0.0623","0.044","","0.1134","0.1019","","","","1.062","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005367","20.345","0.003","10.316","0.002","6.482","0.001","90","","90","","90","","1360.4","0.4","295.2","","295.2","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C13 H15 Br2 N O2 -","- C11.5 H13.5 Br2 N0.5 O2 -","- C46 H54 Br8 N2 O8 -","4","0.5","HA1163","Beddoes, R. L.; Zhao, Y.; Joule, J. A.","3a,7a-Dibromo-2-butyl-4,7-methano-1,3,3a,4,7,7a-hexahydro-2<i>H</i>-isoindole-1,3-dione from the Reaction of 3,4-Dibromo-1-butylmaleimide with Cyclopentadiene","Acta Crystallographica Section C","1996","52","9","2313","2315","10.1107/S0108270196007950","","","0.7107","MoKα","","0.1223","0.0371","","0.0313","0.0245","","","","1.271","1.477","1.477","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005368","11.378","0.002","7.124","0.001","11.585","0.002","90","","101.7","0.8","90","","920","3","293","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H25 Co N2 O3 -","- C20 H25 Co N2 O3 -","- C40 H50 Co2 N4 O6 -","2","1","HU1052","Chen, H.; Han, D.; Yan, H.; Tang, W.; Yang, Y.; Yang, W.","Aqua[bis(salicylidene)ethylenediaminato](isobutyl)cobalt(III)","Acta Crystallographica Section C","1996","52","9","2204","2206","10.1107/S0108270196009134","","","0.71073","MoKα","","","0.053","","","0.067","","","","","1.24","1.24","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2005369","10.6713","0.0007","6.6936","0.0006","21.0352","0.0007","90","","100.776","0.004","90","","1476.04","0.17","153","","153","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Isopropylamidine hydrochloride","Isopropylamidine hydrochloride","","- C4 H11 Cl N2 -","- C4 H11 Cl N2 -","- C32 H88 Cl8 N16 -","8","2","HU1140","Barker, J.; Powell, H. R.","Isopropylamidinium Chloride","Acta Crystallographica Section C","1996","52","9","2307","2309","10.1107/S0108270196002843","","","1.5418","CopperKα","","","0.0368","","","0.0443","","","","","4.976","4.976","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005370","6.806","0.001","8.166","0.001","15.568","0.002","100.69","0.01","94.99","0.02","103.29","0.01","819.8","0.2","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H25 N O4 -","- C16 H25 N O4 -","- C32 H50 N2 O8 -","2","1","JZ1117","Beck, H.; Egert, E.","A Dihydrooxazinone","Acta Crystallographica Section C","1996","52","9","2253","2254","10.1107/S0108270196003873","","","0.71073","MoKα","","","0.067","","","0.057","","","","","1.58","1.58","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005371","13.734","0.002","8.281","0.001","6.53","0.001","90","","90","","90","","742.67","0.18","293","","","","","","","","","","","3","P m n 21","P 2ac -2","31","","","","- C18 H24 O3 -","- C18 H24 O3 -","- C36 H48 O6 -","2","0.5","JZ1118","Schormann, N.; Egert, E.","A Fully Cyclo-Substituted Cyclohexane","Acta Crystallographica Section C","1996","52","9","2254","2256","10.1107/S0108270196003885","","","0.71073","MoKα","","","0.049","","","0.056","","","","","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005372","13.651","0.001","23.91","0.003","27.883","0.002","90","","102.44","0.01","90","","8887.2","1.5","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H46 Co2 Mo2 O22 P6 -","- C26 H46 Co2 Mo2 O22 P6 -","- C208 H368 Co16 Mo16 O176 P48 -","8","2","JZ1119","Herbst-Irmer, R.; Egert, E.","An Mo~2~(CO)~4~ (Mo[tripleMo) Fragment Stabilized by a Tripod Ligand","Acta Crystallographica Section C","1996","52","9","2161","2164","10.1107/S0108270196004076","","","0.71073","MoKα","","","0.042","","","0.049","","","","","2.08","2.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005373","7.577","0.001","22.058","0.003","15.098","0.002","90","","90","","90","","2523.4","0.6","293","1","293","1","","","","","","","","6","P b c n","-P 2n 2ab","60","","trans-dichlorotetra(pyridine)molybdenum(III) tribromide","","- C20 H20 Br3 Cl2 Mo N4 -","- C20 H20 Br3 Cl2 Mo N4 -","- C80 H80 Br12 Cl8 Mo4 N16 -","4","0.5","JZ1125","Rotar, R.; Leban, I.; Brenčič, J. V.","<i>trans</i>-Dichlorotetrakis(pyridine-<i>N</i>)molybdenum(III) Tribromide","Acta Crystallographica Section C","1996","52","9","2155","2157","10.1107/S0108270196005628","","","0.71073","MoKα","","0.119","0.0525","","0.1327","0.1052","","","","1.024","1.117","1.117","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005374","6.283","0.001","22.113","0.002","9.691","0.002","90","","91.1","0.01","90","","1346.2","0.4","294","","294","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","E-2,2,5,5-Tetramethyl-3,4-di[4-(tribromomethyl)phenyl]hex-3-ene","","- C24 H26 Br6 -","- C30 H44 Br6 -","- C60 H88 Br12 -","2","0.5","KA1154","Gano, J. E.; Kirschbaum, K.; Sekher, P.","(<i>E</i>)-2,2,5,5-Tetramethyl-3,4-bis[4-(tribromomethyl)phenyl]hex-3-ene","Acta Crystallographica Section C","1996","52","9","2334","2337","10.1107/S0108270196001576","","","0.71073","Mo-Kα","","0.181","0.056","","","0.061","","","","","1.732","1.732","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005375","6.419","0.001","13.34","0.002","24.701","0.002","90","","90","","90","","2115.1","0.5","153","2","153","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-(6-Methoxy-7-methyl-1,2,3,4-tetrahydro-naphthalene-1-yl)ethyl 4,7,7-trimethyl-3-oxo-2-oxa-bicyclo[2.2.1]heptane-1-carboxylate","","- C24 H32 O5 -","- C24 H32 O5 -","- C96 H128 O20 -","4","1","KA1161","Noltemeyer, M.; Raschke, T.; Tietze, L. F.","2-(6-Methoxy-7-methyl-1,2,3,4-tetrahydro-1-naphthyl)ethyl 4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate","Acta Crystallographica Section C","1996","52","9","2256","2258","10.1107/S0108270196004167","","","0.71073","MoKα","","0.0356","0.032","","0.0818","0.0776","","","","1.066","1.066","1.066","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005376","17.172","0.004","17.172","0.004","14.965","0.009","90","","90","","120","","3822","3","293","2","293","2","","","","","","","","3","P 61","P 61","169","Diester of 16α-hydroxy-prednisolone","21-Acetoxy-16α-propionoxy-11β,17α-dihydroxypregna-1,4-diene-3,20-dione monohydrate","","- C26 H36 O9 -","- C26 H36 O9 -","- C156 H216 O54 -","6","1","KA1173","Pniewska, B.; Anulewicz, R.; Uszycka-Horawa, T.","21-Acetoxy-16α-propionoxy-11β,17α-dihydroxypregna-1,4-diene-3,20-dione Monohydrate","Acta Crystallographica Section C","1996","52","9","2288","2290","10.1107/S0108270196002533","","","1.54178","CuKα","","0.095","0.058","","0.1678","0.1477","","","","1.005","1.109","1.109","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005377","6.8302","0.0008","12.164","0.001","23.846","0.004","90","","90","","90","","1981.2","0.4","295","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C22 H28 O3 -","- C22 H28 O3 -","- C88 H112 O12 -","4","1","KA1177","Steiner, Th.","17α-Ethynyl-19-nor-3-oxo-4-androsten-17β-yl Acetate (Norethindrone Acetate)","Acta Crystallographica Section C","1996","52","9","2261","2263","10.1107/S0108270196002417","","","1.54184","CuKα","","","0.059","","","0.156","","","","","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005378","8.55","0.001","12.189","0.001","20.979","0.002","90","","90","","90","","2186.3","0.4","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","16β-fluoro-17aβ-(4-nitroanilino)-3-methoxy-D-homoestra-1,3,5(10)-triene","","- C26 H31 F N2 O3 -","- C26 H31 F N2 O3 -","- C104 H124 F4 N8 O12 -","4","1","KA1183","Noltemeyer, M.; Tietze, L. F.; Wölfling, J.; Frank, É.; Schneider, G.","A Fluorinated <small>D</small>-Homoestrone Derivative","Acta Crystallographica Section C","1996","52","9","2258","2259","10.1107/S0108270196003897","","","0.71073","MoKα","","0.0591","0.0459","","0.1065","0.0967","","","","1.073","1.074","1.074","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005379","14.868","0.005","11.953","0.002","20.403","0.006","90","","90","","90","","3626","1.7","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","Triphenylpropargylphosphonium bromide","","- C21 H18 Br P -","- C21 H18 Br P -","- C168 H144 Br8 P8 -","8","2","KA1184","Steiner, Th.","Triphenylpropargylphosphonium Bromide","Acta Crystallographica Section C","1996","52","9","2263","2266","10.1107/S0108270196004490","","","1.54176","CuKα","","0.0405","0.0295","","0.0827","0.068","","","","1.045","1.1","1.1","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005380","16.233","0.002","17.313","0.002","13.3","0.001","90","","90","","90","","3737.9","0.7","173","","173","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4-Hydroxy-3-diethylphosphono-5-tert-butyl-phenyl)-bis-(diphenylphosphinyl)- methane","","- C39 H45 O7 P3 -","- C39 H45 O7 P3 -","- C156 H180 O28 P12 -","4","1","KA1188","Ramm, M.; Costisella, B.","Diethyl 5-Bis(diphenylphosphinoyl)methyl-2-hydroxy-3-<i>tert</i>-butylphenylphosphonate Hydrate at 173K","Acta Crystallographica Section C","1996","52","9","2305","2307","10.1107/S0108270196003903","","","1.54178","CuKα","","","0.044","","","0.059","","","","","2.274","2.274","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005381","4.8701","0.0002","11.046","0.001","23.877","0.004","90","","90","","90","","1284.5","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Gly-His hydrochloride dihydrate","Glycyl-L-histidinium Chloride dihydrate","","- C8 H17 Cl N4 O5 -","- C8 H17 Cl N4 O5 -","- C32 H68 Cl4 N16 O20 -","4","1","KA1193","Steiner, Th.","Glycyl-<small>L</small>-histidinium Chloride Dihydrate: an Unusual Histidine Conformation","Acta Crystallographica Section C","1996","52","9","2266","2269","10.1107/S0108270196004556","","","1.54176","CuKα","","0.0445","0.0383","","0.1357","0.0966","","","","1.095","1.1","1.1","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005382","9.1259","0.0008","21.802","0.001","9.0555","0.0009","90","","102.85","0.008","90","","1756.6","0.3","293","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H23 N O4 -","- C20 H23 N O4 -","- C80 H92 N4 O16 -","4","1","KH1085","Honda, T.; Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A.","Coumarin 338","Acta Crystallographica Section C","1996","52","9","2363","2365","10.1107/S0108270196004362","","","1.54184","CuKα","","","0.052","","","0.087","","","","","2.3","2.3","","","","","has coordinates,has disorder","206251","2020-10-21","18:00:00",""
"2005383","9.552","0.004","9.552","0.004","36.413","0.009","90","","90","","90","","3322","2","293","2","","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C15 H23 N4 O6.5 -","- C15 H21 N4 O6.5 -","- C120 H168 N32 O52 -","8","1","KH1092","Hirayama, N.; Arai, H.; Kasai, M.","Structural Studies of Mitomycins. VIII. Mitomycin D Hydrate, C~15~H~18~N~4~O~5~.1.5H~2~O","Acta Crystallographica Section C","1996","52","9","2365","2367","10.1107/S0108270196004350","","","1.54184","CuKα","","","0.055","","","0.067","","","","","2.33","2.33","","","","","has coordinates","203832","2020-10-21","18:00:00",""
"2005384","8.707","0.001","12.106","0.002","14.704","0.004","92.03","0.01","91.55","0.01","96.86","0.01","1537.1","0.5","293","","","","","","","","","","","3","P -1","-P 1","2","","","","- C18 H24 O2 -","- C18 H24 O2 -","- C72 H96 O8 -","4","2","LI1143","Zukerman-Schpector, J.; Caracelli, I.; Silva, Jnr, F.; Brocksom, T. J.","Structures of the Diels‒Alder Reaction Products of Thymoquinone and 1-Vinylcyclohexene. III. 5-Isopropyl-2-methyltricyclo[8.4.0.0^2,7^]tetradeca-4,9-diene-3,6-dione, C~18~H~24~O~2~","Acta Crystallographica Section C","1996","52","9","2354","2356","10.1107/S0108270196004210","","","0.71073","MoKα","","0.2065","0.0609","","0.1919","0.1273","","","","1.026","1.158","1.158","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005385","15.2841","0.0011","8.3869","0.0013","28.3216","0.0009","90","","102.104","0.014","90","","3549.7","0.6","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Bis[5,5-di(4'-methoxyphenyl)-3,3-dimethyl-2-tetrahydrofuranyl] ether.","","- C40 H46 O7 -","- C40 H46 O7 -","- C160 H184 O28 -","4","1","LI1146","Barnes, J. C.; Horspool, W. M.; Hynd, G.; Armesto, D.; Ramos, A.","Bis[5,5-bis(4-methoxyphenyl)-3,3-dimethyl-2-tetrahydrofuranyl] Ether","Acta Crystallographica Section C","1996","52","9","2296","2298","10.1107/S0108270196004088","","","0.71069","MoKα","","0.0785","0.0449","","0.1066","0.0967","","","","0.822","1.047","1.047","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005386","15.89","0.002","12.264","0.002","9.147","0.002","90","","93.9","0.02","90","","1778.4","0.5","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2(2-hydroxy-5,5-dimethylcyclohexan-1,3-dione)-5,5-dimethylcyclo- hexan-1,3-dionato caesium monohydrate","","- C16 H23 Cs O6 -","- C16 H22 Cs O6 -","- C64 H88 Cs4 O24 -","4","1","LI1149","Barnes, J. C.","Caesium 2-(2-Hydroxy-5,5-dimethyl-1,3-dioxo-2-cyclohexyl)-5,5-dimethyl-1,3-cyclohexanedionato(1‒) Monohydrate","Acta Crystallographica Section C","1996","52","9","2185","2188","10.1107/S0108270196007342","","","0.71069","MoKα","","0.0537","0.0505","","0.1303","0.1284","","","","1.071","1.101","1.101","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005387","9.092","0.001","9.849","0.001","10.428","0.001","68.9","0.01","69.39","0.01","72.67","0.01","799.62","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","6-methyl-2-(4-methylphenyl)-8-trifluoromethylimidazo[1,2-a][1,8] naphthyridine.","","- C19 H14 F3 N3 -","- C19 H14 F3 N3 -","- C38 H28 F6 N6 -","2","1","MU1237","Fun, H.-K.; Sivakumar, K.; Chua, S.-O.; Ooi, M.-F.; Anwair, M. A. S.; Gan, E.-K.; Jackson, W. R.","Substituted Imidazonaphthyridine Derivatives. I. C~19~H~14~F~3~N~3~, C~18~H~10~F~5~N~3~, C~18~H~11~ClF~3~N~3~ and C~18~H~11~BrF~3~N~3~","Acta Crystallographica Section C","1996","52","9","2231","2236","10.1107/S010827019600371X","","","0.71073","MoKα","","0.0628","0.0457","","0.1446","0.1352","","","","1.045","1.177","1.177","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005388","7.916","0.007","8.454","0.006","12.838","0.009","73.64","0.02","87.62","0.06","70.08","0.07","773.6","1.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(3,4-difluorophenyl)-6-methyl-8-trifluoromethylimidazo[1,2-a][1,8] naphthyridine.","","- C18 H10 F5 N3 -","- C18 H10 F5 N3 -","- C36 H20 F10 N6 -","2","1","MU1237","Fun, H.-K.; Sivakumar, K.; Chua, S.-O.; Ooi, M.-F.; Anwair, M. A. S.; Gan, E.-K.; Jackson, W. R.","Substituted Imidazonaphthyridine Derivatives. I. C~19~H~14~F~3~N~3~, C~18~H~10~F~5~N~3~, C~18~H~11~ClF~3~N~3~ and C~18~H~11~BrF~3~N~3~","Acta Crystallographica Section C","1996","52","9","2231","2236","10.1107/S010827019600371X","","","0.71073","MoKα","","0.1197","0.1027","","0.3248","0.305","","","","1.077","1.207","1.207","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005389","8.422","0.002","9.042","0.001","12.859","0.003","70.43","0.02","89.09","0.02","62.25","0.01","804.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(4-chlorophenyl)-6-methyl-8-trifluoromethylimidazo[1,2-a][1,8] naphthyridine.","","- C18 H11 Cl F3 N3 -","- C18 H11 Cl F3 N3 -","- C36 H22 Cl2 F6 N6 -","2","1","MU1237","Fun, H.-K.; Sivakumar, K.; Chua, S.-O.; Ooi, M.-F.; Anwair, M. A. S.; Gan, E.-K.; Jackson, W. R.","Substituted Imidazonaphthyridine Derivatives. I. C~19~H~14~F~3~N~3~, C~18~H~10~F~5~N~3~, C~18~H~11~ClF~3~N~3~ and C~18~H~11~BrF~3~N~3~","Acta Crystallographica Section C","1996","52","9","2231","2236","10.1107/S010827019600371X","","","0.71073","MoKα","","0.0546","0.0416","","0.1191","0.1134","","","","1.019","1.133","1.133","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005390","8.557","0.001","8.954","0.001","12.957","0.001","70.12","0.01","72.27","0.01","63.19","0.01","819.62","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(4-bromophenyl)-6-methyl-8-trifluoromethylimidazo[1,2,-a][1,8] naphthyridine.","","- C18 H11 Br F3 N3 -","- C18 H11 Br F2.97 N3 -","- C36 H22 Br2 F5.94 N6 -","2","1","MU1237","Fun, H.-K.; Sivakumar, K.; Chua, S.-O.; Ooi, M.-F.; Anwair, M. A. S.; Gan, E.-K.; Jackson, W. R.","Substituted Imidazonaphthyridine Derivatives. I. C~19~H~14~F~3~N~3~, C~18~H~10~F~5~N~3~, C~18~H~11~ClF~3~N~3~ and C~18~H~11~BrF~3~N~3~","Acta Crystallographica Section C","1996","52","9","2231","2236","10.1107/S010827019600371X","","","0.71073","MoKα","","0.0905","0.0523","","0.1444","0.1331","","","","0.927","1.138","1.138","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005391","8.041","0.001","13.567","0.001","15.03","0.001","93.52","0.001","97.32","0.001","105.93","0.01","1555.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","6,8-dimethyl-2-(4-methoxyphenyl)imidazo[1,2-a]1,8-naphthyridine.","","- C19 H17 N3 O -","- C19 H17 N3 O -","- C76 H68 N12 O4 -","4","2","MU1239","Sivakumar, K.; Fun, H.-K.; Chua, S.-O.; Ooi, M.-F.; Anwair, M. A. S.; Gan, E.-K.; Jackson, W. R.","Substituted Imidazonaphthyridine Derivatives. II. C~19~H~17~N~3~O and C~24~H~19~N~3~O","Acta Crystallographica Section C","1996","52","9","2236","2239","10.1107/S0108270196003708","","","0.71073","MoKα","","0.1116","0.0589","","0.1807","0.1521","","","","0.894","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005392","8.435","0.001","7.146","0.001","31.823","0.003","90","","92","0.01","90","","1917","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-methoxyphenyl)-6-methyl-8-phenylimidazo[1,2-a][1,8]naphthyridine.","","- C24 H19 N3 O -","- C24 H19 N3 O -","- C96 H76 N12 O4 -","4","1","MU1239","Sivakumar, K.; Fun, H.-K.; Chua, S.-O.; Ooi, M.-F.; Anwair, M. A. S.; Gan, E.-K.; Jackson, W. R.","Substituted Imidazonaphthyridine Derivatives. II. C~19~H~17~N~3~O and C~24~H~19~N~3~O","Acta Crystallographica Section C","1996","52","9","2236","2239","10.1107/S0108270196003708","","","0.71073","MoKα","","0.0957","0.0482","","0.1433","0.117","","","","0.899","1.063","1.063","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005393","9.387","0.001","10.173","0.002","11.698","0.0001","110.36","0.01","91.83","0.01","103.34","0.01","1011.3","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1-diethylaminomethyl-6,8-dimethyl-2-(4-methylphenyl)imidazo[1,2-a][1,8] naphthyridine.","","- C24 H28 N4 -","- C24 H28 N4 -","- C48 H56 N8 -","2","1","MU1241","Sivakumar, K.; Fun, H.-K.; Chua, S.-O.; Ooi, M.-F.; Anwair, M. A. S.; Gan, E.-K.; Jackson, W. R.","Substituted Imidazonaphthyridine Derivatives. III. C~24~H~28~N~4~, C~24~H~28~N~4~O and C~23~H~25~BrN~4~","Acta Crystallographica Section C","1996","52","9","2239","2243","10.1107/S0108270196003745","","","0.71073","MoKα","","0.0591","0.0503","","0.1604","0.1526","","","","1.096","1.168","1.168","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005394","7.358","0.001","10.641","0.001","13.586","0.001","96.55","0.01","95.64","0.01","98.11","0.01","1039.13","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-diethylaminomethyl-6,8-dimethyl-2-(4-methoxyphenyl)imidazo[1,2-a][1,8] naphthyridine.","","- C24 H28 N4 O -","- C24 H28 N4 O -","- C48 H56 N8 O2 -","2","1","MU1241","Sivakumar, K.; Fun, H.-K.; Chua, S.-O.; Ooi, M.-F.; Anwair, M. A. S.; Gan, E.-K.; Jackson, W. R.","Substituted Imidazonaphthyridine Derivatives. III. C~24~H~28~N~4~, C~24~H~28~N~4~O and C~23~H~25~BrN~4~","Acta Crystallographica Section C","1996","52","9","2239","2243","10.1107/S0108270196003745","","","0.71073","MoKα","","0.0507","0.0383","","0.105","0.1001","","","","0.976","1.09","1.09","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005395","12.134","0.001","12.833","0.002","15.25","0.002","113.98","0.01","91.33","0.01","105.68","0.01","2064.9","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(4-bromophenyl)-1-diethylaminomethyl-6,8-dimethylimidazo[1,2-a][1,8] naphthyridine.","","- C23 H25 Br N4 -","- C23 H25 Br N4 -","- C92 H100 Br4 N16 -","4","2","MU1241","Sivakumar, K.; Fun, H.-K.; Chua, S.-O.; Ooi, M.-F.; Anwair, M. A. S.; Gan, E.-K.; Jackson, W. R.","Substituted Imidazonaphthyridine Derivatives. III. C~24~H~28~N~4~, C~24~H~28~N~4~O and C~23~H~25~BrN~4~","Acta Crystallographica Section C","1996","52","9","2239","2243","10.1107/S0108270196003745","","","0.71073","MoKα","","0.1118","0.058","","0.1829","0.1468","","","","1.029","1.177","1.177","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005396","4.495","0.004","19.982","0.012","7.822","0.004","90","","105.47","0.06","90","","677.1","0.8","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","ammonium phosphoglycolate","","- C2 H8 N O6 P -","- C2 H8 N O6 P -","- C8 H32 N4 O24 P4 -","4","1","MU1249","Lis, T.","Ammonium Salts of Phosphoglycolic Acid (H~3~PG): NH~4~. H~2~PG, 3NH~4~. H~2~PG. HPG, 2NH~4~. HPG and 3NH~4~.PG.H~2~O at 150K","Acta Crystallographica Section C","1996","52","9","2326","2332","10.1107/S0108270196002624","","","0.71073","MoKα","","0.0404","0.0274","","0.0821","0.0776","","","","1.097","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005397","17.732","0.006","9.626","0.004","16.628","0.006","90","","93.18","0.03","90","","2833.8","1.8","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","triammonium bis(phosphoglycolate)","","- C4 H19 N3 O12 P2 -","- C4 H19 N3 O12 P2 -","- C32 H152 N24 O96 P16 -","8","1","MU1249","Lis, T.","Ammonium Salts of Phosphoglycolic Acid (H~3~PG): NH~4~. H~2~PG, 3NH~4~. H~2~PG. HPG, 2NH~4~. HPG and 3NH~4~.PG.H~2~O at 150K","Acta Crystallographica Section C","1996","52","9","2326","2332","10.1107/S0108270196002624","","","0.71073","MoKα","","0.0606","0.0297","","0.0922","0.0807","","","","1.018","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005398","13.202","0.005","8.072","0.003","13.792","0.005","90","","91.12","0.03","90","","1469.5","0.9","150","1","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","diammonium phosphoglycolate","","- C2 H11 N2 O6 P -","- C2 H11 N2 O6 P -","- C16 H88 N16 O48 P8 -","8","2","MU1249","Lis, T.","Ammonium Salts of Phosphoglycolic Acid (H~3~PG): NH~4~. H~2~PG, 3NH~4~. H~2~PG. HPG, 2NH~4~. HPG and 3NH~4~.PG.H~2~O at 150K","Acta Crystallographica Section C","1996","52","9","2326","2332","10.1107/S0108270196002624","","","0.71073","MoKα","","0.0433","0.0309","","0.0879","0.0814","","","","1.069","1.103","1.103","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005399","7.318","0.004","14.086","0.005","9.657","0.004","90","","93.37","0.04","90","","993.7","0.8","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","triammonium phosphoglycolate hydrate","","- C2 H16 N3 O7 P -","- C2 H16 N3 O7 P -","- C8 H64 N12 O28 P4 -","4","1","MU1249","Lis, T.","Ammonium Salts of Phosphoglycolic Acid (H~3~PG): NH~4~. H~2~PG, 3NH~4~. H~2~PG. HPG, 2NH~4~. HPG and 3NH~4~.PG.H~2~O at 150K","Acta Crystallographica Section C","1996","52","9","2326","2332","10.1107/S0108270196002624","","","0.71073","MoKα","","0.0773","0.0335","","0.0971","0.0843","","","","1.004","1.1","1.1","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005400","6.362","0.003","7.512","0.003","17.258","0.008","94.55","0.04","96.81","0.05","104.59","0.04","787.4","0.6","295","","295","","","","","","","","","6","P -1","-P 1","2","","Bis(para-aminobenzoic acid)dichloro cadmium","","- C14 H14 Cd Cl2 N2 O4 -","- C14 H14 Cd Cl2 N2 O4 -","- C28 H28 Cd2 Cl4 N4 O8 -","2","1","MU1252","Le Fur, Y.; Masse, R.","Bis(<i>p</i>-aminobenzoic acid-<i>N</i>)dichlorocadmium(II)","Acta Crystallographica Section C","1996","52","9","2183","2185","10.1107/S0108270196003721","","","0.5608","AgKα","","0.025","0.025","","0.027","0.027","","","","0.81","0.81","0.81","","","","","has coordinates","190528","2020-10-21","18:00:00",""
"2005401","10.2145","0.0007","8.9516","0.0006","12.5214","0.0008","90","","96.77","0.006","90","","1136.93","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,4-Dimethyl-Pyridinium bis(6,7-dihydro-5H-1,4-dithiepin-2,3-dithiolato) Cuprate (III)","","- C17 H22 Cu N S8 -","- C17 H22 Cu N S8 -","- C34 H44 Cu2 N2 S16 -","2","0.5","MU1254","Fun, H.-K.; Sivakumar, K.; Zuo, J.-L.; You, F.; You, X.-Z.","1,4-Dimethylpyridinium Bis(6,7-dihydro-5<i>H</i>-1,4-dithiepine-2,3-dithiolato-<i>S</i>,<i>S</i>')cuprate(III)","Acta Crystallographica Section C","1996","52","9","2153","2155","10.1107/S0108270196003757","","","0.71073","MoKα","","0.0591","0.0449","","0.1332","0.1255","","","","0.957","1.044","1.044","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005402","14.654","0.001","14.385","0.001","15.897","0.001","90","","90","","90","","3351.1","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Tris(4-chlorophenyl)phosphine.","","- C18 H12 Cl3 P -","- C18 H12 Cl3 P -","- C144 H96 Cl24 P8 -","8","1","MU1256","bin Shawkataly, O.; Singh, J.; Fun, H.-K.; Sivakumar, K.","Tris(4-chlorophenyl)phosphine and Tris(4-fluorophenyl)phosphine","Acta Crystallographica Section C","1996","52","9","2243","2245","10.1107/S0108270196004337","","","0.71073","MoKα","","0.0784","0.0402","","0.1053","0.0931","","","","0.881","1.032","1.032","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005403","12.428","0.001","12.428","0.001","8.753","0.001","90","","90","","120","","1170.82","0.19","293","2","293","2","","","","","","","","4","P 31","P 31","144","","Tris(4-fluorophenyl)phosphine.","","- C18 H12 F3 P -","- C18 H12 F3 P -","- C54 H36 F9 P3 -","3","1","MU1256","bin Shawkataly, O.; Singh, J.; Fun, H.-K.; Sivakumar, K.","Tris(4-chlorophenyl)phosphine and Tris(4-fluorophenyl)phosphine","Acta Crystallographica Section C","1996","52","9","2243","2245","10.1107/S0108270196004337","","","0.71073","MoKα","","0.0607","0.0359","","0.0791","0.0723","","","","0.907","1.059","1.059","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005404","21.33","0.001","5.4002","0.0001","26.232","0.002","90","","112.447","0.009","90","","2792.6","0.3","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H32 N2 O4 S2 -","- C31 H32 N2 O4 S2 -","- C124 H128 N8 O16 S8 -","4","1","NA1212","Feigel, M.; Strassner, Th.; Manero, J.; Weckert, E.","4,4'-Bis(2,4,6-trimethylbenzenesulfonamido)diphenylmethane","Acta Crystallographica Section C","1996","52","9","2303","2305","10.1107/S0108270196002016","","","1.5405","CuKα","","","0.051","","","0.054","","","","","1.66","1.66","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005405","14.467","0.002","7.391","0.004","11.868","0.003","90","","90","","90","","1269","0.8","292","","292","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Methacryloylcholine iodide","","- C9 H18 I N O2 -","- C9 H18 I N O2 -","- C36 H72 I4 N4 O8 -","4","0.5","NA1215","Angelova, O.; Macícek, J.; Kossev, K.; Koseva, N.","Trimethyl[2-(2-methyl-2-propenoyloxy)ethyl]ammonium Iodide (Methacryloylcholine Iodide)","Acta Crystallographica Section C","1996","52","9","2216","2218","10.1107/S0108270196002855","","","0.71073","MoKα","","0.031","0.026","","0.059","0.041","","","","1.378","0.979","0.979","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005406","11.13","0.004","13.028","0.004","24.74","0.02","90","","90","","90","","3587","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Methyl 2,7,7-Trimethyl-4(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolyl- 3-carboxylate","","- C20 H22 N2 O5 -","- C20 H22 N2 O5 -","- C160 H176 N16 O40 -","8","1","NA1225","Morales, A. D.; García-Granda, S.; Navarro, M. S.; Diviú, A. M.; Pérez-Barquero, R. E.","Methyl 2,7,7-Trimethyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate and 3-Acetyl-2,7,7-trimethyl-4-phenyl-1,4,5,6,7,8-hexahydro-5-quinolone","Acta Crystallographica Section C","1996","52","9","2356","2359","10.1107/S0108270196004611","","","0.71073","MoKα","","0.1638","0.0502","","0.1492","0.1132","","","","1.037","1.167","1.167","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005407","11.046","0.005","12.7318","0.0008","12.944","0.005","90","","106.68","0.03","90","","1743.8","1.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Ethanoyl-2,7,7-trimethyl-4-phenyl-1,4,5,6,7,8-hexahydro-5-quinolone","","- C20 H23 N O2 -","- C20 H23 N O2 -","- C80 H92 N4 O8 -","4","1","NA1225","Morales, A. D.; García-Granda, S.; Navarro, M. S.; Diviú, A. M.; Pérez-Barquero, R. E.","Methyl 2,7,7-Trimethyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate and 3-Acetyl-2,7,7-trimethyl-4-phenyl-1,4,5,6,7,8-hexahydro-5-quinolone","Acta Crystallographica Section C","1996","52","9","2356","2359","10.1107/S0108270196004611","","","0.71073","MoKα","","0.3249","0.0591","","0.1894","0.1172","","","","0.962","1.232","1.232","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005408","17.242","0.004","15.244","0.003","11.406","0.005","90","","90","","90","","2997.9","1.6","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","rac.-1,10-Dimethyl-1,10-bis-(tert.-butyldimethylsilyloxy)-cyclododeca- 2,8-diyne","","- C26 H48 O2 Si2 -","- C26 H48 O2 Si2 -","- C104 H192 O8 Si8 -","4","0.5","NA1231","Boss, C.; Keese, R.; Förtsch, M.","Racemic 3,6-Dimethyl-3,6-bis(<i>tert</i>-butyldimethylsilyloxy)-1,7-cyclododecadiyne","Acta Crystallographica Section C","1996","52","9","2370","2372","10.1107/S0108270196004891","","","0.71069","MoKα","","0.1019","0.0435","","0.1454","0.118","","","","1.091","1.206","1.206","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005409","8.6202","0.0003","20.154","0.001","21.0425","0.0009","73.497","0.004","89.067","0.003","79.781","0.004","3447.3","0.3","293","","293","","","","","","","","","5","P -1","-P 1","2","","cis-2-sec-Butyl-4-[4-(4-{4-[2-(2,4-dichlorophenyl)- 2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-ylmethoxy]phenyl}- piperazin-1-yl)phenyl]-2,4-dihydro-1,2,4-triazol-3-one","","- C35 H38 Cl2 N8 O4 -","- C39 H47 Cl2 N8 O4 -","- C156 H188 Cl8 N32 O16 -","4","2","NA1232","Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","<i>cis</i>-2-<i>sec</i>-Butyl-4-{4-[4-(4-{[2-(2,4-dichlorophenyl)-2-(1<i>H</i>-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)-1-piperazinyl]phenyl}-2,4-dihydro-3<i>H</i>-1,2,4-triazol-3-one (Itraconazole)","Acta Crystallographica Section C","1996","52","9","2225","2229","10.1107/S0108270196004180","","","1.54184","CuKα","","0.1151","0.0594","","0.2","0.1461","","","","1.02","1.026","1.026","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005410","7.603","0.001","11.701","0.002","14.434","0.002","90","","101.17","0.01","90","","1259.8","0.3","293","","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","bis[bis(2-pyridyl)sulphide]palladium(II) bis(tetrafluoroborate)","","- C20 H16 B2 F8 N4 Pd S2 -","- C20 H16 B2 F8 N4 Pd0.5 S2 -","- C40 H32 B4 F16 N8 Pd S4 -","2","0.5","NA1236","Nicolò, F.; Bruno, G.; Tresoldi, G.","Bis[bis(2-pyridyl-<i>N</i>) sulfide]palladium(II) Bis(tetrafluoroborate)","Acta Crystallographica Section C","1996","52","9","2188","2191","10.1107/S010827019600604X","","","0.71073","MoKα","","0.0465","0.0272","","0.0359","0.0314","","","","","1.48","1.48","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2005411","8.366","0.002","11.066","0.002","14.562","0.002","90","","90","","90","","1348.1","0.4","292","","292","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Phenylglycinium hydrogen squarate monohydrate","","- C12 H13 N O7 -","- C12 H13 N O7 -","- C48 H52 N4 O28 -","4","1","NA1238","Angelova, O.; Petrova, R.; Radomirska, V.; Kolev, T.","Crystalline Complexes Involving Amino Acids. II. (<i>R</i>)-({-})-1-Phenylglycinium Hydrogen Squarate Monohydrate","Acta Crystallographica Section C","1996","52","9","2218","2220","10.1107/S0108270196006452","","","0.71073","MoKα","","0.08","0.045","","0.081","0.057","","","","1.557","1.112","1.112","","","","","has coordinates","191095","2020-10-21","18:00:00",""
"2005412","8.925","0.004","23.48","0.012","8.049","0.003","90","","96.36","0.03","90","","1676.4","1.3","296","","296","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","trans-1,4-dimethyl-7,7-diphenylbicyclo[4.1.0]hepta-2,5-dione","","- C21 H20 O2 -","- C21 H20 O2 -","- C84 H80 O8 -","4","1","OA1000","Moriwaki, H.; Kawamoto, T.; Oshima, T.","Half-Chair Conformation of <i>trans</i>-1,4-Dimethyl-7,7-diphenylbicyclo[4.1.0]hepta-2,5-dione","Acta Crystallographica Section C","1996","52","9","2269","2271","10.1107/S0108270196003435","","","0.71073","MoKα","","","0.0699","","","0.0709","","","","","0.81","0.81","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005413","18.056","0.003","15.446","0.002","15.452","0.002","103.159","0.005","112.994","0.005","99.352","0.005","3707.8","0.9","293","2","293","2","","","","","","","","3","P 1","P 1","1","β-Cyclodextrin-nonanoic acid complex","cyclomaltoheptaose-nonanoic acid complex","","- C98.4 H216.6 O97.1 -","- C98.4 H92 O97.08 -","- C98.4 H92 O97.08 -","1","1","PA1218","Rontoyianni, A.; Mavridis, I. M.","β-Cyclodextrin Nonanoic Acid 1:1 Complex","Acta Crystallographica Section C","1996","52","9","2277","2281","10.1107/S0108270196002156","","","0.71069","MoKαNb-filtered","","0.127","0.0783","","0.2939","0.2069","","","","1.094","0.978","0.978","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005414","11.358","0.004","16.352","0.006","12.999","0.005","90","","101.56","0.01","90","","2365.3","1.5","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dibutyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","","- C23 H30 N2 O6 -","- C23 H30 N2 O6 -","- C92 H120 N8 O24 -","4","1","PA1223","Rowan, K. R.; Holt, E. M.","Dibutyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, Diisobutyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate and Di-<i>tert</i>-butyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section C","1996","52","9","2207","2212","10.1107/S0108270196003551","","","0.71073","MoKα","","0.1461","0.056","","0.1027","0.0612","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005415","9.715","0.001","10.932","0.001","12.501","0.001","99.29","0.01","97.27","0.01","116.35","0.01","1144.2","0.2","298","","298","","","","","","","","","4","P -1","-P 1","2","","Di-isobutyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","","- C23 H30 N2 O6 -","- C23 H30 N2 O6 -","- C46 H60 N4 O12 -","2","1","PA1223","Rowan, K. R.; Holt, E. M.","Dibutyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, Diisobutyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate and Di-<i>tert</i>-butyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section C","1996","52","9","2207","2212","10.1107/S0108270196003551","","","0.71073","MoKα","","0.0776","0.0574","","0.2092","0.1595","","","","1.047","1.113","1.113","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005416","11.142","0.001","16.803","0.002","13.384","0.001","90","","109.9","0.01","90","","2356.1","0.4","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Di-tertbutyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","","- C23 H30 N2 O6 -","- C23 H30 N2 O6 -","- C92 H120 N8 O24 -","4","1","PA1223","Rowan, K. R.; Holt, E. M.","Dibutyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, Diisobutyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate and Di-<i>tert</i>-butyl 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section C","1996","52","9","2207","2212","10.1107/S0108270196003551","","","0.71073","MoKα","","0.1042","0.0542","","0.1535","0.1209","","","","1.035","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005417","6.778","0.001","10.451","0.001","11.618","0.001","91.34","0.01","98.88","0.01","97.51","0.01","805.35","0.16","298","","298","","","","","","","","","5","P -1","-P 1","2","","(E)-3-[2-(4-chlorophenylsulfonyl) Ethenyl]-6-chloro-4H-1-benzopyran-4-one","","- C17 H10 Cl2 O4 S -","- C17 H10 Cl2 O4 S -","- C34 H20 Cl4 O8 S2 -","2","1","PA1224","Raju, K. V. N.; Krishnaiah, M.; Chen, Y.-S.; Rao, S. N.; Holt, E. M.","(<i>E</i>)-6-Chloro-3-[2-(4-chlorophenylsulfonyl)ethenyl]-4-chromanone, (<i>E</i>)-6-Bromo-3-[2-(4-bromophenylsulfonyl)ethenyl]-4-chromanone and (<i>E</i>)-3-[2-(4-Chlorophenylsulfonyl)ethenyl]-6-methoxy-4-chromanone","Acta Crystallographica Section C","1996","52","9","2212","2215","10.1107/S0108270196003563","","","0.71073","MoKα","","","0.0308","","","0.0429","","","","","1.14","1.14","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005418","6.761","0.001","10.719","0.001","11.744","0.001","91.2","0.01","99.1","0.01","97.71","0.01","832.02","0.17","298","","298","","","","","","","","","5","P -1","-P 1","2","","(E)-3-[2-(4-Bromophenylsulfonyl) ethenyl]-6-bromo-4H-1-benzopyran-4- one","","- C17 H10 Br2 O4 S -","- C17 H10 Br2 O4 S -","- C34 H20 Br4 O8 S2 -","2","1","PA1224","Raju, K. V. N.; Krishnaiah, M.; Chen, Y.-S.; Rao, S. N.; Holt, E. M.","(<i>E</i>)-6-Chloro-3-[2-(4-chlorophenylsulfonyl)ethenyl]-4-chromanone, (<i>E</i>)-6-Bromo-3-[2-(4-bromophenylsulfonyl)ethenyl]-4-chromanone and (<i>E</i>)-3-[2-(4-Chlorophenylsulfonyl)ethenyl]-6-methoxy-4-chromanone","Acta Crystallographica Section C","1996","52","9","2212","2215","10.1107/S0108270196003563","","","0.71073","MoKα","","","0.043","","","0.0484","","","","","1.18","1.18","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005419","39.053","0.013","6.7","0.002","13.471","0.005","90","","106.62","0.03","90","","3378","2","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(E)-3-[2-(4-chlorophenylsulfonyl) ethenyl]-6-methoxy-4H-1-benzopyran-4- one","","- C18 H13 Cl O5 S -","- C18 H13 Cl O5 S -","- C144 H104 Cl8 O40 S8 -","8","1","PA1224","Raju, K. V. N.; Krishnaiah, M.; Chen, Y.-S.; Rao, S. N.; Holt, E. M.","(<i>E</i>)-6-Chloro-3-[2-(4-chlorophenylsulfonyl)ethenyl]-4-chromanone, (<i>E</i>)-6-Bromo-3-[2-(4-bromophenylsulfonyl)ethenyl]-4-chromanone and (<i>E</i>)-3-[2-(4-Chlorophenylsulfonyl)ethenyl]-6-methoxy-4-chromanone","Acta Crystallographica Section C","1996","52","9","2212","2215","10.1107/S0108270196003563","","","0.71073","MoKα","","","0.0687","","","0.1612","","","","","1.14","1.14","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005421","14.907","0.007","10.506","0.004","12.518","0.003","90","","104.07","0.03","90","","1901.7","1.3","294","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 Br N3 S -","- C7 H8 Br N3 S -","- C56 H64 Br8 N24 S8 -","8","2","PT1014","Seth, S.; Biswas, A.; Banerjee, A.; Chattopadhyay, S. K.; Ghosh, S.","Biological Activity of 4-(4-Bromophenyl)thiosemicarbazide","Acta Crystallographica Section C","1996","52","9","2377","2379","10.1107/S0108270195011000","","","1.54182","CuKα","","","0.056","","","0.058","","","","","1.01","1.01","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005422","10.917","0.004","7.933","0.005","23.137","0.002","90","","99.93","0.01","90","","1973.8","1.5","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H17 Cl O3 -","- C25 H17 Cl O3 -","- C100 H68 Cl4 O12 -","4","1","PT1027","Murugesan, R.; Selladurai, S.; Subramaniam, K.; Velmurugan, D.; Hamilton, J. R.; Chen, Y.-S.; Schapiro, P. J.; Rao, S. N.","4-(4-Chlorophenyl)-2,6-diphenyl-(4<i>H</i>)-pyran-3,5-dicarbaldehyde","Acta Crystallographica Section C","1996","52","9","2318","2320","10.1107/S0108270196003204","","","1.54184","CuKα","","","0.064","","","0.065","","","","","1.265","1.265","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005423","9.553","0.009","19.2","0.03","18.607","0.018","90","","101.76","0.07","90","","3341","7","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H18 N2 O2 -","- C21 H18 N2 O2 -","- C168 H144 N16 O16 -","8","4","SK1003","Alcock, N. W.; Clase, H. J.; Willey, G. R.; Daly, L. T.","Packing of Four Independent Molecules: 1-Methyl-<i>N</i>,<i>N</i>'-bis(salicylidene)-2,4-phenylenediamine","Acta Crystallographica Section C","1996","52","9","2340","2343","10.1107/S0108270196002272","","","0.71073","MoKα","","0.2251","0.1058","","0.4","0.2846","","","","0.998","1.362","1.362","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2005424","7.671","0.001","20.414","0.002","8.326","0.002","90","","112.39","0.02","90","","1205.5","0.4","295","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C10 H14 N6 -","- C10 H14 N6 -","- C40 H56 N24 -","4","1","SK1005","Küçükbay, H.; Çetinkaya, E.; Ülkü, D.; Tahir, M. N.","(1<i>E</i>,3<i>Z</i>,5<i>E</i>)-2,5-Diaza-1,6-bis(dimethylamino)-1,3,5-hexatriene-3,4-dicarbonitrile","Acta Crystallographica Section C","1996","52","9","2271","2272","10.1107/S0108270196004453","","","0.71073","MoKα","","","0.045","","","0.043","","","","","0.76","0.76","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005425","7.7989","0.0004","8.066","0.0011","7.8631","0.001","90","","116.336","0.013","90","","443.3","0.1","180","2","180","2","","","","","","","","4","P 1 21 1","P 2yb","4","diisopropylammonium bromide","diisopropylammonium bromide","","- C6 H16 Br N -","- C6 H16 Br N -","- C12 H32 Br2 N2 -","2","1","SK1006","Kociok-Köhn, G.; Lungwitz, B.; Filippou, A. C.","Diisopropylammonium Bromide","Acta Crystallographica Section C","1996","52","9","2309","2311","10.1107/S010827019600354X","","","0.71073","MoKα","","0.0337","0.022","","0.0468","0.0436","","","","1.02","1.046","1.046","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005426","16.757","0.002","11.099","0.002","20.165","0.002","90","","110.73","0.01","90","","3507.6","0.9","211","2","211","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5-(1,3,5-Tri-tert.-butyl-4-hydroxybenzyl)-1,3,5,tri-tert.-butyl-2-oxo- bicyclo[4.1.0]hept-3-en","","- C38 H62 O2 -","- C38 H62 O2 -","- C152 H248 O8 -","4","1","SK1019","Rieker, A.; Neumayer, M.; Hiller, W.","1,3,5-Tri-<i>tert</i>-butyl-5-(1,3,5-tri-<i>tert</i>-butyl-4-oxo-2,5-cyclohexadienyl)methylbicyclo[4.1.0]hept-3-en-2-one, a Highly Hindered Propane","Acta Crystallographica Section C","1996","52","9","2351","2353","10.1107/S0108270196004465","","","0.71073","MoKα","","0.0923","0.0451","","0.1137","0.094","","","","1.011","1.059","1.059","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005427","11.4291","0.0008","13.6877","0.0009","15.488","0.001","89.588","0.002","84.336","0.002","68.014","0.002","2234.6","0.3","294","1","","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H60 I22 N8 O4 Sb6 -","- C32 I22 N8 O4 Sb6 -","- C32 I22 N8 O4 Sb6 -","1","0.5","SZ1036","Smyth, M. V.; Bailey, R. D.; Pennington, W. T.","Tetrakis(2,3,5,6-tetramethylpyrazinium) Tetra-μ~3~-iodo-hexa-μ-iodo-dodecaiodohexaantimonate(4‒) Tetrahydrate","Acta Crystallographica Section C","1996","52","9","2170","2173","10.1107/S0108270196006038","","","0.71073","MoKα","","","0.0633","","","0.0809","","","","","2.54","2.54","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005428","9.897","0.002","13.746","0.002","10.436","0.002","90","","99.81","0.02","90","","1399","0.4","294","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H48 Fe N6 P4 -","- C20 H48 Fe N6 P4 -","- C40 H96 Fe2 N12 P8 -","2","0.5","TA1025","Field, L. D.; George, A. V.; Pike, S. R.; Buys, I. E.; Hambley, T. W.","<i>trans</i>-Diazidobis[1,2-bis(diethylphosphino)ethane-<i>P</i>,<i>P</i>']iron(II)","Acta Crystallographica Section C","1996","52","9","2164","2166","10.1107/S0108270195008882","","","0.7109","MoKα","","","0.05","","","0.058","","","","","2.26","2.26","","","","","has coordinates,has disorder","199470","2020-10-21","18:00:00",""
"2005429","7.238","0.002","8.881","0.002","6.14","0.001","99.81","0.02","112.84","0.02","99.81","0.02","346.05","0.16","293.2","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C10 H6 Co N6 Na O8 -","- C10 H6 Co N6 Na O8 -","- C10 H6 Co N6 Na O8 -","1","0.5","TA1045","Sharma, R. P.; Bhasin, K. K.; Tiekink, E. R. T.","Sodium Dinitritobis(pyrazine-2-carboxylato-<i>N</i>,<i>O</i>)cobaltate(III)","Acta Crystallographica Section C","1996","52","9","2140","2141","10.1107/S0108270195009322","","","0.7107","MoKα","","0.0339","0.0339","","0.0263","0.0283","","","","1.791","1.791","1.791","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005430","10.941","0.003","17.658","0.005","13.516","0.002","90","","110.4","0.02","90","","2447.5","1.1","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H21 Cl3 N2 Sn -","- C25 H21 Cl3 N2 Sn -","- C100 H84 Cl12 N8 Sn4 -","4","1","TA1046","Hall, V. J.; Tiekink, E. R. T.","Benzyltrichloro(1,10-phenanthroline-<i>N</i>,<i>N</i>')tin(IV) Benzene Solvate (1/1)","Acta Crystallographica Section C","1996","52","9","2141","2143","10.1107/S0108270195009334","","","0.7107","MoKα","","0.0849","0.04","","0.0371","0.034","","","","1.556","1.753","1.753","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005431","7.765","0.005","13.805","0.002","10.292","0.003","90","","105.1","0.03","90","","1065.2","0.8","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H30 Cl4 N2 Sn -","- C12 H30 Cl4 N2 Sn -","- C24 H60 Cl8 N4 Sn2 -","2","0.5","TA1047","Hall, V. J.; Tiekink, E. R. T.","Bis(diethylammonium) Tetrachlorodivinylstannate(IV)","Acta Crystallographica Section C","1996","52","9","2143","2145","10.1107/S0108270195009346","","","0.7107","MoKalpha","","0.153","0.0465","","0.043","0.0362","","","","1.46","1.839","1.839","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005432","10.114","0.003","11.289","0.004","21.103","0.009","90","","90","","90","","2409.5","1.5","293","1","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H38 O8 -","- C25 H38 O8 -","- C100 H152 O32 -","4","1","TA1076","Chen, H.; Tan, R.; Liu, Z.; Liu, J.; Chen, M.","Lupulin D","Acta Crystallographica Section C","1996","52","9","2229","2231","10.1107/S0108270196004829","","","0.71073","MoKα","","","0.039","","","0.037","","","","","0.841","0.841","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005433","5.224","0.001","5.096","0.001","31.006","0.006","90","","94.53","0.03","90","","822.8","0.3","296","0.1","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-hexamethylenebis(3-pyridinecarboxamide)","","- C18 H22 N4 O2 -","- C18 H22 N4 O2 -","- C36 H44 N8 O4 -","2","0.5","TA1081","Liu, Q.; Zhang, S.-W.; Wei, Y. G.; Shao, M.-C.","Anticancer and Antifertility Agents. II. <i>N</i>,<i>N</i>'-Hexamethylenebis(3-pyridinecarboxamide)","Acta Crystallographica Section C","1996","52","9","2260","2261","10.1107/S0108270196005045","","","0.71073","MoKα","","0.0691","0.0411","","0.0874","0.0639","","","","","1.62","1.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005434","4.47","0.002","17.568","0.002","10.183","0.002","90","","97.84","0.02","90","","792.2","0.4","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 Cl N O3 -","- C7 H8 Cl N O3 -","- C28 H32 Cl4 N4 O12 -","4","1","TA1084","Okabe, N.; Shimosaki, A.; Miura, J.","3-Hydroxyanthranilic Acid Hydrochloride","Acta Crystallographica Section C","1996","52","9","2345","2347","10.1107/S0108270196003368","","","0.71069","MoKα","","","0.054","","","0.056","","","","","1.58","1.58","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2005435","10.599","0.001","3.775","0.001","26.517","0.003","90","","95.17","0.01","90","","1056.7","0.3","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H18 N2 O2 -","- C34 H18 N2 O4 -","- C68 H36 N4 O8 -","2","0.5","TA1086","Mizuguchi, J.","5,15-Diaza-6,16-dihydroxytetrabenzo[<i>b</i>,<i>e</i>,<i>k</i>,<i>n</i>]perylene","Acta Crystallographica Section C","1996","52","9","2315","2317","10.1107/S0108270196004271","","","0.71073","MoKα","","","0.058","","","0.065","","","","","1.212","1.212","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005436","7.085","0.001","9.836","0.001","10.704","0.001","102.95","0.01","95.58","0.01","98.54","0.01","712.29","0.15","293","","","","","","","","","","","3","P -1","-P 1","2","","","","- C16 H18 O4 -","- C16 H18 O4 -","- C32 H36 O8 -","2","1","VJ1039","Rajnikant; Gupta, V. K.; Singh, A.; Lal, M.; Varghese, B.","Coumurrayin","Acta Crystallographica Section C","1996","52","9","2272","2274","10.1107/S0108270196004209","","","0.71073","MoKα","","","0.05","","","0.144","","","","","0.9","0.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005437","12.383","0.002","11.802","0.003","11.373","0.005","90","","94.57","0.03","90","","1656.8","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diacetatobis(pyridine)palladium(II) Hydrate","","- C14 H18 N2 O5 Pd -","- C14 H18 N2 O5 Pd -","- C56 H72 N8 O20 Pd4 -","4","0.5","VS1019","Kravtsova, S. V.; Romm, I. P.; Stash, A. I.; Belsky, V. K.","Bis(acetato-<i>O</i>)bis(pyridine-<i>N</i>)palladium(II) Monohydrate and Bis(acetato-<i>O</i>)bis(diethylamine-<i>N</i>)palladium(II)","Acta Crystallographica Section C","1996","52","9","2201","2204","10.1107/S0108270196005732","","","0.71069","MoKα","","0.0269","0.0269","","0.0499","0.0499","","","","1.093","1.093","1.093","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005438","8.089","0.001","7.173","0.001","8.48","0.001","88.7","0.01","65.76","0.01","80.8","0.01","442.37","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diacetatobis(diethylamine)palladium(II)","","- C12 H28 N2 O4 Pd -","- C12 H28 N2 O4 Pd -","- C12 H28 N2 O4 Pd -","1","0.5","VS1019","Kravtsova, S. V.; Romm, I. P.; Stash, A. I.; Belsky, V. K.","Bis(acetato-<i>O</i>)bis(pyridine-<i>N</i>)palladium(II) Monohydrate and Bis(acetato-<i>O</i>)bis(diethylamine-<i>N</i>)palladium(II)","Acta Crystallographica Section C","1996","52","9","2201","2204","10.1107/S0108270196005732","","","0.71069","MoKα","","0.0188","0.0188","","0.048","0.048","","","","1.08","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005439","28.787","0.004","8.619","0.003","11.623","0.005","90","","95.64","0.02","90","","2869.9","1.6","298","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H16 N Na O7 S -","- C10 H16 N Na O7 S -","- C80 H128 N8 Na8 O56 S8 -","8","1","AB1205","Wang, J.-L.; Li, G.-P.; Zhang, L.-J.; Li, B.; Ma, S.-K.; Niu, Z.-C.; Miao, F.-M.","Sodium 1-Naphthylamine-6-sulfonate‒Water (1/4)","Acta Crystallographica Section C","1996","52","10","2476","2477","10.1107/S0108270195004987","","","0.71073","MoKα","","","0.05","","","0.058","","","","","0.815","0.815","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005440","10.71","0.001","16.485","0.002","9.124","0.001","90","","113.59","0.01","90","","1476.3","0.3","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H13 Cl O -","- C19 H13 Cl O -","- C76 H52 Cl4 O4 -","4","1","AB1316","Kumaran, D.; Eswaramoorthy, S.; Ponnuswamy, M. N.; Raju, K. S.; Nanjundan, S.","3-(2-Chlorophenyl)-1-(2-naphthyl)-2-propen-1-one","Acta Crystallographica Section C","1996","52","10","2543","2545","10.1107/S0108270195016490","","","1.5418","CuKα","","","0.055","","","0.076","","","","","1.3","1.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005441","16.531","0.004","13.224","0.002","22.633","0.002","90","","87.85","0.02","90","","4944.2","1.5","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 Ti -","- C22 H17.6667 Ti -","- C264 H212 Ti12 -","12","3","AB1327","Zhu, Y.; Shen, X.-M.","2,2'-Biphenylbis(η-cyclopentadienyl)titanium","Acta Crystallographica Section C","1996","52","10","2422","2425","10.1107/S0108270196001011","","","1.54184","CuKα","","","0.071","","","0.075","","","","","2.49","2.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005442","10.589","0.003","9.396","0.002","21.132","0.005","90","0.02","93.24","0.02","90","0.02","2099.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Tris(2-hydroxyethyl)ammonium (2,6-dichlorophenyl)amino-phenylacetate (HTEA.D)","","- C20 H26 Cl2 N2 O5 -","- C20 H26 Cl2 N2 O5 -","- C80 H104 Cl8 N8 O20 -","4","1","AB1345","Castellari, C.; Ottani, S.","Diclofenac Salts. IV. Tris(2-hydroxyethyl)ammonium 2-(2,6-Dichlorophenylamino)phenylacetate","Acta Crystallographica Section C","1996","52","10","2619","2622","10.1107/S0108270196006300","","","0.71069","MoKα","","0.1955","0.0464","","0.1006","0.0698","","","","0.955","1.133","1.133","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2005443","11.559","0.002","11.559","0.002","21.783","0.004","90","","90","","120","","2520.5","0.8","293","2","293","2","","","","","","","","3","R 3 2 :H","R 3 2""","155","","Perchlorotriphenylcarbonium hexachloroantimonate(V)","","- C19 Cl21 Sb -","- C19 Cl21.008 Sb -","- C57 Cl63.024 Sb3 -","3","0.166667","AB1351","Molins, E.; Mas, M.; Maniukiewicz, W.; Ballester, M.; Castañer, J.","Perchlorotriphenylcarbenium Hexachloroantimonate(V)","Acta Crystallographica Section C","1996","52","10","2412","2414","10.1107/S0108270196007287","","","0.71073","MoKα","","0.049","0.0438","","0.1379","0.1322","","","","1.026","1.025","1.025","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005444","13.273","0.003","9.692","0.002","38.608","0.008","90","","99.19","0.03","90","","4902.9","1.9","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","di(ciprofloxacinium) hexaaquamagnesium(II) bis(sulfate) hexahydrate","","- C34 H62 F2 Mg N6 O26 S2 -","- C34 H62 F2 Mg N6 O26 S2 -","- C136 H248 F8 Mg4 N24 O104 S8 -","4","0.5","AB1358","Turel, I.; Leban, I.; Zupancic, M.; Bukovec, P.; Gruber, K.","An Adduct of Magnesium Sulfate with a Member of the Quinolone Family (Ciprofloxacin)","Acta Crystallographica Section C","1996","52","10","2443","2445","10.1107/S0108270196005343","","","0.71073","MoKα","","0.1325","0.06","","0.1695","0.1172","","","","1.048","1.091","1.091","","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2005445","5.766","0.001","7.46","0.001","7.267","0.003","90","","92.45","0.03","90","","312.3","0.15","293","","293","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C3 H9 Br S -","- C3 H9 Br S -","- C6 H18 Br2 S2 -","2","0.5","AB1364","Svensson, P. H.; Kloo, L.","Trimethylsulfonium Bromide","Acta Crystallographica Section C","1996","52","10","2580","2581","10.1107/S0108270196006610","","","0.71069","MoKα","","","0.025","","","0.026","","","","","1.54","1.54","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005446","11.8328","0.0016","7.5583","0.0014","12.387","0.003","90","","90","","90","","1107.8","0.4","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Compound 5","4-methylpyridazin-3(2H)-one","","- C5 H6 N2 O -","- C5 H6 N2 O -","- C40 H48 N16 O8 -","8","1","AB1367","Blake, A. J.; McNab, H.","Four Simple Pyridazin-3(2<i>H</i>)-ones","Acta Crystallographica Section C","1996","52","10","2622","2627","10.1107/S0108270196005355","","","0.71073","MoKα","","0.207","0.0566","","0.1738","0.1085","","","","0.933","1.075","1.075","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005447","6.903","0.002","6.302","0.002","14.406","0.003","90","","92.12","0.03","90","","626.3","0.3","150","0.2","150","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Compound 6.H~2~O","5-methylpyridazin-3(2H)-one monohydrate","","- C5 H8 N2 O2 -","- C5 H8 N2 O2 -","- C20 H32 N8 O8 -","4","1","AB1367","Blake, A. J.; McNab, H.","Four Simple Pyridazin-3(2<i>H</i>)-ones","Acta Crystallographica Section C","1996","52","10","2622","2627","10.1107/S0108270196005355","","","0.71073","MoKα","","0.0533","0.0412","","0.1162","0.1054","","","","1.061","1.099","1.099","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005448","6.325","0.002","6.322","0.003","15.597","0.004","90","","90","","90","","623.7","0.4","150","0.2","150","0.2","","","","","","","","4","P n m a","-P 2ac 2n","62","Compound 7.H~2~O","6-methylpyridazin-3(2H)-one monohydrate","","- C5 H8 N2 O2 -","- C5 H8 N2 O2 -","- C20 H32 N8 O8 -","4","0.5","AB1367","Blake, A. J.; McNab, H.","Four Simple Pyridazin-3(2<i>H</i>)-ones","Acta Crystallographica Section C","1996","52","10","2622","2627","10.1107/S0108270196005355","","","0.71073","MoKα","","0.0825","0.0481","","0.1529","0.1229","","","","1.035","1.074","1.074","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005449","5.7","0.004","26.428","0.018","6.712","0.005","90","","110.94","0.07","90","","944.3","1.2","150","0.2","150","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Compound 8","2-(p-tolyl)pyridazin-3(2H)-one","","- C11 H10 N2 O -","- C11 H10 N2 O -","- C44 H40 N8 O4 -","4","1","AB1367","Blake, A. J.; McNab, H.","Four Simple Pyridazin-3(2<i>H</i>)-ones","Acta Crystallographica Section C","1996","52","10","2622","2627","10.1107/S0108270196005355","","","0.71073","MoKα","","0.0949","0.0538","","0.2555","0.1336","","","","1.06","1.081","1.081","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005450","10.006","0.001","14.876","0.001","11.34","0.001","90","","102.93","0.01","90","","1645.2","0.3","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H38 Cu N4 O6 -","- C34 H38 Cu N4 O6 -","- C68 H76 Cu2 N8 O12 -","2","0.5","AB1371","Hökelek, T.; Gündüz, H.; Necefouglu, H.","<i>trans</i>-Bis(benzoato-<i>O</i>,<i>O</i>')bis(<i>N</i>,<i>N</i>-diethylnicotinamide-<i>N</i>^1^)copper(II)","Acta Crystallographica Section C","1996","52","10","2470","2473","10.1107/S0108270196006312","","","0.71073","MoKα","","","0.0427","","","0.0448","","","","","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005451","12.96","0.002","17.444","0.003","8.068","0.002","90","","90","","90","","1824","0.6","173","1","173","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(1S*,3S*,4R*,7S*,8S*,12S*,13S*)-7-isocyanocycloamphilect- 11(20)-ene","","","- C21 H31 N -","- C21 H31 N -","- C84 H124 N4 -","4","1","AB1372","Linden, A.; König, G. M.; Wright, A. D.","Four Diterpene Isonitriles from the Sponge <i>Cymbastela hooperi</i>","Acta Crystallographica Section C","1996","52","10","2601","2607","10.1107/S010827019600515X","","","0.71069","MoKα","","0.0769","0.0466","","0.0436","0.041","","","","","1.706","1.706","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005452","14.319","0.002","17.591","0.004","7.145","0.002","90","","90","","90","","1799.7","0.7","173","1","173","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(1S*,3S*,4R*,7S*,8S*,11R*,12R*,13S*,20S*)-7- isocyanoisocycloamphilect-14-ene","","","- C21 H31 N -","- C21 H31 N -","- C84 H124 N4 -","4","1","AB1372","Linden, A.; König, G. M.; Wright, A. D.","Four Diterpene Isonitriles from the Sponge <i>Cymbastela hooperi</i>","Acta Crystallographica Section C","1996","52","10","2601","2607","10.1107/S010827019600515X","","","0.71069","MoKα","","0.1233","0.0564","","0.0469","0.0431","","","","","2.091","2.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005453","9.502","0.001","9.942","0.001","9.841","0.002","90","","106.6","0.01","90","","890.9","0.2","173","1","173","1","","","","","","","","3","P 1 21 1","P 2yb","4","(1S*,3S*,4R*,7S*,8S*,12S*,13S*)-7-isocyanoamphilecta- 11(20),15-diene","","","- C21 H31 N -","- C21 H31 N -","- C42 H62 N2 -","2","1","AB1372","Linden, A.; König, G. M.; Wright, A. D.","Four Diterpene Isonitriles from the Sponge <i>Cymbastela hooperi</i>","Acta Crystallographica Section C","1996","52","10","2601","2607","10.1107/S010827019600515X","","","0.71069","MoKα","","0.0505","0.0393","","0.0383","0.0374","","","","","2.008","2.008","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005454","20.38","0.006","32.683","0.009","8.37","0.007","90","","90","","90","","5575","5","173","1","173","1","","","","","","","","3","P 21 21 2","P 2 2ab","18","(1R*,3S*,4R*,7S*,8S*,13R*)-7-isocyanoamphilecta-11,14-diene","","","- C21 H31 N -","- C21 H31 N -","- C252 H372 N12 -","12","3","AB1372","Linden, A.; König, G. M.; Wright, A. D.","Four Diterpene Isonitriles from the Sponge <i>Cymbastela hooperi</i>","Acta Crystallographica Section C","1996","52","10","2601","2607","10.1107/S010827019600515X","","","0.71069","MoKα","","0.1569","0.0573","","0.0538","0.0459","","","","","1.711","1.711","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005455","10.6038","0.0011","10.4252","0.0011","10.8255","0.0012","90","","118.675","0.002","90","","1050","0.2","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(μ~2~-pinacolato-O,O')-bis(pinacolato-O,O')-diboron","","- C18 H36 B2 O6 -","- C18 H36 B2 O6 -","- C36 H72 B4 O12 -","2","0.5","AB1397","Clegg, W.; Scott, A. J.; Dai, C.; Lesley, G.; Marder, T. B.; Norman, N. C.; Farrugia, L. J.","(μ~2~-Pinacolato-<i>O</i>,<i>O</i>')-bis(pinacolato-<i>O</i>,<i>O</i>')diboron","Acta Crystallographica Section C","1996","52","10","2545","2547","10.1107/S0108270196008177","","","0.71073","MoKα","","0.0587","0.0471","","0.1064","0.0983","","","","1.133","1.146","1.146","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005456","16.535","0.005","3.8939","0.001","19.89","0.005","90","","111.87","0.008","90","","1188.5","0.6","160","2","160","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","m-nitro-N-(p-methoxybenzylidene)aniline","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C56 H48 N8 O12 -","4","1","AB1402","Clegg, W.; Elsegood, M. R. J.; Heath, S. L.; Houlton, A.; Shipman, M. A.","Conformational Flexibility in <i>N</i>-Benzylideneanilines","Acta Crystallographica Section C","1996","52","10","2548","2552","10.1107/S0108270196009225","","","0.71073","MoKα","","0.0932","0.0715","","0.1765","0.1674","","","","1.221","1.354","1.354","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005457","11.4508","0.001","7.3793","0.0007","29.047","0.003","90","0.002","99.642","0.002","90","0.002","2419.8","0.4","160","2","160","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","p-nitro-N-(p-methoxybenzylidene)aniline","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C112 H96 N16 O24 -","8","2","AB1402","Clegg, W.; Elsegood, M. R. J.; Heath, S. L.; Houlton, A.; Shipman, M. A.","Conformational Flexibility in <i>N</i>-Benzylideneanilines","Acta Crystallographica Section C","1996","52","10","2548","2552","10.1107/S0108270196009225","","","0.71073","MoKα","","0.056","0.0386","","0.1061","0.0937","","","","1.063","1.077","1.077","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005458","25.559","0.002","7.0926","0.0007","22.138","0.002","90","","110.792","0.008","90","","3751.8","0.6","294","1","294","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,4'-Dihydroxybenzophenone‒4,4'-Bipyridyl (1/1)","","- C23 H18 N2 O3 -","- C23 H18 N2 O3 -","- C184 H144 N16 O24 -","8","1","AB1404","Coupar, P. I.; Ferguson, G.; Glidewell, C.","Hydrogen-Bonded Chains in 4,4'-Dihydroxybenzophenone‒4,4'-Bipyridyl (1/1) and Chains of Rings in 1,3,5-Trihydroxybenzene‒4,4'-Bipyridyl (2/3)","Acta Crystallographica Section C","1996","52","10","2524","2528","10.1107/S0108270196008669","","","0.7107","MolybdenumKα","","0.1775","0.0706","","0.1513","0.1251","","","","0.951","1.273","1.273","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005459","16.716","0.005","13.765","0.005","17.782","0.003","90","","117.18","0.02","90","","3639.8","1.9","294","1","294","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","1,3,5-Trihydroxybenzene‒4,4'-Bipyridyl (2/3)","","- C42 H36 N6 O6 -","- C42 H36 N6 O6 -","- C168 H144 N24 O24 -","4","1","AB1404","Coupar, P. I.; Ferguson, G.; Glidewell, C.","Hydrogen-Bonded Chains in 4,4'-Dihydroxybenzophenone‒4,4'-Bipyridyl (1/1) and Chains of Rings in 1,3,5-Trihydroxybenzene‒4,4'-Bipyridyl (2/3)","Acta Crystallographica Section C","1996","52","10","2524","2528","10.1107/S0108270196008669","","","0.7107","MolybdenumKα","","0.2379","0.0769","","0.1875","0.1428","","","","0.905","1.486","1.486","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005460","15.048","0.002","19.295","0.003","8.1684","0.001","90","","90","","90","","2371.7","0.6","294","1","294","1","","","","","","","","4","A b a 2","A 2 -2ab","41","","4,4'-Sulfonyldiphenol","","- C12 H10 O4 S -","- C12 H10 O4 S -","- C96 H80 O32 S8 -","8","","AB1406","Glidewell, C.; Ferguson, G.","Interpenetrating Square Nets in the Hydrogen-Bonded Structure of 4,4'-Sulfonyldiphenol","Acta Crystallographica Section C","1996","52","10","2528","2530","10.1107/S0108270196009316","","","0.7107","MolybdenumKα","","0.1579","0.0468","","0.0874","0.0722","","","","0.905","1.294","1.294","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005461","11.447","0.001","12.989","0.001","24.881","0.001","90","","90","","90","","3699.4","0.5","294","","","","","","","","","","","5","P b c n","","","","","","- C20 H24 N2 O3 S -","- C20 H24 N2 O3 S -","- C160 H192 N16 O24 S8 -","8","1","BK1153","Kumaradhas, P.; Nirmala, K. A.; Sridhar, M. A.","<i>cis</i>-(±)-5-[2-(Dimethylamino)ethyl]-3-hydroxy-2-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-one","Acta Crystallographica Section C","1996","52","10","2595","2597","10.1107/S0108270196005070","","","0.7093","MoKα","","","0.0486","","","0.1087","","","","","1.205","1.205","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005462","9.0882","0.0008","12.7583","0.0014","15.5461","0.0013","90","","104.725","0.007","90","","1743.4","0.3","163","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H23 B O -","- C22 H23 B O -","- C88 H92 B4 O4 -","4","1","BK1195","Evans, W. J.; Shreeve, J. L.; Ziller, J. W.","Triphenyl(tetrahydrofuranyl)boron","Acta Crystallographica Section C","1996","52","10","2571","2573","10.1107/S0108270196006683","","","0.71073","MoKα","","","0.063","","","0.067","","","","","1.31","1.31","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005463","11.49","0.002","11.49","0.002","30.906","0.003","90","","90","","90","","4080.2","1.1","153.2","","153.2","","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C30 H32 Cd F10 N6 Nb2 O2 -","- C32 H32 Cd F10 N8 Nb2 O2 -","- C128 H128 Cd4 F40 N32 Nb8 O8 -","4","0.25","BK1219","Halasyamani, P.; Willis, M. J.; Heier, K. R.; Stern, C. L.; Poeppelmeier, K. R.","[pyH^+^]~2~[CdNb~2~(py)~4~O~2~F~10~]^2{-^}","Acta Crystallographica Section C","1996","52","10","2491","2493","10.1107/S0108270196007573","","","0.7107","MoKα","","","0.0245","","","0.0289","","","","","2.35","2.35","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005464","10.2743","0.0001","9.6211","0.0002","17.3827","0.0004","90","","94.95","0.001","90","","1711.87","0.06","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 3-(9-anthryl)-5-methyl-4-isoxazolecarboxylate","","- C21 H17 N O3 -","- C21 H17 N O3 -","- C84 H68 N4 O12 -","4","1","BK1222","Mosher, M. D.; Natale, N. R.; Vij, A.","An Intercalating Isoxazole","Acta Crystallographica Section C","1996","52","10","2513","2515","10.1107/S0108270196005082","","","0.71073","MoKα","","0.0498","0.047","","0.111","0.1094","","","","1.2","1.222","1.222","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005465","9.615","0.002","4.909","0.001","21.126","0.004","90","","99.02","0.03","90","","984.8","0.4","198","2","198","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","catena-poly[μ-(difluorophosphato-O:O')bis{silver-μ- (4,4'-dicyanodiphenylacetylene-N:N')}]","","- C16 H8 Ag2 F4 N2 O4 P2 -","- C16 H8 Ag2 F4 N2 O4 P2 -","- C32 H16 Ag4 F8 N4 O8 P4 -","2","0.5","BK1228","Hirsch, K. A.; Wilson, S. R.; Moore, J. S.","A Silver(I) Complex of 4,4'-Dicyanodiphenylacetylene with a Difluorophosphate (PO~2~F~2~^{-^}) Counterion","Acta Crystallographica Section C","1996","52","10","2419","2422","10.1107/S0108270196005173","","","0.71073","MoKα","","0.0403","0.03","","0.078","0.0726","","","","1.05","1.089","1.089","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005466","25.483","0.004","8.0133","0.0019","15.339","0.004","90","","121.581","0.014","90","","2668.4","1.1","297","","297","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C27 H48 O6 -","- C28 H42 O6 -","- C112 H168 O24 -","4","1","BK1233","Wahle, M. C.; Byrn, S. R.","3α,7α,12α-Trihydroxy-5β-cholan-24-oic Acid Methyl Ester Ethanolate (Methyl Cholate Ethanolate)","Acta Crystallographica Section C","1996","52","10","2500","2502","10.1107/S0108270196005161","","","1.54184","Cu-Kα","","0.088","0.062","","0.19","0.19","","","","1.101","1.101","1.101","","","","","has coordinates","198472","2020-10-21","18:00:00",""
"2005467","7.793","0.006","15.72","0.009","20.514","0.012","90","","90","","90","","2513","3","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Sodium 3α,7α,12α-Trihydroxy-5β-cholan-24-oate Methanolate","","- C25 H43 Na O6 -","- C25 H43 Na O6 -","- C100 H172 Na4 O24 -","4","1","BK1236","Wahle, M. C.; Byrn, S. R.","Sodium Cholate Methanolate and Sodium Cholate 2-Propanolate","Acta Crystallographica Section C","1996","52","10","2495","2499","10.1107/S0108270196006506","","","0.71073","MoKα","","0.099","0.068","","0.156","0.156","","","","1.045","1.045","1.045","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005468","10.466","0.002","7.6364","0.0019","17.197","0.002","90","","90.37","0.012","90","","1374.4","0.5","295","","295","","","","","","","","","4","P 1 21 1","P 2yb","4","","Sodium 3α,7α,12α-Trihydroxy-5β-cholan-24-oate 2-Propanolate","","- C27 H47 Na O6 -","- C27 H47 Na O6 -","- C54 H94 Na2 O12 -","2","1","BK1236","Wahle, M. C.; Byrn, S. R.","Sodium Cholate Methanolate and Sodium Cholate 2-Propanolate","Acta Crystallographica Section C","1996","52","10","2495","2499","10.1107/S0108270196006506","","","1.54184","CuKα","","0.205","0.063","","0.205","0.134","","","","1.088","1.216","1.216","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005469","9.8583","0.0003","10.7631","0.0001","11.3841","0.0003","64.636","0.002","84.154","0.002","83.762","0.002","1082.96","0.05","198","2","198","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H31 N O3 -","- C26 H31 N O3 -","- C52 H62 N2 O6 -","2","1","BK1243","Dixon, J. A.; Swiss, K. A.; Denmark, S. E.","<i>rel</i>-(1<i>R</i>,6<i>S</i>,7<i>S</i>,8<i>R</i>,9<i>S</i>)-9-Methyl-8-phenyl-6-[(1<i>S</i>,2<i>R</i>)-(2-phenylcyclohexyl)oxy]-4-aza-3,5-dioxatricyclo[5.2.1.0^4,9^]decane","Acta Crystallographica Section C","1996","52","10","2561","2563","10.1107/S0108270196006671","","","0.71073","MoKα","","0.1001","0.049","","0.126","0.1011","","","","1.03","1.084","1.084","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005470","33.749","0.004","4.459","0.003","28.151","0.003","90","","98.59","0.01","90","","4189","3","296","","296","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","fluorene-9-carboxylic acid","","","- C14 H10 O2 -","- C14 H10 O2 -","- C224 H160 O32 -","16","2","BK1245","Blackburn, A. C.; Dobson, A. J.; Gerkin, R. E.","Fluorene-9-carboxylic Acid","Acta Crystallographica Section C","1996","52","10","2638","2641","10.1107/S0108270196006269","","","0.71073","MoKα","","","0.04","","","0.05","","","","","1.64","1.64","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005471","18.494","0.008","9.857","0.003","20.886","0.008","90","","100.83","0.03","90","","3740","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichloro-bis(diphenylmethylphosphine)- (η^2^-3,3-diphenylcyclopropene)-oxo-tungsten","","- C41 H38 Cl2 O P2 W -","- C41 H38 Cl2 O P2 W -","- C164 H152 Cl8 O4 P8 W4 -","4","1","BK1246","Day, M. W.; Wilhelm, T. E.; Grubbs, R. H.","A Diphenylcyclopropene Complex of Tungsten, [WCl~2~O(PMePh~2~)~2~(η^2^-3,3-diphenylcyclopropene)], Precursor to a Tungsten‒Oxo‒Olefin Metathesis Catalyst","Acta Crystallographica Section C","1996","52","10","2460","2462","10.1107/S0108270196006464","","","0.71073","MoKα","","0.0658","0.036","","0.0765","0.062","","","","1.502","1.47","1.47","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005472","9.5","0.002","10.031","0.003","4.91","0.002","90","","97.4","0.02","90","","464","0.3","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C6 H8 Cl2 N4 -","- C6 H8 Cl2 N4 -","- C12 H16 Cl4 N8 -","2","0.25","BK1258","Bélanger, S.; Beauchamp, A. L.","2,2'-Bi(1<i>H</i>-imidazolium) Dichloride","Acta Crystallographica Section C","1996","52","10","2588","2590","10.1107/S0108270196008098","","","1.54056","CopperKα","","0.0439","0.043","","0.109","0.1084","","","","1.12","1.146","1.146","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005473","4.837","0.001","13.296","0.001","18.24","0.001","90","","90","","90","","1173.1","0.3","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H12 F2 N2 O4 -","- C10 H12 F2 N2 O4 -","- C40 H48 F8 N8 O16 -","4","1","BM1043","Das, A. K.; Mukhopadhyay, A.; Das, N.; Mazumdar, S. K.; Bertolasi, V.; Van Aerschot, A.","3'-Deoxy-2',3'-difluorothymidine, a Nucleoside Analogue","Acta Crystallographica Section C","1996","52","10","2615","2616","10.1107/S010827019600282X","","","0.71073","MoKα","","","0.037","","","0.042","","","","","1.428","1.428","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005474","8.469","0.008","13.474","0.008","11.256","0.009","90","","106.29","0.06","90","","1232.9","1.7","153","","153","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 N2 O2 S -","- C12 H16 N2 O2 S -","- C48 H64 N8 O8 S4 -","4","1","BM1075","Fortes, A. G.; Johnstone, R. A. W.; Mahmood, S.","<i>N</i>-(1-Methyl-2-pyrrolidinylidene)-<i>p</i>-toluenesulfonamide: a Condensation Product of 4-Methylphenylsulfonyl Isocyanate and 1-Methyl-2-pyrrolidone","Acta Crystallographica Section C","1996","52","10","2569","2570","10.1107/S0108270196006750","","","0.71073","MoKα","","","0.0549","","","0.0579","","","","","1.977","1.977","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005475","7.4346","0.001","15.8698","0.001","12.559","0.001","90","","96.91","0.01","90","","1471","0.2","293","","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","trans-[bis(dimethylamino)bis(1-methylcytosine) platinum(II)]bis(tetrachlorothallate(III))","","- C12 H24 Cl8 N8 O2 Pt Tl2 -","- C12 H24 Cl8 N8 O2 Pt Tl2 -","- C24 H48 Cl16 N16 O4 Pt2 Tl4 -","2","0.5","BM1076","Zangrando, E.; Randaccio, L.; Pichierri, F.; Lippert, B.; Holthenrich, D.","<i>trans</i>-Bis(methylamine-<i>N</i>)bis(1-methylcytosine-<i>N</i>^3^)platinum(II) Bis[tetrachlorothallate(III)]","Acta Crystallographica Section C","1996","52","10","2468","2470","10.1107/S010827019600683X","","","0.71073","MoKα","","0.0978","0.0351","","","0.0384","","","","","1.08","1.08","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2005476","6.768","0.012","10.675","0.014","12.384","0.012","81.37","0.05","77.01","0.05","74.77","0.12","837","2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","Maleimide","","","- C4 H3 N O2 -","- C4 H3 N O2 -","- C32 H24 N8 O16 -","8","4","BM1088","Cox, P. J.; Parker, S. F.","Maleimide","Acta Crystallographica Section C","1996","52","10","2578","2580","10.1107/S0108270196006841","","","0.71073","MoKα","","0.1407","0.063","","0.1715","0.1398","","","","0.764","1.123","1.123","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005477","9.2065","0.0004","11.1298","0.0009","20.0264","0.0008","90","","90","","90","","2052","0.2","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- La Mo8 O14 -","- La Mo8 O14 -","- La8 Mo64 O112 -","8","1","BR1140","Kerihuel, G.; Tortelier, J.; Gougeon, P.","LaMo~8~O~14~","Acta Crystallographica Section C","1996","52","10","2389","2393","10.1107/S010827019600532X","","","0.71073","MoKα","","0.0562","0.0365","","0.0816","0.0772","","","","1.142","1.234","1.234","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005478","4.52","0.002","4.52","0.002","15.484","0.008","90","","90","","90","","316.3","0.3","113","2","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- Ag0.64 Cs Mn1.18 Te2 -","- Ag0.64 Cs Mn1.18 Te2 -","- Ag1.28 Cs2 Mn2.36 Te4 -","2","0.0625","BR1142","Wu, E. J.; Pell, M. A.; Ibers, J. A.","CsAg~0.64~Mn~1.18~Te~2~","Acta Crystallographica Section C","1996","52","10","2384","2385","10.1107/S0108270196006294","","","0.7093","MoKα~1~","","","0.0308","","","0.1182","","","","","2.392","2.392","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005479","8.984","0.002","16.588","0.004","13.732","0.002","90","","103.27","0.02","90","","1991.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","3-hexanoyl-1-tosylindole","3-hexanoyl-1-(p-methylphenylsulphonyl)indole","","- C21 H23 N O3 S -","- C21 H23 N O3 S -","- C84 H92 N4 O12 S4 -","4","1","CF1004","Mohialdin-Khaffaf, S.; Persaud, K. C.; Pritchard, R. G.","3-Hexanoyl-1-tosylindole. A Highly Stereospecific Preparation of 3-Alkyl-Substituted Indoles","Acta Crystallographica Section C","1996","52","10","2607","2609","10.1107/S010827019600580X","","","0.71069","MoKα","","0.2052","0.0659","","0.3392","0.1973","","","","1.078","1.222","1.222","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005480","13.2001","0.0012","19.4239","0.0015","15.1868","0.0013","90","","90","","90","","3893.9","0.6","297","","297","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis[N-2-propylsalicylideneamino]cobalt(II)","","- C20 H24 Co N2 O2 -","- C20 H24 Co N2 O2 -","- C160 H192 Co8 N16 O16 -","8","1","CF1056","Elerman, Y.; Kabak, M.; Tahir, M. N.","Bis(<i>N</i>-2-propylsalicylideneamino-<i>N</i>,<i>O</i>)cobalt(II)","Acta Crystallographica Section C","1996","52","10","2434","2436","10.1107/S0108270196007111","","","0.71073","MoKα","","","0.035","","","0.04","","","","","1.27","1.27","","","","","has coordinates","198529","2020-10-21","18:00:00",""
"2005481","4.8797","0.0011","12.155","0.001","14.7338","0.0016","68.364","0.01","86.482","0.012","78.77","0.011","796.7","0.2","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 N2 O11 Pb -","- C14 H10 N2 O11 Pb -","- C28 H20 N4 O22 Pb2 -","2","1","CF1064","Tahir, M. N.; Ülkü, D.; Mövsümov, E. M.","Aquabis(<i>p</i>-nitrosalicylato-<i>O</i>,<i>O</i>')lead(II)","Acta Crystallographica Section C","1996","52","10","2436","2439","10.1107/S0108270196007123","","","0.71073","MoKα","","","0.027","","","0.029","","","","","0.88","0.88","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005482","10.608","0.003","19.147","0.006","17.448","0.005","90","","107.22","0.02","90","","3385","1.8","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(+/-)-cis-1,2-O-Cyclohexylidene-3,4,5,6-tetra-O-benzyl myo-inositol","","- C40 H44 O6 -","- C40 H44 O6 -","- C160 H176 O24 -","4","1","CF1070","Spiers, I. D.; Schwalbe, C. H.; Freeman, S.","3,4,5,6-Tetra-<i>O</i>-benzyl-<i>cis</i>-1,2-<i>O</i>-cyclohexylidene <i>myo</i>-Inositol","Acta Crystallographica Section C","1996","52","10","2575","2578","10.1107/S0108270196005410","","","0.71069","MoKα","","0.1479","0.0511","","0.1513","0.1065","","","","1.005","1.126","1.126","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005483","21.519","0.003","5.5068","0.0004","16.422","0.002","90","","128.692","0.012","90","","1518.9","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(3RS,6SR)-2,5-dimethoxy-3,6-diphenyl-3,6-dihydropyrazine","","- C18 H18 N2 O2 -","- C18 H18 N2 O2 -","- C72 H72 N8 O8 -","4","0.5","CF1094","Benecke, B.; Bolte, M.","<i>trans</i>- and <i>cis</i>-2,5-Dimethoxy-3,6-diphenyl-3,6-dihydropyrazine","Acta Crystallographica Section C","1996","52","10","2586","2588","10.1107/S0108270196006634","","","0.71069","MoKα","","0.0588","0.0416","","0.1366","0.1079","","","","1.11","1.175","1.175","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005484","15.7468","0.0004","17.3677","0.0005","11.5306","0.0004","90","","90","","90","","3153.45","0.16","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(3RS,6RS)-2,5-dimethoxy-3,6-diphenyl-3,6-dihydropyrazine","","- C18 H18 N2 O2 -","- C18 H18 N2 O2 -","- C144 H144 N16 O16 -","8","1","CF1094","Benecke, B.; Bolte, M.","<i>trans</i>- and <i>cis</i>-2,5-Dimethoxy-3,6-diphenyl-3,6-dihydropyrazine","Acta Crystallographica Section C","1996","52","10","2586","2588","10.1107/S0108270196006634","","","1.5418","CuKα","","0.0415","0.0387","","0.1055","0.102","","","","1.079","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005485","9.709","0.002","15.482","0.002","18.267","0.003","90","","96.2","0.01","90","","2729.7","0.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","cis-Dichloro(triethylphosphine-P)[tris(2,6-difluorophenyl)phosphite-P] platinum(II)","","- C24 H24 Cl2 F6 O3 P2 Pt -","- C24 H24 Cl2 F6 O3 P2 Pt -","- C96 H96 Cl8 F24 O12 P8 Pt4 -","4","1","CF1103","Fawcett, J.; Holloway, J. H.; Hope, E. G.; Saunders, G. C.; Atherton, M. J.","<i>cis</i>-Dichloro(triethylphosphine-<i>P</i>)[tris(2,6-difluorophenyl)phosphite-<i>P</i>]platinum(II)","Acta Crystallographica Section C","1996","52","10","2463","2464","10.1107/S0108270196007160","","","0.71073","MoKα","","0.0428","0.0293","","0.0669","0.0616","","","","1.043","1.067","1.067","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005486","6.873","0.001","7.2268","0.0014","7.471","0.002","80.41","0.02","80.27","0.02","67.121","0.01","334.88","0.12","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","Pyridine-2,5-dimethanol","","- C7 H9 N O2 -","- C7 H9 N O2 -","- C14 H18 N2 O4 -","2","1","CF1110","Bell, W.; Coupar, P. I.; Ferguson, G.; Glidewell, C.","Multiple Hydrogen Bonds in Pyridine-2,6-dimethanol and Benzene-1,3,5-trimethanol","Acta Crystallographica Section C","1996","52","10","2520","2524","10.1107/S0108270196006014","","","0.7107","MoKα","","0.106","0.0483","","0.1328","0.1182","","","","0.969","1.203","1.203","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005487","4.566","0.0003","8.1331","0.0005","23.173","0.003","90","","90","","90","","860.55","0.14","294","1","294","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Benzene-1,3,5-trimethanol","","- C9 H12 O3 -","- C9 H12 O3 -","- C36 H48 O12 -","4","1","CF1110","Bell, W.; Coupar, P. I.; Ferguson, G.; Glidewell, C.","Multiple Hydrogen Bonds in Pyridine-2,6-dimethanol and Benzene-1,3,5-trimethanol","Acta Crystallographica Section C","1996","52","10","2520","2524","10.1107/S0108270196006014","","","0.7107","MoKα","","0.0921","0.0434","","0.1004","0.0889","","","","1.05","1.244","1.244","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005488","8.1765","0.001","8.1765","","26.34","0.002","90","","90","","120","","1525","0.2","294","1","294","1","","","","","","","","4","P 31 2 1","P 31 2""","152","","Ferrocene-1,1'-diylbis(2-phenylethanedione)","","- C26 H18 Fe O4 -","- C26 H18 Fe O4 -","- C78 H54 Fe3 O12 -","3","0.5","CF1133","Ferguson, G.; Glidewell, C.; Royles, B. J. L.; Smith, D. M.","1,1'-Ferrocenediylbis(2-phenylethanedione): a Three-Dimensional Network Generated by Short C—H···O Hydrogen Bonds","Acta Crystallographica Section C","1996","52","10","2465","2468","10.1107/S0108270196009699","","","0.7107","MolybdenumKα","","0.0681","0.0487","","0.1157","0.1074","","","","1.065","1.134","1.134","","","","","has coordinates","192286","2020-10-21","18:00:00",""
"2005489","7.529","0.004","20.689","0.012","30.469","0.016","90","","90","","90","","4746","4","302.3","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H16 N4 O4 S2 -","- C13 H16 N4 O4 S2 -","- C156 H192 N48 O48 S24 -","12","3","DE1032","Biswas, G.; Chandra, T.; Garg, N.; Bhakuni, D. S.; Pramanik, A.; Avasthi, K.; Maulik, P. R.","A [3.1.0]-Fused 2',3'-Modified β-<small>D</small>-Pyrazolo[3,4-<i>d</i>]pyrimidine Nucleoside","Acta Crystallographica Section C","1996","52","10","2563","2566","10.1107/S0108270196004015","","","0.71073","MoKα","","","0.052","","","0.087","","","","","1.106","1.106","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005490","13.616","0.001","11.977","0.002","15.804","0.001","90","","111.09","0.02","90","","2404.7","0.6","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H31 N O4 -","- C26 H31 N O4 -","- C104 H124 N4 O16 -","4","1","DE1036","Gunasekaran, K.; Velmurugan, D.; Murugan, P.; Ramakrishnan, V. T.; Panneerselvam, K.; Soriano-García, M.","3,4,6,7,9,10-Hexahydro-3,3,6,6-tetramethyl-1,8(2<i>H</i>,5<i>H</i>)-dioxo-10-phenyl-9-acridinylmethyl Acetate","Acta Crystallographica Section C","1996","52","10","2609","2612","10.1107/S010827019600652X","","","1.54184","CuKα","","","0.0516","","","0.134","","","","","0.903","0.903","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005491","9.673","0.001","6.992","0.003","22.867","0.003","90","","90","","90","","1546.6","0.7","293","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Trieuropium Boron Disilicate","","- B Eu3 O10 Si2 -","- B Eu3 O10 Si2 -","- B8 Eu24 O80 Si16 -","8","1","DU1155","Chi, L.; Chen, H.; Deng, S.; Zhuang, H.; Huang, J.","A New Europium Borosilicate, Eu~3~BSi~2~O~10~","Acta Crystallographica Section C","1996","52","10","2385","2387","10.1107/S0108270196005069","","","0.71073","MoKα","","","0.0527","","","0.0608","","","","","0.61","0.61","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005492","13.032","0.004","11.948","0.004","16.295","0.005","90","","103.83","0.02","90","","2463.7","1.4","293","2","293","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","catena-poly[-μ-aqua-bis(trifluoromethanesulphonatosilver-μ- (1,4-dicyanobenzene-N:N'))]","","- C18 H10 Ag2 F6 N4 O7 S2 -","- C18 H10 Ag2 F6 N4 O7 S2 -","- C72 H40 Ag8 F24 N16 O28 S8 -","4","0.5","FG1114","Venkataraman, D.; Gardner, G. B.; Covey, A. C.; Lee, S.; Moore, J. S.","Silver(I) Complexes of 1,4-Dicyanobenzene","Acta Crystallographica Section C","1996","52","10","2416","2419","10.1107/S0108270196006099","","","0.71073","MoKα","","0.0476","0.0318","","0.0801","0.073","","","","1.065","1.103","1.103","","","","","has coordinates","249787","2020-10-21","18:00:00",""
"2005493","12.165","0.003","13.296","0.009","15.175","0.008","90","","90","0.001","90","0.001","2454.7","2.1","293","2","","","","","","","","","","7","C m c a","-C 2ac 2","64","","","","- C8 H6 Ag F6 N2 O P -","- C8 H6 Ag F6 N2 O P -","- C64 H48 Ag8 F48 N16 O8 P8 -","8","","","","A New Europium Borosilicate, Eu~3~BSi~2~O~10~ Silver(I) Complexes of 1,4-Dicyanobenzene","Acta Crystallographica C","1996","52","","2385","2387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005494","7.313","0.002","9.057","0.002","6.994","0.002","107.63","0.02","117.6","0.02","74.81","0.002","387.16","0.19","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Trans-Dichlorobis(creatinine)platinum(II) Dyhydrate","","- C8 H18 Cl2 N6 O4 Pt -","- C8 H18 Cl2 N6 O4 Pt -","- C8 H18 Cl2 N6 O4 Pt -","1","0.5","FG1117","Ramos Silva, M.; Paixão, J. A.; Matos Beja, A.; Alte da Veiga, L.; Martín-Gil, J.; Martín-Gil, F. J.","A New Allotropic Form of <i>trans</i>-Dichlorobis(creatinine)platinum(II) Dihydrate","Acta Crystallographica Section C","1996","52","10","2450","2452","10.1107/S0108270196008086","","","0.71073","MoKα","","0.0851","0.0388","","0.0551","0.0478","","","","0.995","1.023","1.023","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005495","13.193","0.006","14.523","0.007","23.784","0.009","82.26","0.04","102.89","0.03","109.25","0.03","4185","3","295","","295","","","","","","","","","7","P -1","-P 1","2","","","","- C75 H67 N O P3 Ta Te10 -","- C75 N O P3 Ta Te10 -","- C150 N2 O2 P6 Ta2 Te20 -","2","1","FG1123","Flomer, W. A.; Kolis, J. W.; Pennington, W. T.","Tris(tetraphenylphosphonium) Decatelluriumtantalide Dimethylformamide (1/1), a Tetraphenylphosphonium Salt of TaTe~10~^3{-^}","Acta Crystallographica Section C","1996","52","10","2445","2448","10.1107/S0108270196005847","","","0.71073","MoKα","","","0.0598","","","0.0709","","","","","1.502","1.502","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005496","13.555","0.003","13.059","0.004","18.919","0.002","90","","107.58","0.01","90","","3192.5","1.3","293.2","","293.2","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H54 O Sr -","- C32 H54 O Sr -","- C128 H216 O4 Sr4 -","4","0.5","FG1143","Burkey, D. J.; Hanusa, T. P.","(Tetrahydrofuran-<i>O</i>)bis(η^5^-1,2,4-triisopropylcyclopentadienyl)strontium","Acta Crystallographica Section C","1996","52","10","2452","2454","10.1107/S0108270196007330","","","1.5418","CuKα","","","0.0328","","","0.042","","","","","1.58","1.58","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2005497","17.754","0.009","16.129","0.007","14.99","0.005","90","","103.33","0.03","90","","4177","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H37 Hf N5 O4 -","- C50 H37 Hf N5 O4 -","- C200 H148 Hf4 N20 O16 -","4","0.5","FG1145","Huhmann, J. L.; Rath, N. P.; Corey, J. Y.","(Tetraphenylporphyrinato)hafnium(IV) Diacetate Acetonitrile Solvate","Acta Crystallographica Section C","1996","52","10","2486","2488","10.1107/S0108270196007780","","","0.71073","MoKα","","0.1375","0.078","","0.1096","0.092","","","","1.376","1.527","1.527","","","","","has coordinates","194538","2020-10-21","18:00:00",""
"2005498","9.162","0.002","10.808","0.003","11.627","0.003","102.01","0.01","103.27","0.01","113.63","0.01","966.8","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aqua(2,2'-bipyridyl-N,N')(thiodiacetato-O,O',S)zinc(II) tetrahydrate","","- C14 H22 N2 O9 S Zn -","- C14 H22 N2 O9 S Zn -","- C28 H44 N4 O18 S2 Zn2 -","2","1","FG1160","Baggio, R.; Perec, M.; Garland, M. T.","Aqua(2,2'-bipyridyl-<i>N</i>,<i>N</i>')(thiodiacetato-<i>O</i>,<i>O</i>',<i>S</i>)zinc(II) Tetrahydrate","Acta Crystallographica Section C","1996","52","10","2457","2460","10.1107/S0108270196007329","","","0.71073","MoKα","","0.0242","0.0221","","0.0583","0.0575","","","","1.036","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005499","8.1649","0.0009","8.6999","0.0013","8.9848","0.0011","90","","110.744","0.009","90","","596.85","0.14","288","2","288","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1'-di(2-propanone)-2,2'-biimidazole","","- C6 H7 N2 O -","- C12 H14 N4 O2 -","- C24 H28 N8 O4 -","2","0.5","FG1166","Secondo, P. M.; Barnett, W. M.; Collier, H. L.; Baughman, R. G.","1,1'-Diketone and 1,1'-Dinitrile Derivatives of 2,2'-Biimidazole","Acta Crystallographica Section C","1996","52","10","2636","2638","10.1107/S0108270196005823","","","0.71073","MoKα","","0.0521","0.0435","","0.1401","0.133","","","","1.146","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005500","7.1044","0.0009","5.259","0.0005","13.421","0.002","90","","99.646","0.01","90","","494.35","0.11","288","2","288","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1'-di(cyanomethyl)-2,2'-biimidazole","","- C5 H4 N3 -","- C10 H8 N6 -","- C20 H16 N12 -","2","0.5","FG1166","Secondo, P. M.; Barnett, W. M.; Collier, H. L.; Baughman, R. G.","1,1'-Diketone and 1,1'-Dinitrile Derivatives of 2,2'-Biimidazole","Acta Crystallographica Section C","1996","52","10","2636","2638","10.1107/S0108270196005823","","","0.71073","MoKα","","0.042","0.0367","","0.1034","0.0972","","","","1.058","1.086","1.086","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005501","11.3869","0.0003","12.6938","0.0004","12.8468","0.0004","62.04","0.001","74.175","0.001","63.795","0.001","1466.53","0.08","203","2","203","2","","","","","","","","6","P -1","-P 1","2","Monospiro(1,2-phenylenedioxy)tetrakis(parafluorophenoxy)cyclotriphosphazene","","","- C30 H20 F4 N3 O6 P3 -","- C30 H20 F4 N3 O6 P3 -","- C60 H40 F8 N6 O12 P6 -","2","1","FG1172","Vij, A.; Staples, R. J.; Kirchmeier, R. L.; Shreeve, J. M.","Monospiroaryloxyphosphazenes: <i>p</i>-Fluorophenoxy Derivatives Containing the 1,2-Phenylenedioxy and 2,3-Naphthalenedioxy Groups","Acta Crystallographica Section C","1996","52","10","2515","2520","10.1107/S0108270196005859","","","0.71073","MoKα","","0.0597","0.0454","","0.1157","0.1051","","","","1.037","1.046","1.046","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005502","8.1325","0.0001","26.5942","0.0003","29.8727","0.0005","90","","90","","90","","6460.79","0.15","203","2","203","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Monospiro(2,3-naphthalenedioxy)tetrakis(parafluorophenoxy)cyclotriphosphazene","","","- C34 H22 F4 N3 O6 P3 -","- C34 H22 F4 N3 O6 P3 -","- C272 H176 F32 N24 O48 P24 -","8","1","FG1172","Vij, A.; Staples, R. J.; Kirchmeier, R. L.; Shreeve, J. M.","Monospiroaryloxyphosphazenes: <i>p</i>-Fluorophenoxy Derivatives Containing the 1,2-Phenylenedioxy and 2,3-Naphthalenedioxy Groups","Acta Crystallographica Section C","1996","52","10","2515","2520","10.1107/S0108270196005859","","","0.71073","MoKα","","0.0777","0.0468","","0.1125","0.0818","","","","1.085","1.149","1.149","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005503","9.676","0.002","6.579","0.002","11.215","0.002","90","","90","","90","","713.9","0.3","213","2","213","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","3-Hydroxy-2-methyl-4H-pyran-4-on-4-ium Chloride","","- C6 H7 Cl O3 -","- C6 H7 Cl O3 -","- C24 H28 Cl4 O12 -","4","0.5","FG1175","Bilodeau, D.; Beauchamp, A. L.","Maltol Hydrochloride","Acta Crystallographica Section C","1996","52","10","2633","2636","10.1107/S0108270196005550","","","1.54056","CuKα","","0.0337","0.0267","","0.0713","0.0689","","","","0.973","1.063","1.063","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005504","12.846","0.002","13.608","0.002","11.146","0.001","90","","91.89","0.01","90","","1947.4","0.5","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","(E)-2-Acetylcinnamic Acid","(E)-2-acetyl-3-phenylpropenoic acid","","- C11 H10 O3 -","- C11 H10 O3 -","- C88 H80 O24 -","8","1","FG1176","Coté, M. L.; Thompson, H. W.; Lalancette, R. A.; Williams, IV, J. A.","(<i>E</i>)-2-Acetylcinnamic Acid: Hydrogen-Bonding Pattern of an α,β-Unsaturated β'-Keto Acid","Acta Crystallographica Section C","1996","52","10","2612","2614","10.1107/S0108270196005860","","","0.71073","MoKα","","0.0803","0.0436","","0.1197","0.1081","","","","0.858","1.055","1.055","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005505","9.519","0.003","11.446","0.004","11.65","0.004","108.67","0.03","104.86","0.03","94.68","0.03","1143.6","0.7","178","2","178","2","","","","","","","","5","P -1","-P 1","2","","Difluorobis(diphenylphosphino)methane disulfide","","- C25 H20 F2 P2 S2 -","- C25 H20 F2 P2 S2 -","- C50 H40 F4 P4 S4 -","2","1","FG1184","Jones, P. G.; Bembenek, E.","Derivatives of Bis(diphenylphosphino)difluoromethane: the Disulfide Ph~2~P(= S)CF~2~P(= S)Ph~2~ and the Bis[chlorogold(I)] Complex Ph~2~P(AuCl)CF~2~P(AuCl)Ph~2~","Acta Crystallographica Section C","1996","52","10","2396","2399","10.1107/S0108270196004404","","","0.71073","MoKα","","0.0562","0.0383","","0.105","0.0937","","","","1.021","1.064","1.064","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005506","12.998","0.004","13.719","0.003","13.873","0.003","90","","90","","90","","2473.8","1.1","178","2","178","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Difluorobis(diphenylphosphino)methane bis(chlorogold(I))","","- C25 H20 Au2 Cl2 F2 P2 -","- C25 H20 Au2 Cl2 F2 P2 -","- C100 H80 Au8 Cl8 F8 P8 -","4","1","FG1184","Jones, P. G.; Bembenek, E.","Derivatives of Bis(diphenylphosphino)difluoromethane: the Disulfide Ph~2~P(= S)CF~2~P(= S)Ph~2~ and the Bis[chlorogold(I)] Complex Ph~2~P(AuCl)CF~2~P(AuCl)Ph~2~","Acta Crystallographica Section C","1996","52","10","2396","2399","10.1107/S0108270196004404","","","0.71073","MoKα","","0.0598","0.0405","","0.0945","0.0864","","","","0.974","1.001","1.001","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005507","10.6814","0.0015","20.22","0.005","11.467","0.002","90","","90","","90","","2476.6","0.8","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Chlorotris-(p-methylsulphonylphenyl)Tin(IV)","","- C21 H21 Cl O6 S3 Sn -","- C21 H21 Cl O6 S3 Sn -","- C84 H84 Cl4 O24 S12 Sn4 -","4","1","FG1190","Wharf, I.; Lebuis, A.-M.; Lamparski, H.","Chlorotris(<i>p</i>-methylsulfonylphenyl)tin(IV)","Acta Crystallographica Section C","1996","52","10","2477","2480","10.1107/S0108270196007792","","","0.7093","MolybdenumKα","","0.075","0.0478","","0.0827","0.0755","","","","1.027","1.106","1.106","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005508","7.3431","0.0009","15.305","0.002","14.475","0.003","90","","97.25","0.02","90","","1613.8","0.4","143","2","143","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Chlorobis(methylcyclopentadienyl)pentafluorophenyltitanium(IV)","","- C18 H14 Cl F5 Ti -","- C18 H14 Cl F5 Ti -","- C72 H56 Cl4 F20 Ti4 -","4","1","FG1195","Kienitz, C. O.; Thöne, C.; Jones, P. G.","Chlorobis(η^5^-methylcyclopentadienyl)(2,3,4,5,6-pentafluorophenyl)titanium(IV)","Acta Crystallographica Section C","1996","52","10","2402","2404","10.1107/S0108270196006981","","","0.71073","MoKα","","0.0468","0.0401","","0.1236","0.108","","","","1.068","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005509","9.657","0.004","10.749","0.003","10.996","0.003","90","","110.44","0.03","90","","1069.6","0.6","166","2","166","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-5-bis(ferrocenyl)naphthalene","","- C30 H24 Fe2 -","- C30 H24 Fe2 -","- C60 H48 Fe4 -","2","0.5","FG1200","McAdam, C. J.; Robinson, B. H.; Simpson, J.","1,5-Diferrocenylnaphthalene","Acta Crystallographica Section C","1996","52","10","2404","2406","10.1107/S0108270196007305","","","0.71073","MoKα","","0.0559","0.0382","","0.0892","0.0854","","","","0.901","1.025","1.025","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005510","8.1522","0.0012","8.891","0.0008","8.9605","0.0008","82.552","0.008","89.561","0.004","63.421","0.004","575","0.11","173","2","173","2","","","","","","","","6","P 1","P 1","1","","(cis-1,2-Dichlorovinyl)bis(dimethylglyoximato-N,N')(pyridine)cobalt(III) Chloroform Solvate","","- C16 H21 Cl5 Co N5 O4 -","- C16 H21 Cl5 Co N5 O4 -","- C16 H21 Cl5 Co N5 O4 -","1","1","FG1202","Jones, P. G.; Yang, L.; Steinborn, D.","(<i>cis</i>-1,2-Dichlorovinyl)bis(dimethylglyoximato-<i>N</i>,<i>N</i>')(pyridine-<i>N</i>)cobalt(III) Chloroform Solvate, [Co(dmgH)~2~(py)(CCl=CHCl)].CHCl~3~","Acta Crystallographica Section C","1996","52","10","2399","2402","10.1107/S0108270196007810","","","0.71073","MoKα","","0.0303","0.0291","","0.0752","0.0746","","","","1.053","1.063","1.063","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005511","12.013","0.002","10.61","0.002","15.634","0.003","90","","103.08","0.03","90","","1941","0.7","243","2","243","","","","","","","","","5","P 1 21 1","P 2yb","4","","Bis(tert-butylthio)germanium-Imide trimer","","- C24 H57 Ge3 N3 S6 -","- C24 H57 Ge3 N3 S6 -","- C48 H114 Ge6 N6 S12 -","2","1","FG1205","George, C.; Purdy, A. P.","Bis(<i>tert</i>-butylthiolato-<i>S</i>)germanium‒Imide Trimer","Acta Crystallographica Section C","1996","52","10","2489","2491","10.1107/S0108270196007822","","","1.54178","CuKα","","0.0582","0.0512","","0.132","0.1258","","","","1.038","1.043","1.043","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005512","15.7353","0.002","15.7353","","5.2803","0.0017","90","","90","","90","","1307.4","0.5","","","298","","","","","","","","","3","I -4","I -4","82","","benzenecarboximidamide","","- C7 H8 N2 -","- C7 H8 N2 -","- C56 H64 N16 -","8","1","HA1142","Barker, J.; Phillips, P. R.; Wallbridge, M. G. H.; Powell, H. R.","Benzamidine","Acta Crystallographica Section C","1996","52","10","2617","2619","10.1107/S0108270196006282","","","1.5418","CuKα","","","0.034","","","0.029","","","","","0.957","0.957","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005513","10.552","0.001","24.993","0.0018","7.97","0.001","90","","90","","90","","2101.9","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","α-5-Adamantyl-4'-thio-2'-deoxyuridine methanol solvate","","- C20 H30 N2 O5 S -","- C20 H30 N2 O5 S -","- C80 H120 N8 O20 S4 -","4","1","HA1160","Sun, M.; Basnak, I.; Hamor, T. A.; Walker, R. T.","α-5-Adamantyl-4'-thio-2'-deoxyuridine Methanol Solvate","Acta Crystallographica Section C","1996","52","10","2556","2558","10.1107/S010827019600529X","","","0.71069","MoKα","","0.038","0.0345","","0.1049","0.0954","","","","1.049","0.963","0.963","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005514","7.495","0.001","12.18","0.001","13.75","0.001","90","","104.38","0.01","90","","1215.9","0.2","150","2","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","6-(4-Methoxyphenyl)thieno[2,3-d]-1,3-dithiole-2-thione","","- C12 H8 O S4 -","- C12 H8 O S4 -","- C48 H32 O4 S16 -","4","1","HA1162","Ozturk, T.; Wallis, J. D.","6-(4-Methoxyphenyl)thieno[2,3-<i>d</i>][1,3]dithiole-2-thione at 150K","Acta Crystallographica Section C","1996","52","10","2552","2554","10.1107/S0108270196005264","","","0.71069","MoKα","","0.0632","0.0551","","0.1312","0.1288","","","","1.011","1.098","1.098","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005515","4.6709","0.0002","14.9289","0.0007","9.0408","0.0009","90","","90.131","0.011","90","","630.43","0.07","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","l-Histidyl-l-alanine dihydrate","l-Histidyl-l-alanine dihydrate","","- C9 H18 N4 O5 -","- C9 H18 N4 O5 -","- C18 H36 N8 O10 -","2","1","HA1164","Steiner, Th.","<small>L</small>-Histidyl-<small>L</small>-alanine Dihydrate","Acta Crystallographica Section C","1996","52","10","2554","2556","10.1107/S0108270196006804","","","1.54176","CuKα","","0.0219","0.0204","","0.0564","0.0545","","","","1.072","1.077","1.077","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005516","10.516","0.003","12.855","0.004","11.623","0.002","90","","109.1","0.02","90","","1484.7","0.7","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H16 Br N5 O2 -","- C11 H16 Br N5 O2 -","- C44 H64 Br4 N20 O8 -","4","1","HU1107","Janes, R. W.; Palmer, R. A.","3,5-Diamino-6-(2-bromophenyl)-1,2,4-triazine Dimethanol Solvate: an Analogue of Lamotrigine","Acta Crystallographica Section C","1996","52","10","2627","2629","10.1107/S010827019501300X","","","1.54178","CuKα","","","0.0496","","","0.0577","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005517","11.89","0.002","12.286","0.003","13.579","0.003","90","","94.32","0.02","90","","1978","0.7","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dicaesium ethyltrimethylammonium heptaphosphide-ammonia (1/2)","","- C5 H20 Cs2 N3 P7 -","- C5 H20 Cs2 N3 P7 -","- C20 H80 Cs8 N12 P28 -","4","1","JZ1122","Korber, N.; Daniels, J.","Dicaesium Ethyltrimethylammonium Heptaphosphide‒Ammonia (1/2)","Acta Crystallographica Section C","1996","52","10","2454","2457","10.1107/S0108270196005902","","","0.71073","MoKα","","0.0441","0.0408","","0.1073","0.1055","","","","1.199","1.221","1.221","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005518","10.51","0.001","10.438","0.001","19.012","0.002","90","","103.552","0.007","90","","2027.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(1,2-bis(4-pyridyl)ethane)cadmium(II) Tetracyanonickelate(II) -m-Xylene","","- C44 H44 Cd N8 Ni -","- C44 H44 Cd N8 Ni -","- C88 H88 Cd2 N16 Ni2 -","2","0.5","KA1143","Güneş, B.; Soylu, H.; Özbey, S.; Tufan, Y.; Karacan, N.","Bis(1,2-di-4-pyridylethane-<i>N</i>:<i>N</i>')cadmium(II) Tetracyanonickelate(II) <i>m</i>-Xylene Solvate","Acta Crystallographica Section C","1996","52","10","2425","2427","10.1107/S0108270196005380","","","0.71073","MoKα","","","0.0542","","0.1189","","","","","1.495","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005519","9.003","0.002","11.142","0.003","7.568","0.002","90","","99.51","0.02","90","","748.7","0.3","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C8 H12 Mn2 O16 -","- C8 H4 Mn2 O16 -","- C16 H8 Mn4 O32 -","2","1","KA1155","Ruiz-Pérez, C.; Hernández-Molina, M.; González-Silgo, C.; López, T.; Yanes, C.; Solans, X.","Polymeric (Aqua-1κ<i>O</i>)bis[(<i>R</i>,<i>R</i>)-tartrato-1κ^2^<i>O</i>^1^,<i>O</i>^2^:2κ^2^<i>O</i>^3^,<i>O</i>^4^]dimanganese(II) Trihydrate","Acta Crystallographica Section C","1996","52","10","2473","2475","10.1107/S0108270196006427","","","0.71073","MoKα","","","0.068","","","0.2053","","","","","1.116","1.116","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005520","10.1646","0.0007","8.8048","0.0006","13.157","0.001","90","","96.327","0.006","90","","1170.34","0.14","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(n-propyl)-2-oxy-1-naphthaldimine","","- C14 H15 N O -","- C14 H15 N O -","- C56 H60 N4 O4 -","4","1","KA1185","Kaitner, B.; Pavlovic, G.","A Reinvestigation of the Quinoidal Effect in <i>N</i>-<i>n</i>-Propyl-2-oxo-1-naphthylidenemethylamine","Acta Crystallographica Section C","1996","52","10","2573","2575","10.1107/S0108270196005495","","","0.71073","MolybdenumKα","","","0.036","","","0.058","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005521","10.372","0.003","10.787","0.002","13.571","0.003","74.35","0.02","74.37","0.02","87.03","0.02","1407.7","0.6","292","","292","","","","","","","","","6","P -1","-P 1","2","","Tetrakis(creatinine)platinum(II) Dithiocyanate","","- C18 H28 N14 O4 Pt S2 -","- C18 H28 N14 O4 Pt S2 -","- C36 H56 N28 O8 Pt2 S4 -","2","1","KA1187","Macíček, J.; Gencheva, G.; Mitewa, M.","Tetrakis(creatinine)platinum(II) Dithiocyanate","Acta Crystallographica Section C","1996","52","10","2429","2432","10.1107/S0108270196007901","","","0.71073","MoKα","","0.06","0.034","","0.041","0.046","","","","2.285","0.884","0.884","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005522","10.604","0.005","13.327","0.003","32.664","0.009","90","","90","","90","","4616","3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","11,12,4""-tri-O-methylazithromycin monohydrate","","- C41 H80 N2 O13 -","- C41 H80 N2 O13 -","- C164 H320 N8 O52 -","4","1","KA1189","Kamenar, B.; Košutić Hulita, N.; Vicković, I.; Kobrehel, G.; Lazarevski, G.","11,12,4''-Tri-<i>O</i>-methylazithromycin Monohydrate","Acta Crystallographica Section C","1996","52","10","2566","2568","10.1107/S0108270196005409","","","1.54178","CuKα","","0.1602","0.0624","","0.2176","0.1758","","","","0.952","1.316","1.316","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005523","10.175","0.008","14.146","0.014","39.575","0.035","90","","90","","90","","5696","9","153","2","153","4","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Bis(bis(1,10-phenanthroline)cyanocopper(II) isothiocyanate) Phenanthroline Pentahemihydrate","","- C64 H51 Cu2 N14 O5.5 S2 -","- C64 H51 Cu2 N14 O5.5 S2 -","- C256 H204 Cu8 N56 O22 S8 -","4","1","KA1199","Potočňák, I.; Dunaj-Jurčo, M.; Mikloš, D.","Cyanobis(1,10-phenanthroline-<i>N</i>,<i>N</i>')copper(II) Isothiocyanate‒Phenanthroline‒Water (2/1/5.5)","Acta Crystallographica Section C","1996","52","10","2406","2409","10.1107/S0108270196006993","","","0.71069","MoKα","","0.1001","0.0673","","0.2088","0.1635","","","","0.99","1.018","1.018","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2005524","9.18","0.0009","7.344","0.0007","25.385","0.003","90","0.02","91.22","0.02","90","0.02","1711","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(3-amidyl-3-metoxy-2-nitroso-acrylonitrile)-bipyridine- dicyanamidecopper(II)","","- C16 H12 Cu N8 O2 -","- C16 H12 Cu N8 O2 -","- C64 H48 Cu4 N32 O8 -","4","1","KA1203","Dunaj-Jurčo, M.; Mikloš, D.; Potočňák, I.; Jäger, L.","Addition of Methanol to Copper(II)-Coordinated Dicyanonitrosomethanide: (3-Amino-3-methoxy-2-nitrosoacrylonitrilato-<i>N</i>^2^,<i>N</i>^3^)(bipyridine-<i>N</i>,<i>N</i>')(dicyanamido-<i>N</i>)copper(II)","Acta Crystallographica Section C","1996","52","10","2409","2412","10.1107/S0108270196009766","","","0.71069","MoKα","","0.1176","0.0436","","0.1078","0.0905","","","","0.929","1.106","1.106","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005525","21.094","0.004","10.022","0.003","17.293","0.004","90","","90.18","0.02","90","","3655.8","1.5","293","1","293","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,2-[3,4-Dihydro-2-(5-methoxyphenyl)-2H-pyrrolo)[60]fullerene","","- C70 H9 N O S2 -","- C70 H9 N O S2 -","- C280 H36 N4 O4 S8 -","4","1","KA1208","Ramm, M.; Luger, P.; Averdung, J.; Mattay, J.","1,2-[3,4-Dihydro-2-(4-methoxyphenyl)-2<i>H</i>-pyrrolo][60]fullerene Carbon Disulfide","Acta Crystallographica Section C","1996","52","10","2590","2594","10.1107/S0108270196009742","","","1.54178","CuKα","","0.1","0.0451","","0.1211","0.1094","","","","0.881","1.116","1.116","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005526","12.909","0.003","8.174","0.002","11.302","0.002","90","","94.82","0.03","90","","1188.3","0.5","296","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C12 H6 Cl4 -","- C12 H6 Cl4 -","- C48 H24 Cl16 -","4","0.5","KH1067","Miao, X.-S.; Chu, S.-G.; Xu, X.-B.; Jin, X.-L.","2,2',5,5'-Tetrachlorobiphenyl (PCB 52)","Acta Crystallographica Section C","1996","52","10","2582","2583","10.1107/S0108270196006555","","","0.71073","MoKα","","","0.077","","","0.094","","","","","0.97","0.97","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005527","9.324","0.003","16.59","0.005","18.978","0.002","90","","90.39","0.02","90","","2935.5","1.3","293","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","μ-chloro-μ-hydroxybis{dichloro bis(tetrahydrofuran)vanadium(III)} tetrahydrofuran solvate","","- C20 H41 Cl5 O6 V2 -","- C20 H41 Cl5 O6 V2 -","- C80 H164 Cl20 O24 V8 -","4","1","KH1082","M. Kondo; T. Ohrui; S. Kawata; S. Kitagawa","A Divanadium(III) Complex Bridged by Cl^{-^} and OH^{-^} Anions","Acta Crystallographica Section C","1996","52","10","2448","2450","10.1107/S0108270196006543","","","0.7107","MoKα","","","0.047","","","0.032","","","","","1.8","1.8","","","","","has coordinates","209447","2020-10-21","18:00:00",""
"2005528","10.387","0.007","10.63","0.01","8.016","0.008","111.76","0.08","103.34","0.07","104.2","0.07","744.3","1.4","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H32 Mo2 O14 P2 -","- C24 H32 Mo2 O14 P2 -","- C24 H32 Mo2 O14 P2 -","1","0.5","KH1083","Qiu, P.; Guo, G.; Huang, X.","A Methoxycarbonyl-Substituted Cyclopentadienyl‒Dicarbonyl‒Trimethylphosphite‒Molybdenum Complex Dimer, [Mo(η^5^-MeO~2~C~2~Cp){P(OMe)~3~}(CO)~2~]~2~","Acta Crystallographica Section C","1996","52","10","2484","2486","10.1107/S0108270196007275","","","0.71073","MoKα","","","0.05","","","0.054","","","","","1.13","1.13","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005529","6.271","0.001","6.376","0.001","8.169","0.001","96.45","0.01","103.86","0.01","103.87","0.01","302.84","0.08","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- As2 Ga K O7 -","- As2 Ga K O7 -","- As4 Ga2 K2 O14 -","2","1","KH1086","Lin, K.-J.; Lii, K.-H.","KGaAs~2~O~7~","Acta Crystallographica Section C","1996","52","10","2387","2389","10.1107/S0108270196005112","","","0.71069","MolybdenumKα","","0.037","0.033","","0.041","0.041","","","","","2.43","2.43","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005530","6.663","0.002","6.861","0.003","15.721","0.002","93.16","0.03","94.31","0.02","111.13","0.03","665.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","trans-tetraaquobis(tricyanomelamine)cobalt(II) hexahydrate","","- C12 H24 Co N18 O10 -","- C12 H24 Co N18 O10 -","- C12 H24 Co N18 O10 -","1","0.5","KH1099","Abrahams, B. F.; Egan, S. J.; Hoskins, B. F.; Robson, R.","<i>trans</i>-Tetraaquabis(<i>N</i>,<i>N</i>',<i>N</i>''-tricyanomelamine)cobalt(II) Hexahydrate","Acta Crystallographica Section C","1996","52","10","2427","2429","10.1107/S0108270196006488","","","1.5418","CuKα","","0.0357","0.0355","","0.1006","0.1004","","","","1.084","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005531","10.598","0.002","9.184","0.002","16.683","0.003","90","0.01","108.39","0.02","90","0.01","1540.9","0.6","293","2","293","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","(±)-3-formyl-1-methyl-2-(2-phenylethyl)Cyclohex-2-enecarboxylic acid","","- C17 H20 O3 -","- C17 H18 O3 -","- C68 H72 O12 -","4","1","LI1144","Ghosh, S.; Mostafa, G.; Mukherjee, M.; Pal, S.; Mukherjee, A. K.","(±)-3-Formyl-1-methyl-2-(2-phenylethyl)cyclohex-2-enecarboxylic Acid: an Investigation of Disorder","Acta Crystallographica Section C","1996","52","10","2507","2510","10.1107/S0108270196005586","","","1.5418","CuKα","","0.1535","0.1052","","0.4178","0.2897","","","","1.197","1.119","1.119","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005532","11.353","0.001","9.586","0.001","14.095","0.001","90","0.01","97.36","0.01","90","0.01","1521.3","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-Methoxy-2-(4,4-dimethyl-2-oxo-butan-1-ol)-1-naphthoic-acid-lactone","","- C18 H18 O4 -","- C18 H18 O4 -","- C72 H72 O16 -","4","1","LI1147","Nayak, N. P.; Mukherjee, A. K.; Mukherjee, M.","2-(1-Hydroxy-4,4-dimethyl-2-oxobutyl)-4-methoxy-1-naphtholactone","Acta Crystallographica Section C","1996","52","10","2510","2512","10.1107/S0108270196005574","","","0.7093","MoKα","","0.0578","0.0466","","0.1273","0.1201","","","","1.038","1.117","1.117","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005533","6.124","0.002","8.407","0.003","10.277","0.003","90","","90","0.03","90","","529.1","0.3","291","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C10 H16 O3 -","- C10 H16 O3 -","- C20 H32 O6 -","2","1","NA1217","Majzner, W. R.; Wieczorek, M. W.; Błaszczyk, J.; Kula, J.; Sikora, M.","(<i>S</i>)-(+)-Homoterpenyl Methyl Ketone","Acta Crystallographica Section C","1996","52","10","2629","2631","10.1107/S0108270196005549","","","1.54184","CuKα","","","0.042","","","0.0487","","","","","1.3698","1.3698","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2005534","6.08","0.002","13.552","0.004","13.882","0.007","90","","96.62","0.02","90","","1136.2","0.8","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Dihydrodipentalenyliron","Dihydrodipentalenyliron","","- C16 H14 Fe -","- C14.925 H13.058 Fe -","- C59.7 H52.232 Fe4 -","4","1","NA1230","Molins, E.; Maniukiewicz, W.; Miravitlles, C.; Mas, M.; Manriquez, J. M.; Chávez, I.; Oelckers, B.; Farran, J.; Briansó, J. L.","Bis(η^5^-hydropentalenyl)iron","Acta Crystallographica Section C","1996","52","10","2414","2416","10.1107/S0108270196005872","","","0.70926","MoKα","","0.0498","0.0303","","0.0908","0.081","","","","0.968","1.005","1.005","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005535","8.127","0.001","6.985","0.001","9.306","0.002","90","","97.2","0.01","90","","524.11","0.15","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","1-Fluoromethyl-1-methyl-1H,3H-thiazolo[3,4-a]benzimidazole","","- C11 H11 F N2 S -","- C11 H11 F N2 S -","- C22 H22 F2 N4 S2 -","2","0.5","NA1235","Bruno, G.; Chimirri, A.; Monforte, A. M.; Nicoló, F.; Scopelliti, R.","1-Fluoromethyl-1-methyl-1<i>H</i>,3<i>H</i>-thiazolo[3,4-<i>a</i>]benzimidazole","Acta Crystallographica Section C","1996","52","10","2531","2533","10.1107/S0108270196006026","","","0.71073","MoKα","","0.0369","0.0321","","0.0894","0.0844","","","","1.09","1.09","1.09","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005536","12.314","0.001","12.425","0.001","14.855","0.005","90","","90","","90","","2272.8","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,2R)-N-Benzyl-N-[(N-tert-butoxycarbonyl-2,2-dimethyloxazol-4-yl)- (furan-2-yl)methyl]hydroxylamine","","- C22 H30 N2 O5 -","- C22 H30 N2 O5 -","- C88 H120 N8 O20 -","4","1","NA1237","Merino, P.; Merchan, F. L.; Tejero, T.; Lanaspa, A.","Chiral Hydroxylamines. II. (1<i>R</i>,2<i>R</i>)-<i>N</i>-Benzyl-<i>N</i>-[(3-<i>tert</i>-butoxycarbonyl-2,2-dimethyloxazol-4-yl)(furan-2-yl)methyl]hydroxylamine","Acta Crystallographica Section C","1996","52","10","2536","2538","10.1107/S0108270196005185","","","0.71073","MoKα","","0.0387","0.0375","","0.1049","0.103","","","","1.045","1.05","1.05","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005537","7.016","0.002","13.603","0.002","11.551","0.002","90","","107.16","0.01","90","","1053.3","0.4","292","","292","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Tetrakis(Thiourea)cadmium perrhenate","","- C4 H16 Cd N8 O8 Re2 S4 -","- C4 H16 Cd N8 O8 Re2 S4 -","- C8 H32 Cd2 N16 O16 Re4 S8 -","2","0.5","NA1239","Petrova, R.; Angelova, O.; Bakardjieva, S.; Macícek, J.","Molecular Adducts of Inorganic Salts. VII. Cd(ReO~4~)~2~.4tu (tu = Thiourea)","Acta Crystallographica Section C","1996","52","10","2432","2434","10.1107/S0108270196007093","","","0.71073","MoKα","","0.031","0.024","","0.035","0.032","","","","0.946","0.898","0.898","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005538","8.281","0.002","20.914","0.004","9.549","0.002","90","","97.46","0.02","90","","1639.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(3,5-Ditrifluoromethylphenyl)-1H,3H-thiazolo[3,4-a]benzimidazole","","- C17 H10 F6 N2 S -","- C17 H10 F6 N2 S -","- C68 H40 F24 N8 S4 -","4","1","NA1245","Bruno, G.; Monforte, A. M.; Nicoló, F.; Scopelliti, R.; Zappalá, M.","1-[3,5-Bis(trifluoromethyl)phenyl]-1<i>H</i>,3<i>H</i>-thiazolo[3,4-<i>a</i>]benzimidazole","Acta Crystallographica Section C","1996","52","10","2533","2535","10.1107/S0108270196006476","","","0.71073","MoKα","","0.0615","0.0377","","0.086","0.0703","","","","0.964","0.964","0.964","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005539","8.707","0.001","9.313","0.001","19.869","0.001","90","","90","","90","","1611.1","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,2S)-2-Benzamido-2-methoxycarbonylcyclohexan-5-one-1-carboxylic acid","","- C16 H17 N O6 -","- C16 H17 N O6 -","- C64 H68 N4 O24 -","4","1","NA1251","Buñuel, E.; Cativiela, C.; Díaz-de-Villegas, M. D.; Gálvez, J. A.","A New Conformationally Restricted Aspartic Acid Analogue with a Cyclohexanone Skeleton","Acta Crystallographica Section C","1996","52","10","2641","2644","10.1107/S0108270196008712","","","0.71069","MoKα","","0.0346","0.0321","","0.0871","0.0848","","","","1.063","1.072","1.072","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005540","11.344","0.002","11.344","0.002","4.75","0.002","90","","90","","120","","529.4","0.3","293","","","","","","","","","","","3","P 3 2 1","P 3 2""","150","","","","- Ge4 O9 Sr -","- Ge4 O9 Sr -","- Ge12 O27 Sr3 -","3","0.5","OH1096","Nishi, F.","Strontium Tetragermanate, SrGe~4~O~9~","Acta Crystallographica Section C","1996","52","10","2393","2395","10.1107/S0108270196006737","","","0.71073","MoKα","","","0.049","","","0.052","","","","","1.35","1.35","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005541","5.5464","0.00013","10.472","0.0003","3.87959","0.00008","90","","90","","90","","225.334","0.01","296","","296","","","","","","","","","3","P b a m","-P 2 2ab","55","","dicopper(II) lanthanum cuprate","","- Cu2 La2 O5 -","- Cu2 La2 O5 -","- Cu4 La4 O10 -","2","0.25","OH1097","Khasanova, N. R.; Izumi, F.; Hiroi, Z.; Takano, M.; Huang, Q.; Santoro, A.","Redetermination of the Structure of La~2~Cu~2~O~5~ by Neutron Powder Diffraction","Acta Crystallographica Section C","1996","52","10","2381","2384","10.1107/S0108270196006646","","neutron","1.5396","neutron","","0.0171","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005542","5.53528","0.00014","10.449","0.0003","3.87265","0.00008","90","","90","","90","","223.987","0.01","10","","10","","","","","","","","","3","P b a m","-P 2 2ab","55","","dicopper(II) lanthanum cuprate","","- Cu2 La2 O5 -","- Cu2 La2 O5 -","- Cu4 La4 O10 -","2","0.25","OH1097","Khasanova, N. R.; Izumi, F.; Hiroi, Z.; Takano, M.; Huang, Q.; Santoro, A.","Redetermination of the Structure of La~2~Cu~2~O~5~ by Neutron Powder Diffraction","Acta Crystallographica Section C","1996","52","10","2381","2384","10.1107/S0108270196006646","","neutron","1.5396","neutron","","0.0263","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005543","11.23","0.03","9.66","0.03","8.89","0.03","90","","98.2","0.03","90","","955","5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(pentafluoro-phenyl)-trifluoro-acetamide","","- C8 H F8 N O -","- C8 H F8 N O -","- C32 H4 F32 N4 O4 -","4","1","PA1226","Mahoui, A.; Lapasset, J.; Moret, J.","α,α,α,2,3,4,5,6-Octafluoroacetanilide","Acta Crystallographica Section C","1996","52","10","2583","2585","10.1107/S0108270196005689","","","1.5418","CuKα","","0.0561","0.0476","","0.1234","0.1205","","","","1.078","1.11","1.11","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005544","7.948","0.005","10.902","0.002","8.22","0.005","90","","106.43","0.03","90","","683.2","0.6","293","","293","","","","","","","","","3","P 1 21 1","P 2yb","4","","2α,3α,7β,8β-diépoxy-trans-himachalane","","- C15 H24 O2 -","- C15 H24 O2 -","- C30 H48 O4 -","2","1","PA1232","Chiaroni, A.; Riche, C.; Benharref, A.; El Jamili, H.; Lassaba, E.","2α,3α:7β,8β-Diépoxy-<i>trans</i>-himachalane","Acta Crystallographica Section C","1996","52","10","2502","2504","10.1107/S0108270196005768","","","1.5418","CuKα","","","0.058","","","0.065","","","","","0.6","0.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005545","8.537","0.002","8.221","0.002","10.364","0.002","90","","104.31","0.02","90","","704.8","0.3","293","","293","","","","","","","","","3","P 1 21 1","P 2yb","4","","2α ,3α ,6α ,7α-diépoxyhimachalane","","- C15 H24 O2 -","- C18 H24 O2 -","- C36 H48 O4 -","2","1","PA1235","Chiaroni, A.; Riche, C.; Benharref, A.; Lassaba, E.; Baouid, A.","2α,3α:6α,7α-Diépoxyhimachalane","Acta Crystallographica Section C","1996","52","10","2504","2507","10.1107/S0108270196005756","","","1.5418","CuKα","","","0.059","","","0.07","","","","","0.59","0.59","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005546","10.566","0.001","7.88","0.001","11.572","0.001","90","","99.18","0.01","90","","951.15","0.17","298","","298","","","","","","","","","3","P 1 21 1","P 2yb","4","","2,4,6-triphenyl pyran-3,5-dicarboxaldehyde","","- C25 H18 O3 -","- C25 H18 O3 -","- C50 H36 O6 -","2","1","PA1236","Selladurai, S.; Murugesan, R.; Subramanian, K.; Chen, Y. S.; Rao, S. N.; Holt, E. M.","2,4,6-Triphenyl-4<i>H</i>-pyran-3,5-dicarboxaldehyde","Acta Crystallographica Section C","1996","52","10","2599","2601","10.1107/S0108270196006798","","","0.71073","MoKα","","","0.0377","","","0.0446","","","","","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005547","5.8088","0.0003","17.976","0.002","18.213","0.002","90","","90","","90","","1901.8","0.3","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","9β-tert-butoxy-4(E)-ethylidene-8β-methyl-5-oxobicyclo[6.3.0]undean-2β- carboxylic Acid Methyl Ester","","- C20 H32 O4 -","- C20 H32 O4 -","- C80 H128 O16 -","4","1","SK1014","Mague, J. T.; Li, C.-J.; Chen, D.-L.; Lu, Y.-Q.; Haberman, J. X.","Product of a Novel Carbocyclic Enlargement in Aqueous Media: 9β-<i>tert</i>-Butoxy-4-(<i>E</i>)-ethylidene-8β-methyl-5-oxobicyclo[6.3.0]undecan-2β-carboxylic Acid Methyl Ester","Acta Crystallographica Section C","1996","52","10","2597","2599","10.1107/S0108270196006270","","","0.71073","MoKα,graphitemonochromated","","0.076","0.043","","","0.06","","","","","2.006","2.006","","","","","has coordinates,has Fobs","208466","2020-10-21","18:00:00",""
"2005548","9.973","0.001","10.741","0.001","27.527","0.003","90","","90","","90","","2948.7","0.5","198","2","198","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2aS,3S,6S,7S,7bR)-2-oxo-6-[(1R,2S)-2-phenylcyclohexyloxy]-8- [(dimethylphenyl)silyl]-2a,3,6,7,7a,7b-hexahydro-2H-1,4,5-trioxa-4a- azacyclopenta[cd]indene-3-carboxylic Acid 1-Methylethyl Ester","","- C31 H39 N O7 Si -","- C31 H39 N O7 Si -","- C124 H156 N4 O28 Si4 -","4","1","SK1015","Thorarensen, A.; Swiss, K. A.; Denmark, S. E.","(2a<i>S</i>,3<i>S</i>,6<i>S</i>,7<i>S</i>,7b<i>R</i>)-7-[(Dimethylphenyl)silyl]-2-oxo-6-[(1<i>R</i>,2<i>S</i>)-2-phenylcyclohexyloxy]-2a,3,6,7,7a,7b-hexahydro-2<i>H</i>-1,4,5-trioxa-4a-azacyclopenta[<i>cd</i>]indene-3-carboxylic Acid 1-Methylethyl Ester","Acta Crystallographica Section C","1996","52","10","2558","2561","10.1107/S0108270196005434","","","0.71073","MoKα","","0.1905","0.0905","","0.1653","0.1245","","","","1.116","1.236","1.236","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005549","16.68","0.001","8.886","0.001","8.054","0.001","90","","90","","90","","1193.8","0.2","200","2","200","2","","","","","","","","3","P b c n","-P 2n 2ab","60","diethyl 2,5-dihydroxyterephthalate","","","- C12 H14 O6 -","- C12 H14 O6 -","- C48 H56 O24 -","4","0.5","SK1017","Näther, C.; Bock, H.; Seitz, W.; Nagel, N.","Diethyl 2,5-Dihydroxyterephthalate at 200K","Acta Crystallographica Section C","1996","52","10","2631","2633","10.1107/S0108270196005306","","","0.71073","MoKα","","0.0575","0.0377","","0.1185","0.1066","","","","1.04","1.097","1.097","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005550","7.912","0.004","10.307","0.005","11.533","0.009","69.09","0.04","87.72","0.03","84.06","0.06","873.8","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2,2'-Bipyridinium salt of benzene-1,2,4,5-tetracarboxylic acid","","- C20 H14 N2 O8 -","- C20 H14 N2 O8 -","- C40 H28 N4 O16 -","2","1","SK1020","Mrvos-Sermek, D.; Popovic, Z.; Matkovic-Calogovic, D.","Hydrogen Bonding in the 2,2'-Bipyridinium Salt of 1,2,4,5-Benzenetetracarboxylic Acid (Pyromellitic Acid)","Acta Crystallographica Section C","1996","52","10","2538","2541","10.1107/S0108270196003940","","","0.71073","MoKα","","0.0993","0.0434","","0.125","0.1032","","","","1.008","1.14","1.14","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005551","7.135","0.001","8.338","0.002","10.089","0.002","80.53","0.03","71.16","0.03","67.56","0.03","524.5","0.2","293","2","153","1","","","","","","","","5","P -1","-P 1","2","","Tetraaqua(orotato)magnesium(II) Hydrate","","- C5 H12 Mg N2 O9 -","- C5 H12 Mg N2 O9 -","- C10 H24 Mg2 N4 O18 -","2","1","SK1023","Mutikainen, I.; Hämäläinen, R.; Klinga, M.; Orama, O.; Turpeinen, U.","Triclinic Form of Tetraaqua(orotato-<i>N</i>,<i>O</i>)magnesium(II) Hydrate at 153K","Acta Crystallographica Section C","1996","52","10","2480","2482","10.1107/S0108270196006567","","","0.71073","MoKα","","0.0334","0.0328","","0.0859","0.0855","","","","1.06","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005552","11.852","0.004","15.559","0.003","11.254","0.004","98.3","0.02","115.7","0.03","89.4","0.02","1847.3","1.1","150","2","150","","","","","","","","","4","P -1","-P 1","2","","diethylgallium","","- C44 H46 Ga2 O2 -","- C44 H46 Ga2 O2 -","- C88 H92 Ga4 O4 -","2","1","SK1027","Webster, M.; Browning, D. J.; Corker, J. M.","Bis[(μ-2,6-diphenylphenoxido-<i>O</i>:<i>O</i>)diethylgallium]","Acta Crystallographica Section C","1996","52","10","2439","2441","10.1107/S010827019600755X","","","0.71069","MoKα","","0.0409","0.0313","","0.091","0.0844","","","","0.985","1.002","1.002","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005553","8.7043","0.001","14.988","0.002","5.5288","0.0006","93.431","0.011","99.22","0.009","100.388","0.01","697.37","0.15","150","2","150","","","","","","","","","4","P -1","-P 1","2","","Bis(1,2-bis(n-butylthioethylene)-1,2-dithiolato-S,S')-nickel","","- C20 H36 Ni S8 -","- C20 H36 Ni S8 -","- C20 H36 Ni S8 -","1","0.5","SK1028","Charlton, A.; Kilburn, J. D.; Underhill, A. E.; Webster, M.","A Second Triclinic Polymorph of Bis[1,2-bis(<i>n</i>-butylthio)ethylene-1,2-dithiolato-<i>S</i>,<i>S</i>']nickel","Acta Crystallographica Section C","1996","52","10","2441","2442","10.1107/S010827019600769X","","","0.71069","MoKα","","0.0578","0.0343","","0.1047","0.089","","","","1.067","1.068","1.068","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005554","20.753","0.007","4.017","0.001","17.476","0.003","90","","93.25","0.02","90","","1454.5","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","furylbenzothiazol","3,4-bis-(2-benzothiazolyl)furan","","- C18 H10 N2 O S2 -","- C18 H10 N2 O S2 -","- C72 H40 N8 O4 S8 -","4","1","SK1029","Mrvos-Sermek, D.; Tralic-Kulenovic, V.; Nagl, A.; Fiser-Jakic, L.","3,4-Bis(1,3-benzothiazol-2-yl)furan","Acta Crystallographica Section C","1996","52","10","2541","2543","10.1107/S0108270196005446","","","0.7107","MoKα","","0.0448","0.044","","0.1088","0.1079","","","","1.036","1.036","1.036","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005555","18.616","0.003","18.616","0.003","7.448","0.001","90","","90","","90","","2581.1","0.7","293","2","293","2","","","","","","","","6","I -4 2 d","I -4 2bw","122","","tetrakis(N-methylimdazole)zinc(II) perchlorate","","- C16 H24 Cl2 N8 O8 Zn -","- C16 H24 Cl2 N8 O8 Zn -","- C64 H96 Cl8 N32 O32 Zn4 -","4","0.25","SK1031","Chen, X.-M.; Huang, X.-C.; Xu, Z.-T.; Huang, X.-Y.","Tetrakis(1-methylimidazole-<i>N</i>^3^)zinc(II) Diperchlorate","Acta Crystallographica Section C","1996","52","10","2482","2484","10.1107/S0108270196007706","","","0.71069","MoKα","","0.0587","0.0534","","0.1509","0.1454","","","","1.112","1.153","1.153","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005556","10.388","0.002","16.781","0.007","11.234","0.002","90","","115.6","0.02","90","","1766.1","0.9","138","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C30 H30 O2 Te6 Ti6 -","- C30 H30 O2 Te6 Ti6 -","- C60 H60 O4 Te12 Ti12 -","2","0.5","SZ1028","Gindelberger, D. E.","[(CpTi)~6~(μ~3~-Te)~6~(μ~3~-O)~2~]","Acta Crystallographica Section C","1996","52","10","2493","2495","10.1107/S0108270196004854","","","0.71073","MoKα","","","0.0318","","","0.0373","","","","","1.543","1.543","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005557","7.1195","0.0006","9.5287","0.0008","12.3059","0.0008","82.08","0.007","75.48","0.006","76.48","0.007","782.98","0.11","295","","295","","","","","","","","","3","P -1","-P 1","2","","","","- C10 H6 O3 -","- C10 H6 O3 -","- C40 H24 O12 -","4","2","AB1365","Dekkers, J.; Kooijman, H.; Kroon, J.; Grech, E.","2-Hydroxy-1,4-naphthoquinone","Acta Crystallographica Section C","1996","52","11","2896","2899","10.1107/S0108270196007664","","","0.71073","MoKα","","","0.0424","","0.1258","0.1258","","","","1.072","1.072","1.072","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005558","39.326","0.005","5.988","0.001","15.109","0.003","90","","92.21","0.01","90","","3555.3","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H16 N2 Ni O S -","- C22 H16 N2 Ni O S -","- C176 H128 N16 Ni8 O8 S8 -","8","1","AB1375","Elerman, Y.; Svoboda, I.","[<i>N</i>-(2-Mercaptophenyl)-2-hydroxynaphthaldiminato](pyridine)nickel(II)","Acta Crystallographica Section C","1996","52","11","2705","2707","10.1107/S0108270196008281","","","0.71069","MoKα","","0.043","0.026","","0.07","0.064","","","","1.029","1.062","1.062","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005559","13.907","0.001","14.476","0.001","17.174","0.001","80.993","0.005","87.729","0.004","74.382","0.005","3288.7","0.4","298","","","","","","","","","","","3","P -1","-P 1","2","","","","- C74 H72 S8 -","- C74 H72 S8 -","- C148 H144 S16 -","2","1","AB1379","Downing, G. A.; MacNicol, D. D.; Mallinson, P. R.; Milligan, P. K.","Octakis(3,5-dimethylphenylthio)naphthalene","Acta Crystallographica Section C","1996","52","11","2887","2889","10.1107/S0108270196007299","","","0.71069","MoKα","","","0.042","","","0.063","","","","","0.67","0.67","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2005560","8.304","0.003","11.163","0.005","11.802","0.006","102.08","0.03","98.93","0.03","109.48","0.02","978","0.8","150","0.2","150","0.2","","","","","","","","4","P -1","-P 1","2","","3-(di-isopropylamino)prop-2-enal","","- C9 H17 N O -","- C9 H15.588 N O -","- C36 H62.352 N4 O4 -","4","2","AB1382","Blake, A. J.; McNab, H.; Monahan, L. C.; Parsons, S.; Stevenson, E.","Two C-Unsubstituted Enaminals","Acta Crystallographica Section C","1996","52","11","2814","2818","10.1107/S0108270196007020","","","0.71073","MoKα","","0.0897","0.0638","","0.1844","0.1598","","","","0.984","1.021","1.021","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005561","8.3438","0.0008","14.8912","0.0015","15.5405","0.0013","90","","90","","90","","1930.9","0.3","150","0.2","150","0.2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-[N-(1,2,3,4-tetrahydroquinolinyl)]prop-2-enal","","- C12 H13 N O -","- C12 H13 N O -","- C96 H104 N8 O8 -","8","1","AB1382","Blake, A. J.; McNab, H.; Monahan, L. C.; Parsons, S.; Stevenson, E.","Two C-Unsubstituted Enaminals","Acta Crystallographica Section C","1996","52","11","2814","2818","10.1107/S0108270196007020","","","0.71073","MoKα","","0.0584","0.0345","","0.1229","0.0773","","","","1.034","1.068","1.068","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005562","12.274","0.001","8.086","0.001","19.097","0.002","90","","108.24","0.01","90","","1800.1","0.3","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H27 N O4 -","- C18 H27 N O4 -","- C72 H108 N4 O16 -","4","1","AB1385","Özbey, S.; Temel, A.; Tunouglu, N.; Uludaug, N.","Diethyl 3-Piperidino-2,7-cycloheptadiene-1,2-dicarboxylate","Acta Crystallographica Section C","1996","52","11","2890","2891","10.1107/S0108270196008189","","","0.71073","MoKα","","","0.0425","","","0.0433","","","","","1.22","1.22","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005563","12.175","0.002","3.845","0.002","22.715","0.001","90","","92.37","0.04","90","","1062.4","0.6","295","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 Cl2 Cu2 N2 O4 -","- C22 H20 Cl2 Cu2 N2 O4 -","- C44 H40 Cl4 Cu4 N4 O8 -","2","0.5","AB1386","Tahir, M. N.; Ülkü, D.; Atakol, O.; Akay, A.","Bis[4-(5-chloro-2-hydroxyphenylimino-<i>N</i>,<i>O</i>:<i>O</i>)-2-penten-2-olato(2‒)-<i>O</i>]dicopper(II)","Acta Crystallographica Section C","1996","52","11","2676","2678","10.1107/S0108270196008529","","","0.71073","MoKα","","","0.049","","","0.052","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005564","8.021","0.002","16.864","0.003","8.311","0.002","90","","90","","90","","1124.2","0.4","293","2","293","2","","","","","","","","5","P b c m","-P 2c 2b","57","","catena-((μ~2~-succinato)(diethylenetriamine)copper(II))","","- C8 H17 Cu N3 O4 -","- C8 H17 Cu N3 O4 -","- C32 H68 Cu4 N12 O16 -","4","0.5","AB1387","Pajunen, A.; Pajunen, S.; Kivikoski, J.; Valkonen, J.","<i>catena</i>-Poly[[(diethylenetriamine-<i>N</i>,<i>N</i>',<i>N</i>'')copper(II)]-μ-succinato-<i>O</i>,<i>O</i>':<i>O</i>'']","Acta Crystallographica Section C","1996","52","11","2689","2691","10.1107/S0108270196008505","","","0.71069","MoKα","","0.0414","0.0279","","0.089","0.0685","","","","1.163","1.047","1.047","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005565","26.542","0.004","10.089","0.001","20.922","0.003","90","","133.07","0.02","90","","4092.8","1.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","9-(2-Nitrophenyl)-3,3',6,6'-tetramethylhexahydroacridin-1,8-dione","","- C23 H26 N2 O4 -","- C23 H26 N2 O4 -","- C184 H208 N16 O32 -","8","1","AB1390","Brito-Arias, M.; Ramirez, G.; Rivas, R. E.; Molins, E.; Maniukiewicz, W.","3,3,6,6-Tetramethyl-9-(2-nitrophenyl)-3,4,5,6,9,10-hexahydroacridine-1,8(2<i>H</i>,7<i>H</i>)-dione","Acta Crystallographica Section C","1996","52","11","2811","2814","10.1107/S0108270196008530","","","0.71069","MoKα","","0.1022","0.0625","","0.2188","0.1722","","","","0.996","1.07","1.07","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005566","11.568","0.002","13.156","0.003","15.387","0.005","78.54","0.03","80.39","0.02","81.39","0.02","2246.3","1","294","1","294","1","","","","","","","","6","P -1","-P 1","2","","3-Chloro-3,3-bis(triphenylphosphine)-1,2-dicarba-3-rhoda-closo-dodecaborane 1.1(dichloromethane) solvate","","- C39.1 H43.2 B9 Cl3.2 P2 Rh -","- C38 H41 B9 Cl P2 Rh -","- C76 H82 B18 Cl2 P4 Rh2 -","2","1","AB1408","Ferguson, G.; McEneaney, P. A.; Spalding, T. R.","3-Chloro-3,3-bis(triphenylphosphine-<i>P</i>)-1,2-dicarba-3-rhoda-<i>closo</i>-dodecaborane‒ Dichloromethane (1/1.1)","Acta Crystallographica Section C","1996","52","11","2710","2713","10.1107/S010827019600950X","","","0.7107","MolybdenumKα","","0.1458","0.061","","0.1364","0.1219","","","","0.852","1.193","1.193","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005567","6.222","0.002","9.778","0.002","5.966","0.002","102.83","0.02","108.44","0.02","96.57","0.02","328.97","0.18","291","","291","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H16 F4 O4 -","- C12 H16 F4 O4 -","- C12 H16 F4 O4 -","1","0.5","BK1152","Swenson, D. C.; Davis, C. R.; Burton, D. J.","Three 1,4-<i>trans</i>-Substituted Cyclohexanes","Acta Crystallographica Section C","1996","52","11","2844","2847","10.1107/S0108270196008104","","","0.71073","MoKα","","0","0.039","","","0.046","","","","","1.052","1.052","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005568","8.807","0.003","11.447","0.003","10.644","0.003","90","","98.54","0.03","90","","1061.2","0.6","291","","291","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C10 H14 F6 -","- C10 H14 F6 -","- C20 H28 F12 -","2","0.5","BK1152","Swenson, D. C.; Davis, C. R.; Burton, D. J.","Three 1,4-<i>trans</i>-Substituted Cyclohexanes","Acta Crystallographica Section C","1996","52","11","2844","2847","10.1107/S0108270196008104","","","0.71073","MoKα","","","0.038","","","0.049","","","","","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005569","6.808","0.001","10.747","0.002","7.929","0.001","90","","102.4","0.01","90","","566.6","0.15","291","","291","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 F8 -","- C10 H12 F8 -","- C20 H24 F16 -","2","0.5","BK1152","Swenson, D. C.; Davis, C. R.; Burton, D. J.","Three 1,4-<i>trans</i>-Substituted Cyclohexanes","Acta Crystallographica Section C","1996","52","11","2844","2847","10.1107/S0108270196008104","","","0.71073","MoKα","","","0.034","","","0.044","","","","","1.008","1.008","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005570","21.803","0.002","12.319","0.002","7.898","0.002","90","0.02","92.11","0.02","90","0.02","2119.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","praseodymium(III)tris(2,6-difluorobenzoate)monohydrate","catena-poly[aquapraseodymium(III)-μ2$-2,6-difluorobenzoato-O,O'- μ2$-2,6-difluorobenzoato-Prκ2$O,O',Pr'κO-μ2$-2,6-difluoro benzoato-PrκO,O',Pr''kappaO]","","- C21 H11 F6 O7 Pr -","- C21 H11 F6 O7 Pr -","- C84 H44 F24 O28 Pr4 -","4","1","BK1180","Karipides, A. G.; Jai-nhuknan, J.; Cantrell, J. S.","Aquatris(2,6-difluorobenzoato)praseodymium(III)","Acta Crystallographica Section C","1996","52","11","2740","2742","10.1107/S0108270196008852","","","0.71069","MoKα","","0.0391","0.0316","","0.0834","0.0757","","","","1.148","1.114","1.114","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005571","9.962","0.002","11.4","0.003","11.897","0.002","83.93","0.02","87.19","0.02","86.95","0.02","1340.3","0.5","294","","294","","","","","","","","","4","P -1","-P 1","2","","Tris(2-(2-methoxyethoxy)phenyl)phosphine oxide monohydrate","","- C27 H35 O8 P -","- C29 H40 O9 P -","- C58 H80 O18 P2 -","2","1","BK1225","Livant, P. D.; Mao, J.; Webb, T. R.","Tris[2-(2-methoxyethoxy)phenyl]phosphine Oxide Monohydrate","Acta Crystallographica Section C","1996","52","11","2924","2927","10.1107/S0108270196008906","","","0.71073","MoKα","","0.06","0.0516","","0.0881","0.0843","","","","","1.46","1.46","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005572","7.755","0.006","15.352","0.004","13.508","0.009","90","","95.73","0.06","90","","1600.2","1.7","211","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(1:1) p-nitroaniline/3,5-dinitromethyl salicylate co-crystal","","- C14 H12 N4 O9 -","- C14 H12 N4 O9 -","- C56 H48 N16 O36 -","4","1","BK1232","Huang, K.-S.; Britton, D.; Etter, M. C.","<i>p</i>-Nitroaniline‒3,5-Dinitromethyl Salicylate (1:1) Co-Crystal","Acta Crystallographica Section C","1996","52","11","2868","2871","10.1107/S0108270196008864","","","0.71073","MoKα","","","0.051","","","0.067","","","","","1.8","1.8","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005573","19.05","0.002","8.9927","0.0008","10.418","0.002","90","","101.05","0.01","90","","1751.6","0.4","295","","293","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Triphenylphosphinecarbomethoxymethylene","","- C21 H19 O2 P -","- C21 H19 O2 P -","- C84 H76 O8 P4 -","4","1","BK1237","Boyle, P. D.","Methyl Triphenylphosphoranylideneacetate: a Redetermination","Acta Crystallographica Section C","1996","52","11","2859","2861","10.1107/S0108270196007561","","","0.71069","MolybdenumKα","","0.042","0.042","","0.051","0.051","","","","","1.61","1.61","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005574","9.634","0.003","6.5478","0.0008","8.474","0.001","90","","98.86","0.02","90","","528.17","0.19","190","","190","","","","","","","","","3","P 1 2/m 1","-P 2y","12","","","","- C6 H8 O2 -","- C6 H8 O2 -","- C24 H32 O8 -","4","1","BK1244","Pinkerton, A. A.; le Drian, C.; Vogel, P.","Torturing the 7-Oxabicyclo[2.2.1]heptane Skeleton with an Oxetane Ring: 4,7-Dioxatricyclo[3.2.1.0^3,6^]octane at 190K","Acta Crystallographica Section C","1996","52","11","2927","2929","10.1107/S010827019600889X","","","0.7093","MoKα","","0.035","0.032","","","0.051","","","","","2.81","2.81","","","","","has coordinates","198533","2020-10-21","18:00:00",""
"2005575","10.513","0.003","11.182","0.002","11.206","0.002","90","","97.18","0.02","90","","1307","0.5","294.2","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H18 N2 S2 -","- C12 H18 N2 S2 -","- C48 H72 N8 S8 -","4","1","BK1249","Fleming, F. F.; Hussain, Z.; Mullaney, M.; Norman, R. E.; Chang, S.-C.","(8<i>R</i>,8a<i>S</i>)-Indolizidine-1-spiro-2'-(1',3'-dithiane)-8-carbonitrile","Acta Crystallographica Section C","1996","52","11","2849","2851","10.1107/S0108270196007548","","","0.7107","MoKα","","","0.06","","","0.076","","","","","1.92","1.92","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005576","5.58","0.001","4.916","0.001","30.174","0.002","90","","91.74","0.02","90","","827.3","0.2","153","","153","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2-naphthoic acid","naphthalene-2-carboxylic acid","","- C11 H8 O2 -","- C11 H9 O2 -","- C44 H36 O8 -","4","1","BK1253","Blackburn, A. C.; Fitzgerald, L. J.; Gerkin, R. E.","2-Naphthoic Acid at 153K","Acta Crystallographica Section C","1996","52","11","2862","2864","10.1107/S0108270196008876","","","0.71073","MoKα","","","0.039","","","0.047","","","","","1.74","1.74","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005577","10.066","0.0007","13.753","0.0014","14.729","0.002","66.52","0.02","80.5","0.012","75.87","0.014","1808.4","0.4","127","2","127","2","","","","","","","","5","P -1","-P 1","2","","Chloro-(2,3,7,8,12,13,17,18-octaethylporphinato)gallium(III)","","- C37.45 H46.9 Cl3.9 Ga N4 -","- C37.449 H44 Cl3.898 Ga N4 -","- C74.898 H88 Cl7.796 Ga2 N8 -","2","1","BK1254","Brancato-Buentello, K. E.; Coutsolelos, A. G.; Scheidt, W. R.","Chloro(2,3,7,8,12,13,17,18-octaethylporphinato)gallium(III)","Acta Crystallographica Section C","1996","52","11","2707","2710","10.1107/S0108270196008116","","","0.71073","MoKα","","0.1384","0.0767","","0.1884","0.1501","","","","1.025","1.047","1.047","","","","","has coordinates","198483","2020-10-21","18:00:00",""
"2005578","8.615","0.001","9.954","0.001","29.684","0.002","90","","90","","90","","2545.5","0.4","113","2","113","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Z-(O-Benzoyl)-2-aci-nitro-2-phenylacetonitrile","","- C15 H10 N2 O3 -","- C15 H10 N2 O3 -","- C120 H80 N16 O24 -","8","1","BK1280","Powell, D. R.; Hanson, P. E.; Gellman, S. H.","(<i>Z</i>)-2-(Benzoyl-<i>aci</i>-nitro)-2-phenylacetonitrile","Acta Crystallographica Section C","1996","52","11","2945","2946","10.1107/S0108270196010827","","","1.54178","CuKα","","0.0398","0.037","","0.104","0.102","","","","1.095","1.12","1.12","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005579","14.5086","0.0015","34.527","0.003","3.891","0.0008","90","","91.61","0.01","90","","1948.4","0.5","294","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19.5 H15 N5 O4.5 S -","- C19.5 H13 N5 O4.43 S -","- C78 H52 N20 O17.72 S4 -","4","1","BM0002","Zhu, Y.; Liu, B.; Guo, Q.-X.; Liu, Y.-C.","(2,4-Dinitrophenyl)(10-methyl-3-phenothiazinyl)diazene Hemimethanol Solvate","Acta Crystallographica Section C","1996","52","11","2789","2791","10.1107/S0108270196007597","","","1.54184","CuKα","","","0.075","","","0.075","","","","","1.528","1.528","","","","","has coordinates","191871","2020-10-21","18:00:00",""
"2005580","9.733","0.001","10.601","0.006","13.835","0.004","93.56","0.02","94.94","0.02","94.31","0.03","1414.8","0.9","296","","","","","","","","","","","6","P -1","-P 1","2","","","","- C29 H23 N4 P Pd S2 -","- C29 H23 N4 P Pd S2 -","- C58 H46 N8 P2 Pd2 S4 -","2","1","BM1065","Long, D.-L.; Xin, X.-Q.; Huang, X.-Y.","(Dimercaptomethylenepropanedinitrilato-<i>S</i>,<i>S</i>')(pyridine)(triphenylphosphine)palladium(II)‒Acetonitrile (1/1)","Acta Crystallographica Section C","1996","52","11","2724","2726","10.1107/S0108270196004040","","","0.71073","MoKα","","","0.037","","","0.048","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005581","4.81","0.003","11.175","0.005","10.887","0.005","90","","102.41","0.04","90","","571.5","0.5","300","1","300","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","ammonium D,L-glycerate","ammonium D,L-glycerate","","- C3 H9 N O4 -","- C3 H9 N O4 -","- C12 H36 N4 O16 -","4","1","BM1070","Popek, T.; Lis, T.","Ammonium, Potassium and Lithium Salts of D, <small>L</small>-Glyceric Acid","Acta Crystallographica Section C","1996","52","11","2716","2720","10.1107/S0108270196007044","","","0.71073","MoKα","","0.1209","0.0418","","0.1127","0.0957","","","","1.048","1.145","1.145","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005582","4.79","0.002","10.506","0.006","10.851","0.006","90","","103.69","0.05","90","","530.5","0.5","290","1","290","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","potassium D,L-glycerate","potassium D,L-glycerate","","- C3 H5 K O4 -","- C3 H5 K O4 -","- C12 H20 K4 O16 -","4","1","BM1070","Popek, T.; Lis, T.","Ammonium, Potassium and Lithium Salts of D, <small>L</small>-Glyceric Acid","Acta Crystallographica Section C","1996","52","11","2716","2720","10.1107/S0108270196007044","","","0.71073","MoKα","","0.0337","0.0337","","0.0889","","","","","1.089","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005583","5.099","0.004","11.498","0.009","8.728","0.008","90","","104.44","0.06","90","","495.5","0.7","293","1","293","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","lithium D,L-glycerate","lithium D,L-glycerate","","- C3 H5 Li O4 -","- C3 H5 Li O4 -","- C12 H20 Li4 O16 -","4","1","BM1070","Popek, T.; Lis, T.","Ammonium, Potassium and Lithium Salts of D, <small>L</small>-Glyceric Acid","Acta Crystallographica Section C","1996","52","11","2716","2720","10.1107/S0108270196007044","","","0.71073","MoKα","","0.05","0.0324","","0.0984","0.0907","","","","1.048","1.112","1.112","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005584","5.974","0.0004","8.2261","0.0007","40.685","0.004","90","","90","","90","","1999.4","0.3","293","","293","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","5-Phenylindazole","","- C13 H10 N2 -","- C13 H10 N2 -","- C104 H80 N16 -","8","1","BM1080","Hager, O.; Foces-Foces, C.; Jagerovic, N.; Elguero, J.; Trofimenko, S.","5-Phenylindazole","Acta Crystallographica Section C","1996","52","11","2894","2896","10.1107/S0108270196007068","","","1.5418","CuKα","","0.065","0.038","","0.057","0.044","","","","0.456","0.424","0.424","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005585","5.395","0.003","5.742","0.002","11.428","0.004","82.06","0.03","87.64","0.04","83.32","0.04","348.1","0.3","85","2","85","2","","","","","","","","5","P -1","-P 1","2","","sodium hydrogen bis(phosphoenolpyruvate) dihydrate","","- C6 H13 Na O14 P2 -","- C6 H13 Na O14 P2 -","- C6 H13 Na O14 P2 -","1","0.5","BM1081","Lis, T.","Acid Salts of Phosphoenolpyruvic Acid (H~3~PEP): NaH~5~(PEP)~2~.2H~2~O and KH~5~(PEP)~2~","Acta Crystallographica Section C","1996","52","11","2720","2724","10.1107/S0108270196007445","","","0.71073","MoKα","","0.031","0.0265","","0.0765","0.0741","","","","1.095","1.128","1.128","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005586","11.927","0.007","6.803","0.004","17.215","0.011","90","","101.91","0.05","90","","1366.7","1.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","potassium hydrogen bis(phosphoenolpyruvate)","","- C6 H9 K O12 P2 -","- C6 H9 K O12 P2 -","- C24 H36 K4 O48 P8 -","4","1","BM1081","Lis, T.","Acid Salts of Phosphoenolpyruvic Acid (H~3~PEP): NaH~5~(PEP)~2~.2H~2~O and KH~5~(PEP)~2~","Acta Crystallographica Section C","1996","52","11","2720","2724","10.1107/S0108270196007445","","","0.71073","MoKα","","0.0832","0.0361","","0.1086","0.0954","","","","1.011","1.129","1.129","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005587","7.134","0.001","12.152","0.002","13.304","0.001","90","","90","","90","","1153.4","0.3","293","2","","","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C6 H6 O3 -","- C6 H6 O3 -","- C48 H48 O24 -","8","2","","Burgess, J.; Fawcett, J.; Russell, D. R.; Hider, R. C.; Hossain, M. B.; Stoner, C. R.; van der Helm, D.","Two Polymorphic Forms of 3-Hydroxy-2-methyl-4H-pyran-4-one (Maltol)","Acta Crystallographica Section C","1996","52","11","2917","2920","10.1107/S0108270196007081","","","","","","","","","","","","","","","","","","","","","has coordinates","175355","2020-10-21","18:00:00",""
"2005588","7.166","0.002","35.909","0.01","6.982","0.002","90","","109.79","0.03","90","","1690.5","0.9","163","2","163","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Maltol","","","- C6 H6 O3 -","- C6 H6 O3 -","- C72 H72 O36 -","12","3","BM1083","Burgess, J.; Fawcett, J.; Russell, D. R.; Hider, R. C.; Hossain, M. B.; Stoner, C. R.; van der Helm, D.","Two Polymorphic Forms of 3-Hydroxy-2-methyl-4<i>H</i>-pyran-4-one (Maltol)","Acta Crystallographica Section C","1996","52","11","2917","2920","10.1107/S0108270196007081","","","1.54178","CuKα","","0.0581","0.0434","","0.1274","0.1151","","","","1.071","1.078","1.078","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005589","23.826","0.007","10.098","0.004","9.881","0.004","90","","90","","90","","2377.3","1.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2(R)-ethoxy-4(R)-(1,2;3,4-di-O-isopropylidene-a-D-galacto-1,5-pyranose-5-yl) -6-(thiazol-2-yl)-3,4-dihydro-2H-pyrane.","","- C21 H31 N O8 S -","- C21 H31 N O8 S -","- C84 H124 N4 O32 S4 -","4","1","BM1086","Ianelli, S.; Nardelli, M.","Directly Linked <i>C</i>-Disaccharides: Structures of Two 3,4-Dihydro-2<i>H</i>-pyran Derivatives","Acta Crystallographica Section C","1996","52","11","2853","2857","10.1107/S010827019600827X","","","1.54178","CuKα","","0.0693","0.0313","","0.0603","0.0497","","","","0.749","0.904","0.904","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005590","17.339","0.004","16.43","0.005","7.222","0.003","90","","90","","90","","2057.4","1.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2(R)-ethoxy-4(S)-(1,2;3,4-di-O-isopropylidene-a-D-galacto-1,5-pyranose-5-yl) -6-formyl-3,4-dihydro-2H-pyrane.","","- C19 H28 O8 -","- C19 H28 O8 -","- C76 H112 O32 -","4","1","BM1086","Ianelli, S.; Nardelli, M.","Directly Linked <i>C</i>-Disaccharides: Structures of Two 3,4-Dihydro-2<i>H</i>-pyran Derivatives","Acta Crystallographica Section C","1996","52","11","2853","2857","10.1107/S010827019600827X","","","1.54178","CuKα","","0.092","0.0284","","0.0508","0.0409","","","","0.638","0.797","0.797","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005591","13.495","0.001","9.666","0.01","19.718","0.001","90","","109.108","0.005","90","","2430","3","130","","130","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C25 H29 N O3 Sn -","- C25 H29 N O3 Sn -","- C100 H116 N4 O12 Sn4 -","4","1","BM1087","Meetsma, A.; Dijkstra, H. P.; ten Have, R.; van Leusen, A. M.","An Unexpected Trimethylstannylpyrrole from a Stannylated Derivative of Tosylmethyl Isocyanide (TosMIC) and Chalcone","Acta Crystallographica Section C","1996","52","11","2747","2750","10.1107/S0108270196009286","","","0.71073","MoKα","","0.0338","0.0249","","0.0689","0.0586","","","","1.071","1.083","1.083","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005592","5.428","0.002","9.747","0.003","16.115","0.002","90","","94.336","0.004","90","","850.2","0.4","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H6 Ag2 N4 O12 -","- C14 H6 Ag2 N4 O12 -","- C28 H12 Ag4 N8 O24 -","2","0.5","BM1093","Ülkü, D.; Tahir, M. N.; Movsumov, E. M.","Poly[bis(3,5-dinitrobenzoato-<i>O</i>^1^:<i>O</i>^2^)disilver(I)-<i>O</i>^2^:<i>Ag</i>;<i>Ag</i>':<i>O</i>^2'^]","Acta Crystallographica Section C","1996","52","11","2678","2680","10.1107/S0108270196009298","","","0.71073","MoKα","","","0.049","","","0.04","","","","","1","1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005593","3.7491","0.0003","3.7491","0.0003","10.4122","0.0004","90","","90","","90","","146.351","0.017","292","","292","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- C B2 Gd Rh2 -","- C B2 Gd Rh1.868 -","- C2 B4 Gd2 Rh3.736 -","2","0.0625","BR1145","Ye, J.; Shishido, T.; Kimura, T.; Matsumoto, T.; Fukuda, T.","A New Quaternary Borocarbide, GdRh~2~B~2~C","Acta Crystallographica Section C","1996","52","11","2652","2655","10.1107/S010827019600724X","","","0.7107","MoKα","","","0.025","","","0.023","","","","","1.45","1.45","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005594","10.259","0.006","6.94","0.004","12.175","0.007","90","","106.764","0.007","90","","830","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Dipotassium diberyllium trisilicate","","","- Be2 K2 O9 Si3 -","- Be2 K2 O9 Si3 -","- Be8 K8 O36 Si12 -","4","1","BR1147","Bu, X.; Gier, T. E.; Stucky, G. D.","K~2~Be~2~Si~3~O~9~, a Potassium Beryllium Silicate Framework Built from Edge-Sharing Be‒O Tetrahedra and Three-Ring Silicate Tetrahedra","Acta Crystallographica Section C","1996","52","11","2662","2664","10.1107/S0108270196007378","","","0.7093","MolybdenumKα","","0.0361","0.0329","","0.099","0.0973","","","","1.206","1.239","1.239","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005595","9.2943","0.0011","11.6858","0.001","31.698","0.002","90","","90","","90","","3442.8","0.5","296","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-(2-Hydroxy-5-methylphenyl)salicylaldiminodiethylaminonickel(II)","","- C18 H22 N2 Ni O2 -","- C18 H22 N2 Ni O2 -","- C144 H176 N16 Ni8 O16 -","8","1","CF1069","Ercan, F.; Sari, M.; Yaǧbasan, R.; Taştekin, M.; Aksu, L.","(Diethylamine-<i>N</i>){4-methyl-2-[(2-oxidobenzylidene)amino]phenolato(2‒)-<i>O</i>,<i>N</i>,<i>O</i>'}nickel(II)","Acta Crystallographica Section C","1996","52","11","2682","2684","10.1107/S010827019600964X","","","0.71073","MoKα","","","0.065","","","0.085","","","","","1.41","1.41","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005596","15.265","0.003","11.115","0.002","10.178","0.002","90","","109.7","0.01","90","","1625.8","0.5","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Pt(2,9-dimethyl-1,10-phenantroline)(CN)~2~(ethylene)","","- C18 H16 N4 Pt -","- C18 H16 N4 Pt -","- C72 H64 N16 Pt4 -","4","0.5","CF1071","Tuzi, A.; Panunzi, B.","Dicyano(2,9-dimethyl-1,10-phenanthroline-<i>N</i>,<i>N</i>')(η^2^-ethene)platinum(II)","Acta Crystallographica Section C","1996","52","11","2745","2747","10.1107/S0108270196009651","","","0.71073","MoKα","","0.026","0.019","","","0.028","","","","","1.093","1.093","","","","","has coordinates","198476","2020-10-21","18:00:00",""
"2005597","20.977","0.004","8.943","0.002","25.504","0.005","90","","90","","90","","4784.5","1.7","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","[2-thione-3(N)-[9'(2''-methoxy-6''-chloro)acridinyl]-5-[2'-(di ethylamino)ethylthio]]-1,3,4-thiadiazole","","- C22 H23 Cl N4 O S3 -","- C22 H23 Cl N4 O S3 -","- C176 H184 Cl8 N32 O8 S24 -","8","1","CF1083","Karolak-Wojciechowska, J.; Mrozek, A.; Amiel, P.; Brouant, P.; Barbe, J.","A Potential Antiprotozoal Drug Containing Acridine and Thiadiazole Moieties","Acta Crystallographica Section C","1996","52","11","2939","2941","10.1107/S0108270196007135","","","1.54178","CuKα","","0.0978","0.064","","0.209","0.1745","","","","1.043","1.075","1.075","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005598","4.634","0.001","13.069","0.004","15.832","0.005","90","","90","","90","","958.8","0.5","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H9 N3 O S2 -","- C6 H9 N3 O S2 -","- C24 H36 N12 O4 S8 -","4","1","CF1085","Pomes Hernandez, R.; Gómez González, A.; Rosado Pérez, A.; Nápoles Frías, B. M.; Toscano, R. A.; Quincoces Suárez, J.","<i>N</i>'-[Bis(methylthio)methylene]cyanoacetohydrazide","Acta Crystallographica Section C","1996","52","11","2941","2942","10.1107/S0108270196007147","","","1.54184","CuKα","","","0.039","","","0.05","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005599","7.611","0.003","20.972","0.01","10.312","0.004","90","","99.93","","90","","1621.3","1.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(p-diethylaminophenyl)-1,3-indandione","","- C20 H19 N O2 -","- C20 H19 N O2 -","- C80 H76 N4 O8 -","4","1","CF1092","Khodorkovsky, V.; Mazor, R. A.; Ellern, A.","2-(<i>p</i>-Diethylaminobenzylidene)-1,3-indandione","Acta Crystallographica Section C","1996","52","11","2878","2880","10.1107/S0108270196007457","","","0.71073","MoKα","","0.1241","0.074","","0.2751","0.1898","","","","1.033","1.103","1.103","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2005600","7.032","0.001","10.667","0.002","11.879","0.002","102.4","0.03","102.92","0.03","95.16","0.03","839.3","0.3","293","","293","","","","","","","","","4","P -1","-P 1","2","","4-(N-benzoxy)imino-3,3-dihydro-2,2-dimethyl-6-nitro-2H-1-benzopyran","","- C18 H16 N2 O5 -","- C18 H16 N2 O5 -","- C36 H32 N4 O10 -","2","1","CF1093","Yang, Q.-C.; Li, H.-M.; Tang, Y.-Q.; Huang, W.-L.","2,2-Dimethyl-6-nitro-3,4-dihydro-2<i>H</i>-benzo[<i>b</i>]pyran-4-one <i>O</i>-Benzoyloxime","Acta Crystallographica Section C","1996","52","11","2920","2922","10.1107/S0108270196008475","","","0.71073","MolybdenumKα","","0.1234","0.0486","","","0.0556","","","","","1.6","1.6","","","","","has coordinates","190398","2020-10-21","18:00:00",""
"2005601","10.362","0.002","14.463","0.002","15.209","0.002","90","","90","","90","","2279.3","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H34 Cl2 N2 O8 -","- C18 H34 Cl2 N2 O8 -","- C72 H136 Cl8 N8 O32 -","4","1","CF1098","Wolska, I.; Borowiak, T.; Boczoń, Wł.","17β-Isopropylsparteine and 17β-Isopropyllupanine Perchlorates","Acta Crystallographica Section C","1996","52","11","2822","2826","10.1107/S0108270196008499","","","0.71073","MoKα","","0.1315","0.0653","","0.1837","0.1534","","","","1.069","1.215","1.215","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005602","8.262","0.002","13.774","0.004","8.915","0.002","90","","92.49","0.02","90","","1013.6","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H33 Cl N2 O6 -","- C18 H33 Cl N2 O6 -","- C36 H66 Cl2 N4 O12 -","2","1","CF1098","Wolska, I.; Borowiak, T.; Boczoń, Wł.","17β-Isopropylsparteine and 17β-Isopropyllupanine Perchlorates","Acta Crystallographica Section C","1996","52","11","2822","2826","10.1107/S0108270196008499","","","0.71073","MoKα","","0.0871","0.0357","","0.1371","0.0998","","","","1.125","1.02","1.02","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005603","6.728","0.002","7.94","0.007","25.085","0.009","90","","90","","90","","1340","1.3","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-[1-[(4,5-dimethyl-2-aminophenyl)imino]ethyl]phenol","","- C16 H18 N2 O -","- C16 H18 N2 O -","- C64 H72 N8 O4 -","4","1","CF1102","Corden, J. P.; Bishop, P. R.; Errington, W.; Wallbridge, M. G. H.","2-{1-[(2-Amino-4,5-dimethylphenyl)imino]ethyl}phenol","Acta Crystallographica Section C","1996","52","11","2777","2779","10.1107/S0108270196007159","","","0.71073","MoKα","","0.051","0.0382","","0.1122","0.0831","","","","1.058","1.127","1.127","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005604","13.63","0.005","10.897","0.004","14.546","0.004","90","","90.08","0.03","90","","2160.5","1.3","220","2","220","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","8,3'-methylene[7-acetoxy-4-methyl-2H-1-benzopyran-2-one] [4''-methyl-2''H- 1''-pyran-2''-one(5',6':6'',5'')-2'H-1'-benzopyran-2'-one]","","- C26 H18 O8 -","- C26 H18 O8 -","- C104 H72 O32 -","4","1","CF1115","Jain, S. C.; Talwar, S.; Kumar, R.; Babu, B. R.; Errington, W.","The Acetyl Derivative of a Novel Fries Rearrangement Product","Acta Crystallographica Section C","1996","52","11","2775","2777","10.1107/S0108270196008487","","","0.71073","MoKα","","0.0952","0.0475","","0.1172","0.0954","","","","1.021","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005605","10.432","0.002","15.737","0.003","15.406","0.003","90","","96.57","0.02","90","","2512.6","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H38 B9 P S -","- C18 H38 B9 P S -","- C72 H152 B36 P4 S4 -","4","1","CF1127","Rosair, G. M.; Welch, A. J.; Weller, A. S.","9-Dicyclohexylphenylphosphino-<i>arachno</i>-6-thiadecaborane(11)","Acta Crystallographica Section C","1996","52","11","2851","2853","10.1107/S0108270196008244","","","0.71073","MoKα","","0.1839","0.0694","","0.188","0.1316","","","","0.995","1.105","1.105","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005606","10.933","0.002","6.4597","0.0014","5.6849","0.0009","90","","90","","90","","401.49","0.13","150","0.2","150","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","1-Methyl-1,3,4-triazole","","- C3 H5 N3 -","- C3 H5 N3 -","- C12 H20 N12 -","4","0.5","CF1129","Palmer, M. H.; Parsons, S.","4-Methyl-1,2,4-triazole and 1-Methyltetrazole","Acta Crystallographica Section C","1996","52","11","2818","2822","10.1107/S0108270196008232","","","1.54184","CuKα","","0.0358","0.0352","","0.0904","0.0896","","","","1.124","1.138","1.138","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005607","5.578","0.002","6.324","0.002","10.799","0.006","90","","90","","90","","380.9","0.3","150","0.2","150","0.2","","","","","","","","3","P n m a","-P 2ac 2n","62","","1-Methyltetrazole","","- C2 H4 N4 -","- C2 H4 N4 -","- C8 H16 N16 -","4","0.5","CF1129","Palmer, M. H.; Parsons, S.","4-Methyl-1,2,4-triazole and 1-Methyltetrazole","Acta Crystallographica Section C","1996","52","11","2818","2822","10.1107/S0108270196008232","","","1.54184","CuKα","","0.036","0.0353","","0.0825","0.0817","","","","1.138","1.152","1.152","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005608","10.752","0.001","8.711","0.002","16.646","0.001","90","","94.4","0.1","90","","1554.5","0.4","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 O7 -","- C18 H16 O7 -","- C72 H64 O28 -","4","1","DE1027","Lakshmi, S.; Kumar, S.; Senthilselvan, J.; Subramanian, K.","Dalspinosin","Acta Crystallographica Section C","1996","52","11","2873","2875","10.1107/S0108270196007652","","","0.71073","MoKα","","","0.0399","","","0.0998","","","","","1.048","1.048","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005609","5.184","0.001","15.569","0.002","10.053","0.0015","90","","93.64","0.02","90","","809.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-hydroxy-2,1λ^5^-benzoxarsol-3-one monohydrate","","- C7 H7 As O4 -","- C7 H7 As O4 -","- C28 H28 As4 O16 -","4","1","DE1033","Hundal, M. S.; Hundal, G.; Parmar, S. S.","1-Hydroxy-2,1λ^5^-benzoxarsol-3-one Monohydrate","Acta Crystallographica Section C","1996","52","11","2726","2728","10.1107/S0108270196007640","","","0.71073","MoKα","","0.0807","0.0442","","0.1037","0.0901","","","","1.001","1.077","1.077","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005610","9.8597","0.0008","11.522","0.002","9.333","0.001","92.19","0.01","115.18","0.008","75.94","0.01","928.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(o-phénylèneamineammonium) Bis(o-phénylènediammonium) cyclo-Hexaphosphate Dihydrate","","- C24 H42 N8 O20 P6 -","- C24 H42 N8 O20 P6 -","- C24 H42 N8 O20 P6 -","1","0.5","DU1132","Soumhi, E. H.; Jouini, T.","Bis(<i>o</i>-aminophénylammonium) Bis(<i>o</i>-phénylènediammonium) <i>cyclo</i>-Hexaphosphate Dihydrate","Acta Crystallographica Section C","1996","52","11","2802","2805","10.1107/S0108270196003770","","","0.71069","MoKα","","0.0356","0.0295","","0.0806","0.0771","","","","1.082","1.108","1.108","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005611","10.8997","0.0007","10.8997","0.0007","42.817","0.004","90","","90","","90","","5086.8","0.7","293","2","293","2","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","Beryllium tetrahydrogenorthoperiodate tetrahydrate","","- Be H16 I2 O16 -","- Be H16 I2 O16 -","- Be16 H256 I32 O256 -","16","0.5","DU1154","Zhang, Z.; Lutz, H. D.; Georgiev, M.; Maneva, M.","The First Beryllium Periodate: Be(H~4~IO~6~)~2~.4H~2~O","Acta Crystallographica Section C","1996","52","11","2660","2662","10.1107/S0108270196006762","","","0.7107","MoKα","","0.0331","0.0286","","0.087","0.0844","","","","1.344","1.379","1.379","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005612","8.6233","0.0006","8.6233","0.0006","5.6384","0.0007","90","","90","","90","","419.28","0.08","294","","","","","","","","","","","5","P 4 b m","P 4 -2ab","100","","","","- H8 N2 O8 P V2 -","- N2 O8 P2 V3 -","- N4 O16 P4 V6 -","2","0.25","","","(NH~4~)~2~(VO)(VP)O~7~ , a Layered Structure Comprising Tetrahedral VPO~7~ Groups","Acta Crystallographica C","1996","52","","2668","2670","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005613","6.328","0.001","13.208","0.002","20.069","0.005","90","","90","","90","","1677.4","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3β,4α-dihydroxy-5β-androstan-17-one","","- C19 H30 O3 -","- C19 H30 O3 -","- C76 H120 O12 -","4","1","FG1119","Ramos Silva, M.; Paixão, J. A.; de Almeida, M.-J. M.; Tavares da Silva, E. J.; Sá e Melo, M. L.; Campos Neves, A. S.","3β,4α-Dihydroxy-5β-androstan-17-one","Acta Crystallographica Section C","1996","52","11","2892","2894","10.1107/S0108270196008839","","","0.71073","MoKα","","0.1287","0.0424","","0.1204","0.0883","","","","1.004","1.065","1.065","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005614","24.856","0.005","22.041","0.005","7.921","0.003","90","","90","","90","","4340","2","293","","293","","","","","","","","","3","P c c n","-P 2ab 2ac","56","","cis-4,5-Dihydroxy-2,3,4,5-tetraphenylcyclopent-2-en-1-one","","- C29 H22 O3 -","- C29 H22 O3 -","- C232 H176 O24 -","8","1","FG1122","Jedrzejas, M. J.; Rubin, M. D.; Baker, R. J.; Masnovi, J.; Towns, R. L. R.","<i>cis</i>-4,5-Dihydroxy-2,3,4,5-tetraphenylcyclopent-2-enone","Acta Crystallographica Section C","1996","52","11","2936","2939","10.1107/S0108270196006944","","","0.7093","MoKα","","0.081","0.081","","0.058","0.058","","","","0.99","0.99","0.99","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005615","13.102","0.002","7.077","0.002","16.233","0.002","90","","109.31","0.02","90","","1420.5","0.5","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H13 F N2 O2 -","- C17 H13 F N2 O2 -","- C68 H52 F4 N8 O8 -","4","1","FG1146","De Simone, C. A.; Pereira, M. A.; Luu-Duc, C.; Pitta, I. R.; Galdino, S. L.; Menezes, E. H. C.; Zukerman-Schpector, J.","3-Benzyl-5-(2-fluorobenzylidene)imidazolidine-2,4-dione","Acta Crystallographica Section C","1996","52","11","2771","2772","10.1107/S0108270196007317","","","0.71073","MoKα","","0.0845","0.0562","","0.1689","0.1387","","","","1.114","1.11","1.11","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2005616","14.505","0.002","10.792","0.001","18.496","0.002","90","","98.81","0.01","90","","2861.2","0.6","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,3,5-tris-{2-[(N,N-dimethylhydrazono)methyl]phenyl)}boroxin","","- C27 H33 B3 N6 O3 -","- C27 H33 B3 N6 O3 -","- C108 H132 B12 N24 O12 -","4","1","FG1192","Robinson, P. D.; Groziak, M. P.; Yi, L.","A Triphenylboroxin Derivative Possessing Two Intramolecular Chelates","Acta Crystallographica Section C","1996","52","11","2826","2830","10.1107/S010827019600697X","","","0.71069","MoKα","","","0.043","","","0.049","","","","","1.49","1.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005617","12.303","0.002","18.668","0.004","13.09","0.002","90","","112.81","0.02","90","","2771.3","0.9","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Methyl 3α-methacryloylamino-7α,12α-dihydroxy-5β-cholanoate","","- C29 H47 N O5 -","- C29 H47 N O5 -","- C116 H188 N4 O20 -","4","2","FG1198","Akram, M.; Denike, J. K.; Bélanger-Gariépy, F.; Zhu, X.-X.","Methyl 7α,12α-Dihydroxy-3α-methacryloylamino-5β-cholan-24-oate","Acta Crystallographica Section C","1996","52","11","2905","2907","10.1107/S0108270196007809","","","1.54056","CopperKα","","0.0471","0.0381","","0.0896","0.0853","","","","0.942","1.001","1.001","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005618","11.628","0.003","6.804","0.002","20.778","0.005","90","","96.12","0.03","90","","1634.5","0.8","143","2","143","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","α,α'-Bis(2-selenopyridine)-p-xylene","","- C18 H16 N2 Se2 -","- C18 H16 N2 Se2 -","- C72 H64 N8 Se8 -","4","1","FG1204","Kienitz, C. O.; Thöne, C.; Jones, P. G.","α,α'-Bis(2-pyridylseleno)-<i>p</i>-xylene","Acta Crystallographica Section C","1996","52","11","2847","2849","10.1107/S0108270196007536","","","0.71073","MoKα","","0.0451","0.0313","","0.085","0.0699","","","","1.067","1.056","1.056","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005619","7.9286","0.0016","9.7444","0.0014","20.756","0.003","90","","93.173","0.014","90","","1601.1","0.5","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(SS*,1S*,2R*)-1-(Hydroxymethyl)-2-(p-toluenesulfinyl)ferrocene","","- C18 H18 Fe O2 S -","- C18 H18 Fe O2 S -","- C72 H72 Fe4 O8 S4 -","4","1","FG1218","Robinson, P. D.; Hua, D. H.; Lagneau, N. M.; Chen, J.","(S<i>S</i>*,1<i>S</i>*,2<i>R</i>*)-1-(Hydroxymethyl)-2-(<i>p</i>-tolylsulfinyl)ferrocene","Acta Crystallographica Section C","1996","52","11","2757","2760","10.1107/S0108270196010165","","","0.71069","MoKα","","","0.058","","","0.047","","","","","1.19","1.19","","","","","has coordinates","191860","2020-10-21","18:00:00",""
"2005620","16.149","0.008","12.969","0.008","17.075","0.009","90","","110.59","0.04","90","","3348","3","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","S-(trans-3-methyloxiran-2-yl)-S-phenyl-N-(p-tolylsulfonyl)sulfoximide","","- C16 H17 N O4 S2 -","- C16 H17 N O4 S2 -","- C128 H136 N8 O32 S16 -","8","2","FG1221","Clegg, W.; Elsegood, M. R. J.; Jackson, R. F. W.; Bailey, P. L.; Briggs, A. D.","A Sulfoximidooxirane","Acta Crystallographica Section C","1996","52","11","2781","2783","10.1107/S0108270196010141","","","0.71073","MoKα","","0.0812","0.0395","","0.1242","0.0967","","","","1.074","1.054","1.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005621","5.9653","0.0007","13.45","0.002","18.63","0.002","90","","90","","90","","1494.7","0.3","160","2","160","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-p-toluenesulfonylaziridine-(2S)-carboxylic acid tert-butyl ester","","- C14 H19 N O4 S -","- C14 H19 N O4 S -","- C56 H76 N4 O16 S4 -","4","1","FG1222","Clegg, W.; Heath, S. L.; Horsburgh, L.; Jackson, R. F. W.; Wood, A.","A Sulfonyl-Substituted Aziridine","Acta Crystallographica Section C","1996","52","11","2779","2781","10.1107/S0108270196010153","","","0.71073","MoKα","","0.0272","0.026","","0.0685","0.0674","","","","1.062","1.062","1.062","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005622","11.987","0.002","9.7183","0.0015","10.2177","0.0012","90","","119.889","0.009","90","","1032","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,1'-diacetyl-2,2'-biimidazole","","- C10 H10 N4 O2 -","- C10 H10 N4 O2 -","- C40 H40 N16 O8 -","4","0.5","HA1165","Secondo, P. M.; Hester, C. A.; Collier, H. L.; Baughman, R. G.; Cordes, A. W.","1,1'-Diacetyl-2,2'-biimidazole","Acta Crystallographica Section C","1996","52","11","2882","2883","10.1107/S0108270196008001","","","0.71073","MoKα","","0.0477","0.0388","","0.1062","0.0998","","","","1.058","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005623","4.3326","0.0012","7.966","0.003","26.889","0.017","90","","90","","90","","928","0.7","293","2","293","2","","","","","","","","3","F 2 d d","F -2d 2","43","2-Butyne-1,4-diol","2-Butyne-1,4-diol","","- C4 H6 O2 -","- C4 H6 O2 -","- C32 H48 O16 -","8","0.5","HA1166","Steiner, Th.","2-Butyne-1,4-diol","Acta Crystallographica Section C","1996","52","11","2885","2887","10.1107/S0108270196008207","","","1.54176","CuKα","","0.0416","0.0321","","0.1019","0.0879","","","","1.074","1.076","1.076","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005624","7.795","0.004","15.347","0.002","19.245","0.002","90","","99.53","0.04","90","","2270.5","1.3","298","3","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H34 Cl2 Cu N4 O9 -","- C14 H34 Cl2 Cu N4 O9 -","- C56 H136 Cl8 Cu4 N16 O36 -","4","1","HR1024","Tahirov, T. H.; Lu, T.-H.; Liao, F.-L.; Wang, S.-L.; Chen, B.-H.; Chi, T.-Y.; Chung, C.-S.","Aqua(1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')copper(II) Diperchlorate","Acta Crystallographica Section C","1996","52","11","2687","2689","10.1107/S0108270196007925","","","0.71073","MoKα","","","0.04","","","0.062","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005625","12.169","0.002","13.576","0.001","14.919","0.001","90","","90","","90","","2464.7","0.5","298","3","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H32 Co N7 S3 -","- C19 H32 Co N7 S3 -","- C76 H128 Co4 N28 S12 -","4","1","HR1025","Lu, T.-H.; Tahirov, T. H.; Chen, B.-H.; Lai, C.-Y.; Chung, C.-S.","<i>trans</i>-(5,7,7,12,14,14-Hexamethyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')di(isothiocyanato-<i>N</i>)cobalt(III) Thiocyanate","Acta Crystallographica Section C","1996","52","11","2684","2687","10.1107/S0108270196008724","","","0.71073","MoKα","","","0.051","","","0.055","","","","","1.52","1.52","","","","","has coordinates,has disorder","200181","2020-10-21","18:00:00",""
"2005626","9.166","0.002","35.341","0.004","10.101","0.003","90","","110.65","0.01","90","","3061.8","1.2","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H24 Cl3 Co N6 -","- C33 H24 Cl3 Co N6 -","- C132 H96 Cl12 Co4 N24 -","4","1","JZ1109","Castro, J. A.; Romero, J.; García-Vázquez, J. A.; Sousa, A.; Castiñeiras, A.","Tris{2-[(4-chlorophenyl)iminomethyl]pyrrolato-<i>N</i>,<i>N</i>'}cobalt(III)","Acta Crystallographica Section C","1996","52","11","2734","2736","10.1107/S0108270196008785","","","0.71073","MoKα","","","0.052","","","0.059","","","","","2.92","2.92","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005627","9.264","0.005","12.768","0.006","10.177","0.005","90","","94.19","0.02","90","","1200.5","1","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 Fe O10 P4 -","- C4 Fe O10 P4 -","- C16 Fe4 O40 P16 -","4","1","JZ1123","Jansen, M.; Clade, J.","Tetracarbonyl(tetraphosphorus hexaoxide)iron","Acta Crystallographica Section C","1996","52","11","2650","2652","10.1107/S0108270196004398","","","0.71073","MoKα","","0.0422","0.0377","","0.1046","0.0922","","","","1.068","1.097","1.097","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005628","12.474","0.002","6.3201","0.0008","12.418","0.003","90","","94.93","0.03","90","","975.4","0.3","193","1","193","1","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","Bis(1,5-cyclooctadiene)di-μ-ethoxo-dirhodium(I)","","- C20 H34 O2 Rh2 -","- C20 H34 O2 Rh2 -","- C40 H68 O4 Rh4 -","2","0.5","JZ1129","Ramm, M.; Selent, D.","Bis[(1,2,5,6-η)-1,5-cyclooctadiene]-di-μ-ethoxo-dirhodium(I)","Acta Crystallographica Section C","1996","52","11","2703","2705","10.1107/S0108270196007998","","","0.71073","MoKα","","0.0357","0.0287","","0.078","0.0752","","","","1.071","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005629","9.558","0.002","10.454","0.002","11.009","0.002","80.29","0.02","87.94","0.02","75.43","0.02","1049.4","0.4","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","(η^4^-1,3-butadiene)tricarbonyl-μ-hydrido(μ-η^1:5^-indene-1,1-diyl)- (η^5^indenyl)dimolybdenum","","- C25 H20 Mo2 O3 -","- C25 H20 Mo2 O3 -","- C50 H40 Mo4 O6 -","2","1","JZ1134","Kreiter, C. G.; Meuser, R.; Frank, W.; Müller-Becker, S.","Photochemical Reactions of Transition Metal Organyl Complexes with Olefins. 15. Tricarbonyl(η^4^-1,3-butadiene)-μ-hydrido-(μ-η^1:5^-indene-1,1-diyl)(η^5^-indenyl)-dimolybdenum(<i>Mo</i>—<i>Mo</i>)","Acta Crystallographica Section C","1996","52","11","2701","2703","10.1107/S0108270196008165","","","0.71069","MoKα","","0.0254","0.0221","","0.0501","0.0495","","","","1.875","1.927","1.927","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005630","13.061","0.001","18.9771","0.0015","9.3473","0.0009","90","","127.004","0.006","90","","1850.2","0.3","293","2","293","2","","","","","","","","3","C 1 c 1","C -2yc","9","","Chromium(III)-trimetaphosphate","","- Cr O9 P3 -","- Cr O9 P3 -","- Cr12 O108 P36 -","12","3","JZ1135","Gruss, M.; Glaum, R.","Refinement of the Superstructure of <i>C</i>-Type Chromium(III) Tris(metaphosphate), Cr(PO~3~)~3~","Acta Crystallographica Section C","1996","52","11","2647","2650","10.1107/S0108270196007056","","","0.71073","MoKα","","0.0306","0.0208","","0.0602","0.0572","","","","1.093","1.129","1.129","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005631","9.7355","0.0019","8.8451","0.0018","16.594","0.003","90","","99.91","0.03","90","","1407.6","0.5","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-bis(2,6-diisopropylphenyl)-2,2,4,4- tetramethyl-1,3,diaza-2,4-disilacyclobutane","","- C28 H46 N2 Si2 -","- C28 H46 N2 Si2 -","- C56 H92 N4 Si4 -","2","0.5","JZ1138","Shah, S. A. A.; Roesky, H. W.; Lubini, P.; Schmidt, H.-G.","1,3-Bis(2,6-diisopropylphenyl)-2,2,4,4-tetramethyl-1,3-diaza-2,4-disilacyclobutane","Acta Crystallographica Section C","1996","52","11","2810","2811","10.1107/S0108270196006865","","","0.71073","MoKα","","0.0367","0.0329","","0.0897","0.0862","","","","1.037","1.049","1.049","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005632","6.5712","0.0006","12.9917","0.0006","6.9237","0.0003","90","","102.133","0.006","90","","577.88","0.07","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","Triammonium trimetaphosphimate monohydrate","Triammonium-tri-μ-imido-cyclotriphosphate monohydrate","","- H17 N6 O7 P3 -","- H17 N6 O7 P3 -","- H34 N12 O14 P6 -","2","1","JZ1139","Stock, N.; Schnick, W.","Triammonium Trimetaphosphimate Monohydrate","Acta Crystallographica Section C","1996","52","11","2645","2647","10.1107/S0108270196006907","","","0.71073","MoKα","","0.0173","0.0167","","0.0447","0.0443","","","","1.129","1.13","1.13","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005633","9.425","0.001","10.904","0.003","20.034","0.007","90","","90","","90","","2058.9","0.9","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1S,5R,6R,8R,10R,12R)-5,8,15,15-Tetramethyl-6-phenyl-7,9-dioxa-3-thia- 4-azatetracyclo[10.2.1.0^1,10^.0^4,8^]pentadecane 3,3-Dioxide","","- C21 H29 N O4 S -","- C21 H29 N O4 S -","- C84 H116 N4 O16 S4 -","4","1","JZ1144","Bolte, M.; Strahringer, C.","(1<i>S</i>,5<i>R</i>,6<i>R</i>,8<i>R</i>,10<i>R</i>,12<i>R</i>)-5,8,15,15-Tetramethyl-6-phenyl-7,9-dioxa-3-thia-4-azatetracyclo[10.2.1.0^1,10^.0^4,8^]pentadecane 3,3-Dioxide","Acta Crystallographica Section C","1996","52","11","2805","2806","10.1107/S0108270196008840","","","1.5418","CuKα","","0.0312","0.0307","","0.0918","0.0909","","","","0.991","0.99","0.99","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005634","10.79","0.001","10.79","0.001","30.688","0.003","90","0.009","90","0.009","90","0.009","3572.8","0.6","293","2","293","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","Boc-Phe-Aminomalonaldehyde","6-benzyl-2,2-dimethyl-5,8-diaza-4,7-dioxo-9-formyl-10-hydroxy- 3-oxa-(9,10)-decen","","- C17 H22 N2 O5 -","- C17 H22 N2 O5 -","- C136 H176 N16 O40 -","8","1","KA1191","Sopková, J.; Císarová, I.; Arnold, Z.","Boc‒Phe‒Aminomalonaldehyde","Acta Crystallographica Section C","1996","52","11","2903","2905","10.1107/S0108270196008025","","","0.71073","MoKα","","0.0516","0.0347","","0.0987","0.0851","","","","1.033","1.017","1.017","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005635","5.8303","0.0007","8.039","0.001","16.026","0.002","84.55","0.01","82.82","0.01","81.91","0.01","735.54","0.16","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H17 N O S -","- C16 H17 N O S -","- C32 H34 N2 O2 S2 -","2","1","KA1196","Hartung, J.; Svoboda, I.; Fuess, H.","Balancing Conjugational Stabilization and Torsional Strain. The Solid-State Structure of a 2-Thioalkyl-Substituted Pyridine <i>N</i>-Oxide","Acta Crystallographica Section C","1996","52","11","2841","2844","10.1107/S0108270196007019","","","0.71069","MoKα","","0.0663","0.0426","","0.1257","0.1125","","","","1.038","1.079","1.079","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005636","12.801","0.004","18.168","0.004","7.866","0.004","90","","90","","90","","1829.4","1.2","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4-androsten-17beta-yl acetate-3-one","","- C21 H30 O3 -","- C21 H30 O3 -","- C84 H120 O12 -","4","1","KA1197","Böcskei, Z.; Gérczei, T.; Bodor, A.; Schwartz, R.; Náray-Szabó, G.","Three Testosterone Derivatives","Acta Crystallographica Section C","1996","52","11","2899","2903","10.1107/S0108270196006440","","","1.54178","CuKα","","0.1942","0.0492","","0.1746","0.114","","","","1.079","1.302","1.302","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005637","10.207","0.005","40.174","0.007","6.074","0.013","90","","90","","90","","2491","5","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","anti-4-androsten-17beta-yl acetate-3-Obenzyloxime","","- C28 H37 N O3 -","- C28 H37 N O3 -","- C112 H148 N4 O12 -","4","1","KA1197","Böcskei, Z.; Gérczei, T.; Bodor, A.; Schwartz, R.; Náray-Szabó, G.","Three Testosterone Derivatives","Acta Crystallographica Section C","1996","52","11","2899","2903","10.1107/S0108270196006440","","","1.54178","CuKα","","0.1965","0.052","","0.2097","0.1219","","","","1.075","1.238","1.238","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005638","13.507","0.003","6.117","0.005","15.25","0.003","90","","92.582","0.015","90","","1258.7","1.1","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","syn-4-androsten-17beta-yl acetate-3-O-benzyloxyme","","- C28 H37 N O3 -","- C28 H37 N O3 -","- C56 H74 N2 O6 -","2","1","KA1197","Böcskei, Z.; Gérczei, T.; Bodor, A.; Schwartz, R.; Náray-Szabó, G.","Three Testosterone Derivatives","Acta Crystallographica Section C","1996","52","11","2899","2903","10.1107/S0108270196006440","","","1.54178","CuKα","","0.1226","0.0476","","0.1629","0.1157","","","","1.072","1.132","1.132","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005639","11.077","0.002","9.631","0.002","20.945","0.004","90","","93.53","0.03","90","","2230.2","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-methyl-4(5)-(p-methoxyphenylazo)imidazole","","- C11 H12 N4 O -","- C11 H12 N4 O -","- C88 H96 N32 O8 -","8","2","KA1202","Anulewicz, R.; Maciejewska, D.","4(5)-(<i>p</i>-Methoxyphenylazo)-2-methylimidazole","Acta Crystallographica Section C","1996","52","11","2943","2945","10.1107/S0108270196007007","","","1.54178","CuKα","","0.117","0.0931","","0.269","0.2349","","","","1.023","1.117","1.117","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005640","14.14","0.005","8.028","0.002","25.133","0.004","90","","90","","90","","2853","1.3","291","","291","","","","","","","","","4","P b c a","-P 2ac 2ab","61","4-Nitro-α-methoxy-trans-chalcone","3-(4-Nitro-phenyl)-2-methoxy-1-phenyl-prop-2-en-1-one","","- C16 H13 N O4 -","- C16 H13 N O4 -","- C128 H104 N8 O32 -","8","1","KA1206","Bolte, M.; Schütz, G.; Bader, H. J.","Two Nitro-α-methoxy-<i>trans</i>-chalcones","Acta Crystallographica Section C","1996","52","11","2807","2809","10.1107/S0108270196007913","","","1.5418","CuKα","","0.0758","0.0575","","0.176","0.1601","","","","1.063","1.162","1.162","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005641","8.384","0.001","8.783","0.001","9.492","0.001","95.01","0.01","97.17","0.01","101.5","0.01","675.03","0.14","293","","293","","","","","","","","","4","P -1","-P 1","2","3-Nitro-α-methoxy-trans-chalcone","3-(3-Nitro-phenyl)-2-methoxy-1-phenyl-prop-2-en-1-one","","- C16 H13 N O4 -","- C16 H13 N O4 -","- C32 H26 N2 O8 -","2","1","KA1206","Bolte, M.; Schütz, G.; Bader, H. J.","Two Nitro-α-methoxy-<i>trans</i>-chalcones","Acta Crystallographica Section C","1996","52","11","2807","2809","10.1107/S0108270196007913","","","1.5418","CuKα","","0.0438","0.0429","","0.1132","0.1122","","","","1.129","1.141","1.141","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005642","4.77","0.001","11.725","0.002","8.9911","0.0008","90","","99.64","0.01","90","","495.76","0.14","296","","","","","","","","","","","5","P 1 21 1","","","","","","- C10 H7 F4 N O -","- C10 H7 F4 N O -","- C20 H14 F8 N2 O2 -","2","1","KH1097","Kato, K.; Morikawa, H.; Kimoto, H.; Momota, K.","5,5,8,8-Tetrafluoro-6-methoxy-5,8-dihydroquinoline","Acta Crystallographica Section C","1996","52","11","2836","2837","10.1107/S0108270196007676","","","0.71069","MoKα","","","0.037","","","0.036","","","","","1.41","1.41","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005643","10.914","0.002","13.287","0.002","7.317","0.002","93.43","0.02","94.44","0.02","110.89","0.009","984","0.4","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H22 Cl Mn N2 O2 -","- C22 H22 Cl Mn N2 O2 -","- C44 H44 Cl2 Mn2 N4 O4 -","2","1","KH1098","Feng, Y.-L.; Liu, S.-X.","Chloro[<i>N</i>,<i>N</i>'-ethylenebis(3-imino-1-phenyl-1-butanonato-<i>N</i>,<i>O</i>)]manganese(III), [MnCl(C~22~H~22~N~2~O~2~)]","Acta Crystallographica Section C","1996","52","11","2768","2770","10.1107/S0108270196006579","","","0.71069","MoKα","","","0.0446","","","0.0535","","","","","1.172","1.172","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005644","9.846","0.009","38.204","0.009","11.421","0.009","90","","113.18","0.07","90","","3949","5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-^t^butyl-1-cyclohexyl-2-diisopropylamino-6-(4-methoxyphenyl)-2-[4-methoxy- 2,3,4-tris(methoxycarbonyl)-5-oxo-2-cyclopentenyliden]-1,2-dihydro-1,3,2- diazaphosphinine.","","- C38 H54 N3 O9 P -","- C38 H54 N3 O9 P -","- C152 H216 N12 O36 P4 -","4","1","KH1100","García-Granda, S.; Santiago-García, R.; Bieger, K.","C~38~H~54~N~3~O~9~P, a New Compound in Diazadihydrophosphinine Chemistry","Acta Crystallographica Section C","1996","52","11","2857","2859","10.1107/S0108270196007755","","","0.71073","MoKα","","0.3048","0.058","","0.2329","0.1269","","","","0.992","1.148","1.148","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2005645","8.754","0.002","8.857","0.002","16.748","0.003","90","","92","0.03","90","","1297.8","0.5","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Tetra-n-butylammonium Chloride-Thiourea (1/2)","","","- C18 H44 Cl N5 S2 -","- C18 H44 Cl N5 S2 -","- C36 H88 Cl2 N10 S4 -","2","1","KH1101","Li, Q.; Mak, T. C. W.","Tetra-<i>n</i>-butylammonium Chloride‒Thiourea (1/2), a Layer-Type Inclusion Compound","Acta Crystallographica Section C","1996","52","11","2830","2832","10.1107/S0108270196008268","","","0.71073","MoKα","","0.0619","0.0501","","0.1476","0.1371","","","","1.061","1.098","1.098","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005646","7.214","0.001","16.437","0.001","16.18","0.002","90","","97.378","0.005","90","","1902.7","0.4","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","7-methyladeninium trichloro-7-methyladeninezinc(II) hydrate","","- C12 H17 Cl3 N10 O Zn -","- C12 H17 Cl3 N10 O Zn -","- C48 H68 Cl12 N40 O4 Zn4 -","4","1","KH1103","Price, C. L.; Taylor, M. R.","7-Methyl-3-adeninium Trichloro(7-methyladenine-<i>N</i>^9^)zinc(II) Hydrate","Acta Crystallographica Section C","1996","52","11","2736","2738","10.1107/S0108270196009079","","","1.5418","CuKα","","0.035","0.032","","0.07","0.07","","","","2.903","2.959","2.959","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2005647","6.8995","0.0004","11.3444","0.0006","11.537","0.001","114.436","0.007","92.049","0.006","104.428","0.005","786.26","0.11","571","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H17 B10 N O -","- C10 H17 B10 N O -","- C20 H34 B20 N2 O2 -","2","1","KH1105","White, J. M.; Bateman, S. A.; Kelly, D. P.; Martin, R. F.","3-[1,2-Dicarba-<i>closo</i>-dodecacarboranyl(methyleneoxy)]benzonitrile","Acta Crystallographica Section C","1996","52","11","2785","2787","10.1107/S0108270196008062","","","1.5418","CuKα(Nifiltered","","0.0492","0.0446","","0.165","0.1408","","","","0.809","0.816","0.816","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005648","16.434","0.002","6.99","0.003","16.204","0.002","90","","117.83","0.01","90","","1646.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H40 Co3 N4 O24 -","- C22 H40 Co3 N4 O24 -","- C44 H80 Co6 N8 O48 -","2","0.5","KH1107","Chen, X.-M.; Chen, H.-A.; Wu, B.-M.; Mak, T. C. W.","Hexaaquacobalt(II) Bis[(2-Hydroxy-1,3-propanediamine-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetraacetato)cobalt(III)]","Acta Crystallographica Section C","1996","52","11","2693","2695","10.1107/S0108270196007937","","","0.71073","MoKα","","0.0553","0.0452","","0.1309","0.1225","","","","1.052","1.075","1.075","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005649","10.113","0.002","16.951","0.003","18.015","0.004","90","","98.49","0.03","90","","3054.4","1.1","294","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[1,2-Bis(diphenylphosphino)propane](1,3-propanedithiolate)palladium(II), [Pd{Ph~2~P(CH~2~)~3~PPh~2~}(SC~3~H~6~S)].CH~3~CN","","- C32 H35 N P2 Pd S2 -","- C32 H35 N P2 Pd S2 -","- C128 H140 N4 P8 Pd4 S8 -","4","1","KH1111","Su, W.; Hong, M.; Zhou, Z.; Xue, F.; Liu, H.; Mak, T. C. W.","[1,3-Bis(diphenylphosphino)propane-<i>P</i>,<i>P</i>'](1,3-propanedithiolato-<i>S</i>,<i>S</i>')palladium(II) Acetonitrile Solvate, [Pd{Ph~2~P(CH~2~)~3~PPh~2~}(SC~3~H~6~S)].CH~3~CN","Acta Crystallographica Section C","1996","52","11","2691","2693","10.1107/S0108270196008670","","","0.71073","MoKα","","","0.035","","","0.048","","","","","1.12","1.12","","","","","has coordinates","198524","2020-10-21","18:00:00",""
"2005650","12.578","0.002","12.848","0.002","11.505","0.002","90","","90","","90","","1859.2","0.5","291","","291","","","","","","","","","5","P b c n","-P 2n 2ab","60","","[N,N'-bis(2-thiobenzenylidene)1,2-dimethyl-4,5-phenylenediaminato]nickel(II)","","- C22 H18 N2 Ni S2 -","- C22 H18 N2 Ni S2 -","- C88 H72 N8 Ni4 S8 -","4","0.5","KH1114","Henderson, R. K.; Bouwman, E.; Reedijk, J.; Powell, A. K.","[<i>N</i>,<i>N</i>'-Bis(2-thiobenzylidene)-1,2-dimethyl-4,5-phenylenediaminato]nickel(II), Ni(tsaldimph)","Acta Crystallographica Section C","1996","52","11","2696","2698","10.1107/S0108270196009778","","","0.71073","MoKα","","0.0584","0.0328","","0.0498","0.0454","","","","","1.08","1.08","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005651","9.944","0.001","13.171","0.001","15.92","0.002","90","","97.48","0.01","90","","2067.3","0.4","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H18 Cl2 O S Te -","- C21 H18 Cl2 O S Te -","- C84 H72 Cl8 O4 S4 Te4 -","4","1","LI1148","Zukerman-Schpector, J.; Caracelli, I.; Dabdoub, M. J.; Dabdoub, V. B.; Pereira, M. A.","(<i>Z</i>)-1-(Dichloro-<i>p</i>-methoxyphenyltelluro)-1-phenyl-2-thiophenylethene","Acta Crystallographica Section C","1996","52","11","2772","2774","10.1107/S0108270196008256","","","0.71073","MoKα","","0.0414","0.0261","","0.0711","0.061","","","","1.126","1.082","1.082","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005652","8.962","0.002","8.962","0.002","15.439","0.003","90","","90","","90","","1240","0.5","293","2","293","2","","","","","","","","5","P 42/n m c :2","-P 4ac 2a","137","","Bis(tetraethylammonium)-tetrachloromercurate","","- C16 H40 Cl4 Hg N2 -","- C16 H40 Cl4 Hg N2 -","- C32 H80 Cl8 Hg2 N4 -","2","0.125","MD1004","Mahoui, A.; Lapasset, J.; Moret, J.; Saint Grégoire, P.","Bis(tetraethylammonium) Tetrachlorometallates, [(C~2~H~5~)~4~N]~2~[<i>M</i>Cl~4~], where <i>M</i> = Hg, Cd, Zn","Acta Crystallographica Section C","1996","52","11","2671","2674","10.1107/S010827019600666X","","","0.7107","MoKα","","0.1181","0.0299","","0.0862","0.0676","","","","0.886","1.033","1.033","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005653","9.034","0.002","9.034","0.002","15.297","0.003","90","","90","","90","","1248.4","0.5","293","2","293","2","","","","","","","","5","P 42/n m c :2","-P 4ac 2a","137","","Bis(tetraethylammonium)-tetrachlorocadamate","","- C16 H40 Cd Cl4 N2 -","- C16 H40 Cd Cl4 N2 -","- C32 H80 Cd2 Cl8 N4 -","2","0.125","MD1004","Mahoui, A.; Lapasset, J.; Moret, J.; Saint Grégoire, P.","Bis(tetraethylammonium) Tetrachlorometallates, [(C~2~H~5~)~4~N]~2~[<i>M</i>Cl~4~], where <i>M</i> = Hg, Cd, Zn","Acta Crystallographica Section C","1996","52","11","2671","2674","10.1107/S010827019600666X","","","0.71069","MoKα","","0.118","0.0389","","0.1028","0.0883","","","","0.755","1.034","1.034","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005654","9.0147","0.001","9.0147","0.001","14.964","0.002","90","","90","","90","","1216","0.3","293","2","293","2","","","","","","","","5","P 42/n m c :2","-P 4ac 2a","137","","Bis(tetraethylammonium)-tetrachlorozincate","","- C16 H40 Cl4 N2 Zn -","- C16 H42 Cl4 N2 Zn -","- C32 H84 Cl8 N4 Zn2 -","2","0.125","MD1004","Mahoui, A.; Lapasset, J.; Moret, J.; Saint Grégoire, P.","Bis(tetraethylammonium) Tetrachlorometallates, [(C~2~H~5~)~4~N]~2~[<i>M</i>Cl~4~], where <i>M</i> = Hg, Cd, Zn","Acta Crystallographica Section C","1996","52","11","2671","2674","10.1107/S010827019600666X","","","1.5418","CuKα","","0.0688","0.0599","","0.1924","0.1841","","","","1.12","1.195","1.195","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005655","18.308","0.002","7.262","0.001","22.805","0.003","90","","90","","90","","3032","0.7","293","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H17 Cu N3 O4 -","- C14 H17 Cu N3 O4 -","- C112 H136 Cu8 N24 O32 -","8","1","MU1236","Warda, S. A.; Friebel, C.; Sivý, J.; Plesch, G.; Svajlenová, O.","Aqua(3,5-dimethylpyrazole)(<i>N</i>-salicylideneglycinato)copper(II)","Acta Crystallographica Section C","1996","52","11","2763","2766","10.1107/S0108270196008578","","","0.71073","MoKα","","","0.0472","","","0.1161","","","","","1.076","1.076","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005656","35.8","0.004","15.564","0.001","11.387","0.001","90","","96.21","0.01","90","","6307.5","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[(quinolin-8-olato)(8-hydroxyquinoline)(triphenylphosphine)silver(I)] hydrogen acetate monohydrate","","- C74 H62 Ag2 N4 O7 P2 -","- C74 H62 Ag2 N4 O7 P2 -","- C296 H248 Ag8 N16 O28 P8 -","4","1","MU1240","Othman, A. H.; Goh, S.-C.; Fun, H.-K.; Sivakumar, K.","Hydrogen Bis[(8-quinolinol-<i>N</i>)(8-quinolinolato-<i>N</i>,<i>O</i>)(triphenylphosphine-<i>P</i>)silver(I)] Acetate Monohydrate","Acta Crystallographica Section C","1996","52","11","2760","2763","10.1107/S010827019600858X","","","0.71073","MoKα","","0.08","0.053","","0.2075","0.1478","","","","1.056","1.138","1.138","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005657","11.249","0.002","9.995","0.002","9.362","0.002","90","","111.25","0.03","90","","981","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(2-thioxo-1,3-thiazolidin-3-yl)4,5-dihydro-1,3-thiazole hydrochloride","","- C6 H9 Cl N2 S3 -","- C6 H9 Cl N2 S3 -","- C24 H36 Cl4 N8 S12 -","4","1","MU1250","Raper, E. S.; Kubiak, M.; Głowiak, T.","2-(2-Thioxo-1,3-thiazolidin-3-yl)-4,5-dihydro-1,3-thiazol-1-ium Chloride, C~6~H~9~N~2~S~3~^+^.Cl^{-^}","Acta Crystallographica Section C","1996","52","11","2908","2910","10.1107/S0108270196008591","","","0.71069","MoKα","","0.0424","0.0424","","0.1137","0.1137","","","","1.097","1.097","1.097","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005658","11.677","0.002","12.431","0.002","9.443","0.002","108.6","0.03","111.44","0.03","89.96","0.03","1198.7","0.5","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","2-(7,9-Diphenylcyclopenta[a]acenaphthylen-6b-yl)-2-phenylethanol","","- C35 H26 O -","- C35 H26 O -","- C70 H52 O2 -","2","1","MU1261","Repo, T.; Klinga, M.; Leskelä, M.; Polamo, M.; Rieger, B.","2-(7,9-Diphenylcyclopenta[<i>a</i>]acenaphthadien-6b-yl)-2-phenylethanol","Acta Crystallographica Section C","1996","52","11","2910","2912","10.1107/S0108270196007895","","","0.71073","MoKα","","0.075","0.0563","","0.1392","0.1279","","","","1.056","1.119","1.119","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005659","17.784","0.005","18.326","0.004","9.055","0.003","90","","104.74","0.03","90","","2854","1.4","143","2","143","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","N,N'-dimethyl-N-(p-tolylthio)-N'-[chloro(methyl)arsino]urea","","- C11 H16 As Cl N2 O S -","- C11 H16 As Cl N2 O S -","- C88 H128 As8 Cl8 N16 O8 S8 -","8","2","MU1265","Jones, P. G.; Fischer, A. K.; Müller, C.; Pinchuk, V. A.; Schmutzler, R.","<i>N</i>-Chloro(methyl)arsino-<i>N</i>,<i>N</i>'-dimethyl-<i>N</i>'-(<i>p</i>-tolylthio)urea","Acta Crystallographica Section C","1996","52","11","2750","2752","10.1107/S0108270196008359","","","0.71073","MoKα","","0.0485","0.0344","","0.0802","0.0728","","","","1.046","1.055","1.055","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005660","32.027","0.007","9.829","0.002","17.42","0.006","90","","96.89","0.03","90","","5444","3","293","","","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C48 H44 Cl4 Cu2 Mo N2 P2 S6 -","- C48 H44 Cl4 Cu2 Mo N2 P2 S6 -","- C192 H176 Cl16 Cu8 Mo4 N8 P8 S24 -","4","0.5","MU1271","Wang, Q.; Wu, X.; Huang, Q.; Sheng, T.","Bis(pyridine-2-thione)-2κ<i>S</i>;3κ<i>S</i>-tetra-μ-sulfido-1:2κ^4^<i>S</i>;1:3κ^4^<i>S</i>-bis(triphenylphosphine)-2κ<i>P</i>;3κ<i>P</i>-dicoppermolybdenum Bis(dichloromethane) Solvate","Acta Crystallographica Section C","1996","52","11","2738","2740","10.1107/S0108270196008608","","","0.71073","MoKα","","","0.045","","","0.051","","","","","1.35","1.35","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005661","7.9572","0.0007","8.2383","0.0004","8.5846","0.0006","110.416","0.005","92.067","0.006","92.165","0.006","526.3","0.07","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H24 N6 Ni O4 -","- C20 H24 N6 Ni O4 -","- C20 H24 N6 Ni O4 -","1","0.5","MU1275","Ülkü, D.; Ercan, F.; Macit, M.; Gülce, A.","Bis[<i>N</i>-(2,6-dimethylphenyl)aminoglyoximato-<i>N</i>,<i>N</i>']nickel(II)","Acta Crystallographica Section C","1996","52","11","2680","2682","10.1107/S0108270196009407","","","0.71073","MoKα","","","0.029","","","0.033","","","","","1.25","1.25","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005662","12.245","0.0012","10.3134","0.0012","18.77","0.003","90","","106.53","0.012","90","","2272.5","0.5","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-{N,N,N',N'-tetrakis[2-(3,5-dimethyl-1-pyrazolyl)ethyl]-1,2- ethylenediamine}-bis[aquanitratonickel(II)] dinitrate dimethanol solvate.","","- C32 H60 N14 Ni2 O16 -","- C32 H60 N14 Ni2 O16 -","- C64 H120 N28 Ni4 O32 -","2","0.5","MU1285","Veldman, N.; Spek, A. L.; Tabbì, G.; Driessen, W. L.; Reedijk, J.","A Dinuclear Nickel(II) Compound: μ-{<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis[2-(3,5-dimethyl-1-pyrazolyl)ethyl]-1,2-ethylenediamine}-bis[aqua(nitrato-<i>O</i>,<i>O</i>')nickel(II)] Dinitrate Dimethanol Solvate","Acta Crystallographica Section C","1996","52","11","2698","2701","10.1107/S010827019600981X","","","0.71073","MoKα","","0.0637","0.0637","","0.1647","0.1647","","","","1.096","1.02","1.02","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005663","11.216","0.001","14.366","0.002","12.837","0.003","90","","92.03","0.01","90","","2067.1","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H28 Fe2 -","- C26 H28 Fe2 -","- C104 H112 Fe8 -","4","1","NA1233","Alvarez-Larena, A.; Briansó, J. L.; Piniella, J. F.; Farran, J.; Manríquez, J. M.; Chávez, I.; Oelckers, B.; Molins, E.; Miravitlles, C.","Triple-Decker [Cp*Fe(C~8~H~6~)Fe(C~8~H~7~)]","Acta Crystallographica Section C","1996","52","11","2754","2757","10.1107/S0108270196008037","","","0.71073","MoKα","","0.0593","0.035","","0.0916","0.0886","","","","0.971","1.12","1.12","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005664","4.783","0.001","16.982","0.006","16.205","0.006","90","","96.82","0.04","90","","1306.9","0.7","295","3","295","3","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(2,5-dichlorophenylhydrazono)-glutaric acid","","- C11 H10 Cl2 N2 O4 -","- C11 H10 Cl2 N2 O4 -","- C44 H40 Cl8 N8 O16 -","4","1","NA1241","Antolić, S.; Kojic-Prodic, B.; Cohen, J. D.","2-(2,5-Dichlorophenylhydrazono)glutaric Acid and 2-(3,5-Dichlorophenylhydrazono)glutaric Acid","Acta Crystallographica Section C","1996","52","11","2832","2835","10.1107/S0108270196008013","","","1.54184","CuKα","","0.1658","0.0549","","0.1432","0.1241","","","","0.835","1.125","1.125","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005665","7.279","0.001","8.805","0.002","11.753","0.002","73.15","0.01","71.27","0.01","71.09","0.01","660.2","0.2","295","3","295","3","","","","","","","","5","P -1","-P 1","2","","2-(3,5-dichlorophenylhydrazono)-glutaric acid","","- C11 H10 Cl2 N2 O4 -","- C11 H10 Cl2 N2 O4 -","- C22 H20 Cl4 N4 O8 -","2","1","NA1241","Antolić, S.; Kojic-Prodic, B.; Cohen, J. D.","2-(2,5-Dichlorophenylhydrazono)glutaric Acid and 2-(3,5-Dichlorophenylhydrazono)glutaric Acid","Acta Crystallographica Section C","1996","52","11","2832","2835","10.1107/S0108270196008013","","","1.54184","CuKα","","0.098","0.0617","","0.1772","0.1647","","","","0.987","1.114","1.114","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005666","8.16","0.002","22.289","0.004","9.461","0.002","90","","96.51","0.03","90","","1709.7","0.6","295","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-[2-(α-Hydrazonomethyl)-3-benzofuranyl]-p-toluene sulfonamide","","- C17 H17 N3 O3 S -","- C17 H17 N3 O3 S -","- C68 H68 N12 O12 S4 -","4","1","NA1246","Bachechi, F.; Coiro, V. M.; Delfini, M.","<i>N</i>-[2-(1-Hydrazonoethyl)-3-benzofuranyl]-<i>p</i>-toluenesulfonamide","Acta Crystallographica Section C","1996","52","11","2915","2917","10.1107/S0108270196006968","","","0.71073","MoKα","","","0.0525","","","0.0593","","","","","1.0785","1.0785","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2005667","7.7033","0.0002","8.4943","0.0002","15.4169","0.0005","90","","96.201","0.005","90","","1002.89","0.05","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","(-)-(R)-N-[3,4-dihydro-2H-1-benzopyran-2-yl)methyl]- N'-(1,4,5,6-tetrahydro-2-pyrimidyl)-1,3-propanediamine dihydrobromide","","- C17 H28 Br2 N4 O -","- C17 H28 Br2 N4 O -","- C34 H56 Br4 N8 O2 -","2","1","NA1252","Peeters, O. M.; Blaton, N. M.; De Ranter, C. J.","({-})-(<i>R</i>)-<i>N</i>-[(3,4-Dihydro-2<i>H</i>-1-benzopyran-2-yl)methyl]-<i>N</i>'-(1,4,5,6-tetrahydro-2-pyrimidyl)-1,3-propanediaminium Dibromide","Acta Crystallographica Section C","1996","52","11","2795","2797","10.1107/S010827019600710X","","","1.54184","CuKα","","0.0335","0.0333","","0.0842","0.0842","","","","1.085","1.085","1.085","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005668","10.608","0.007","9.782","0.009","25.999","0.007","90","","90.44","0.04","90","","2698","3","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H34 Cl2 N2 O2 Ti -","- C26 H34 Cl2 N2 O2 Ti -","- C104 H136 Cl8 N8 O8 Ti4 -","4","1","NA1254","Repo, T.; Klinga, M.; Leskelä, M.; Pietikäinen, P.; Brunow, G.","Dichloro[<i>N</i>,<i>N</i>'-ethylenebis(3-<i>tert</i>-butyl-5-methylsalicylideneiminato)-<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>']titanium(IV), [TiCl~2~(C~26~H~34~N~2~O~2~)]","Acta Crystallographica Section C","1996","52","11","2742","2745","10.1107/S010827019600933X","","","0.71073","MoKα","","0.2051","0.0957","","0.1591","0.1226","","","","0.978","1.231","1.231","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005669","10.319","0.002","8.933","0.002","23.976","0.002","90","","94.92","0.02","90","","2202","0.7","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1,7-Dimethyl-5-phenyl-2-(3-thenoylaminomethyl)-2,3-dihydro- 1H-1,4-benzodiazepin-4-ium chloride","","- C23 H24 Cl N3 O S -","- C27 H27 Cl N3 O S2 -","- C108 H108 Cl4 N12 O4 S8 -","4","1","NA1255","Blaton, N. M.; Peeters, O. M.; De Ranter, C. J.","1,7-Dimethyl-5-phenyl-2-(3-thenoylaminomethyl)-2,3-dihydro-1<i>H</i>-1,4-benzodiazepin-4-ium Chloride","Acta Crystallographica Section C","1996","52","11","2793","2795","10.1107/S0108270196007962","","","1.54184","CuKα","","0.082","0.0462","","0.1247","0.1236","","","","1.121","1.112","1.112","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005670","7.935","0.001","25.116","0.003","11.081","0.002","90","0","96.4","0.01","90","0","2194.6","0.6","293","3","293","3","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(4-Nitro-phenyl)-(1,3,5,8,12-pentaaza-cyclotetradec-3-yl)- -methanone dinitrato copper(II)","","- C16 H26 Cu N8 O9 -","- C16 H26 Cu N8 O9 -","- C64 H104 Cu4 N32 O36 -","4","1","NA1257","Sardone, N.; Licchelli, M.","(4-Nitrophenyl 1,3,5,8,12-pentaazacyclotetradec-3-yl ketone-<i>N</i>^1^,<i>N</i>^5^,<i>N</i>^8^,<i>N</i>^12^)copper(II) Dinitrate","Acta Crystallographica Section C","1996","52","11","2713","2716","10.1107/S0108270196009183","","","1.54184","CuKα","","0.054","0.05","","","0.039","","","","","1.744","1.744","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2005671","28.01","0.01","28.22","0.02","19.24","0.01","107.04","0.06","93.75","0.06","130.71","0.02","10308","14","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- Al2 Er6 H117 Na8 Nb30 O149.5 -","- Al2 Er6 Na8 Nb30 O149.25 -","- Al4 Er12 Na16 Nb60 O298.5 -","2","1","OA1001","Naruke, H.; Yamase, T.","Na~8~H~18~[{Er~3~O(OH)~3~(H~2~O)~3~}~2~Al~2~-(Nb~6~O~19~)~5~].40.5H~2~O","Acta Crystallographica Section C","1996","52","11","2655","2660","10.1107/S0108270196007366","","","0.7107","MoKα","","","0.076","","","0.098","","","","","3.53","3.53","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005672","20.19","0.004","5.388","0.002","22.728","0.003","90","","107.502","0.011","90","","2358","1","293","2","293","2","","","","","","","","3","C 1 c 1","C -2yc","9","","4-octyloxybiphenyl-4'-yl 4-Methoxybenzoate","","- C28 H32 O4 -","- C28 H32 O4 -","- C112 H128 O16 -","4","1","OA1004","Hori, K.; Nishiura, Y.","4-Octyloxybiphenyl-4'-yl 4-Methoxybenzoate","Acta Crystallographica Section C","1996","52","11","2922","2924","10.1107/S0108270196008517","","","1.5418","CuKα","","0.0505","0.0434","","0.1302","0.1259","","","","1.082","1.084","1.084","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005673","19.368","0.008","24.45","0.01","15.94","0.01","90","","108.72","0.04","90","","7149","6","293","","","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C51 H104 O46 -","- C51 H49 O45.32 -","- C204 H196 O181.28 -","4","1","PA1216","Rysanek, N.; Le Bas, G.; Villain, F.; Tsoucaris, G.","Inclusion of the Main Pheromone Component of <i>Dacus oleae</i>, 1,7-Dioxaspiro[5,5]undecane, in β-Cyclodextrin","Acta Crystallographica Section C","1996","52","11","2932","2936","10.1107/S0108270196005677","","","1.54184","CuKα","","","0.086","","","0.086","","","","","4.04","4.04","","","","","has coordinates","191097","2020-10-21","18:00:00",""
"2005674","10.661","0.002","5.478","0.002","11.383","0.003","90","","104.57","0.02","90","","643.4","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2,4-Dinitro-diphenyl-sulfone","","- C12 H8 N2 O6 S -","- C12 H8 N2 O6 S -","- C24 H16 N4 O12 S2 -","2","1","PA1230","Ellena, J.; Punte, G.; Nudelman, N. S.","2,4-Dinitrophenyl Phenyl Sulfone","Acta Crystallographica Section C","1996","52","11","2929","2932","10.1107/S0108270196008736","","","0.71073","MoKα","","0.0449","0.0371","","0.0866","0.0811","","","","1.137","1.143","1.143","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005675","8.031","0.001","13.161","0.001","14.477","0.001","90","","90","","90","","1530.2","0.2","293","2","120","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2,6-dibenzoylhydroquinone","","","- C20 H14 O4 -","- C20 H14 O4 -","- C80 H56 O16 -","4","1","PA1231","Biradha, K.; Desiraju, G. R.; Carrell, H. L.; Katz, A. K.","2,6-Dibenzoylhydroquinone","Acta Crystallographica Section C","1996","52","11","2839","2841","10.1107/S0108270196007615","","","0.71073","MoKα","","0.0575","0.0526","","0.1441","0.1335","","","","0.711","0.709","0.709","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005676","18.15","0.009","17.99","0.009","17.365","0.006","90","","97.39","0.03","90","","5623","4","295","","295","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[13,16,19,22,25,28,42,45,48,51,54,57-dodecaoxahexacyclo[28.28.1.1^11,40^.- 0^5,58^.0^7,12^.0^29,34^.0^36,41^]hexaconta-1(58),2,4,7,9,11,29,31,33,36,38,40- dodecaene](diiodo)dicaesium","","- C52 H66 Cs2 I2 N2 O12 -","- C52 H66 Cs2 I2 N2 O12 -","- C208 H264 Cs8 I8 N8 O48 -","4","0.5","PA1233","Thuéry, P.; Nierlich, M.; Lamare, V.; Dozol, J.-F.; Asfari, Z.; Vicens, J.","Caesium Iodide Complex of 1,3-Calix[4]-<i>bis</i>-crown-6","Acta Crystallographica Section C","1996","52","11","2729","2731","10.1107/S0108270196006786","","","0.71073","MoKα","","0.032","0.025","","0.04","0.038","","","","1.791","1.879","1.879","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005677","7.267","0.002","17.837","0.007","12.975","0.007","90","","98.78","0.03","90","","1662.1","1.2","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,2'-spirobitricyclo[3.3.1.1^3,7^]decanyl acetate","","- C21 H30 O2 -","- C21 H30 O2 -","- C84 H120 O8 -","4","1","PA1240","Vaissermann, J.; Lomas, J. S.","A Highly Strained Tertiary Acetate: 2,2'-Spirobiadamant-1-yl Acetate","Acta Crystallographica Section C","1996","52","11","2837","2839","10.1107/S0108270196007639","","","0.71076","MoKα","","","0.0422","","","0.0405","","","","","3.55","3.55","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005678","11.664","0.004","17.476","0.006","12.408","0.004","90","","94.81","0.03","90","","2520.3","1.5","293","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32.5 H26 O4.5 -","- C32.48 H24 O4.48 -","- C129.92 H96 O17.92 -","4","1","PT1008","Kumar, S. A.; Mathew, T.; Das, S.; Rath, N. P.; George, M. V.","Two Photoproducts Derived from 11,12-Dibenzoyl-9,10-dihydro-9,10-dimethoxy-9,10-ethenoanthracene","Acta Crystallographica Section C","1996","52","11","2797","2800","10.1107/S0108270196005197","","","0.71073","MoKα","","0.1571","0.0435","","0.0816","0.0684","","","","0.777","1.264","1.264","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005679","17.513","0.005","14.897","0.006","19.587","0.008","90","","90","","90","","5110","3","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C33 H28 O5 -","- C33 H28 O5 -","- C264 H224 O40 -","8","1","PT1008","Kumar, S. A.; Mathew, T.; Das, S.; Rath, N. P.; George, M. V.","Two Photoproducts Derived from 11,12-Dibenzoyl-9,10-dihydro-9,10-dimethoxy-9,10-ethenoanthracene","Acta Crystallographica Section C","1996","52","11","2797","2800","10.1107/S0108270196005197","","","0.71073","MoKα","","0.0689","0.0389","","0.1041","0.0975","","","","0.97","1.222","1.222","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005680","8.181","0.002","4.696","0.001","8.563","0.002","90","","111.39","0.03","90","","306.31","0.14","113","2","113","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","sulfuric acid","dihydrogen sulfate","","- H2 O4 S -","- H2 O4 S -","- H8 O16 S4 -","4","0.5","SK1004","Kemnitz, E.; Werner, C.; Trojanov, S.","Reinvestigation of Crystalline Sulfuric Acid and Oxonium Hydrogensulfate","Acta Crystallographica Section C","1996","52","11","2665","2668","10.1107/S0108270196006749","","","0.71073","MoKα","","0.0231","0.0212","","0.0623","0.0576","","","","1.139","1.155","1.155","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005681","7.077","0.001","6.955","0.001","8.15","0.002","90","","106.18","0.03","90","","385.26","0.14","160","2","160","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","sulfuric acid monohydrate","oxonium hydrogen sulfate","","- H4 O5 S -","- H4 O5 S -","- H16 O20 S4 -","4","1","SK1004","Kemnitz, E.; Werner, C.; Trojanov, S.","Reinvestigation of Crystalline Sulfuric Acid and Oxonium Hydrogensulfate","Acta Crystallographica Section C","1996","52","11","2665","2668","10.1107/S0108270196006749","","","0.71073","MoKα","","0.0374","0.0332","","0.1075","0.0858","","","","1.126","1.145","1.145","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005682","21.141","0.005","9.61","0.003","13.98","0.004","90","","107.33","0.08","90","","2711.3","1.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(4-nitrobenzyl) oximinoether] hexahydroazepine 2,3-dione.","","- C13 H15 N3 O4 -","- C13 H15 N3 O4 -","- C104 H120 N24 O32 -","8","1","SK1016","Tranqui, D.; Elfrom, H.; Pera, H.; Leclerc, G.","3-(4-Nitrobenzyloximino)hexahydroazepin-2-one","Acta Crystallographica Section C","1996","52","11","2880","2882","10.1107/S0108270196007688","","","1.5418","CuKα","","0.0517","0.0406","","0.1077","0.1008","","","","0.438","0.55","0.55","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005683","13.078","0.01","13.078","0.01","11.871","0.01","90","","90","","90","","2030","3","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","","(tetraethylammonium,tetramethylammonium)-tetrachlorocuprate","","- C12 H32 Cl4 Cu N2 -","- C12.5 H33 Cl4 Cu N2 -","- C50 H132 Cl16 Cu4 N8 -","4","0.5","SK1018","Mahoui, A.; Lapasset, J.; Moret, J.; Saint Grégoire, P.","Tetraethylammonium Tetramethylammonium Tetrachlorocuprate(II), [(C~2~H~5~)~4~N][(CH~3~)~4~N][CuCl~4~]","Acta Crystallographica Section C","1996","52","11","2674","2676","10.1107/S0108270196009031","","","1.5418","CuKα","","0.0761","0.0702","","0.1763","0.1716","","","","1.097","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005684","7.603","0.001","13.634","0.002","13.405","0.002","90","","90","","90","","1389.6","0.3","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","cis-aconitic acid","1-propene-cis(1,2),3-tricarboxylic acid","","- C6 H6 O6 -","- C6 H6 O6 -","- C48 H48 O48 -","8","1","SK1040","Nagel, N.; Endruschat, U.; Bock, H.","<i>cis</i>-Aconitic Acid at 150K","Acta Crystallographica Section C","1996","52","11","2912","2915","10.1107/S0108270196008220","","","0.71073","MoKα","","0.0505","0.0375","","0.0995","0.0917","","","","1.029","1.059","1.059","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005685","8.502","0.002","9.653","0.003","11.767","0.002","72.01","","74.57","","72.74","","860.8","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","acetyloxymethyl 4-chloro-N-furfuryl-5-sulfamoylanthranilate","","- C15 H15 Cl N2 O7 S -","- C15 H15 Cl N2 O7 S -","- C30 H30 Cl2 N4 O14 S2 -","2","1","SX1003","González, O. A.; Mombrú, A. W.; Suescun, L. P.; Mariezcurrena, R. A.; Manta, E.; Prandi, C.","Acetoxymethyl 4-Chloro-<i>N</i>-furfuryl-5-sulfamoylanthranilate, an Absorption Furosemide Prodrug","Acta Crystallographica Section C","1996","52","11","2875","2878","10.1107/S0108270196008360","","","0.71073","MoKα","","0.1086","0.0511","","0.1437","0.1179","","","","0.93","1.088","1.088","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005686","6.936","0.002","9.747","0.003","12.057","0.001","101.81","0.01","102.65","0.02","112.03","0.01","699.2","0.3","293","1","","","","","","","","","","6","P -1","-P 1","2","","","","- C11 H14 Cl Cu N4 O6 -","- C11 H14 Cl Cu N4 O6 -","- C22 H28 Cl2 Cu2 N8 O12 -","2","1","SZ1007","Chen, Z.-N.; Jun, Q.; Tang, W.-X.; Chen, J.; Zheng, P.-J.","A μ-Oxamidato-Bridged Dinuclear Copper(II) Complex","Acta Crystallographica Section C","1996","52","11","2752","2754","10.1107/S0108270196005793","","","0.71073","MoKα","","","0.026","","","0.028","","","","","0.66","0.66","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2005687","9.078","0.002","14.909","0.003","16.576","0.003","90","","91.73","0.03","90","","2242.4","0.8","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H19 N O2 -","- C31 H19 N O2 -","- C124 H76 N4 O8 -","4","1","SZ1023","Muneer, M.; George, M. V.; Rath, N. P.","The Photoproduct Derived from 9-Cyanodibenzobarrelene","Acta Crystallographica Section C","1996","52","11","2800","2802","10.1107/S0108270196007238","","","1.54178","CuKα","","0.0539","0.0423","","0.1184","0.1098","","","","1.304","1.378","1.378","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2005688","9.43","0.001","10.007","0.001","10.023","0.002","90.29","0.01","109.01","0.01","104.1","0.1","863.6","0.5","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H16 N4 S -","- C21 H16 N4 S -","- C42 H32 N8 S2 -","2","1","TA1008","Zhang, Z.-Y.; Zou, N.; Zhu, Y.; Zhao, L.; Li, M.","Studies on Condensed Heterocyclic Compounds. XIII. 6-(4-Methylphenyl)-3-(1-naphthylmethylene)-<i>s</i>-triazolo[3,4-<i>b</i>][1,3,4]thiadiazole","Acta Crystallographica Section C","1996","52","11","2787","2789","10.1107/S0108270196001746","","","1.5418","CuKα","","","0.069","","","0.072","","","","","0.91","0.91","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005689","12.837","0.003","18.081","0.004","11.747","0.004","96.49","0.02","106.84","0.03","107.77","0.03","2423.7","1.4","298","","298","","","","","","","","","7","P -1","-P 1","2","","Bis[S,S'(-)-trans-3,3'-(1,2-cyclohexandiyldinitrilo)-bis(2-methylpropane-2- thialato)nickel(II)] [(μ-iodocopper(I)-κ^2^S^1^,S^2'^)(μ-iodocopper(I)-κ^2^S^2^,S^1'^)(μ- iodocopper(I)-κ^2^S^2^,S^2'^)].diacetonitrile","","- C32 H62 Cu3 I3 N6 Ni2 S4 -","- C32 H62 Cu3 I3 N6 Ni2 S4 -","- C64 H124 Cu6 I6 N12 Ni4 S8 -","2","1","TA1057","Fox, S.; Stibrany, R. T.; Potenza, J. A.; Schugar, H. J.","A Mixed-Metal Pentanuclear Complex Containing Linked Ni^II^N~2~S~2~ and Cu^I^I Units","Acta Crystallographica Section C","1996","52","11","2731","2734","10.1107/S0108270196001308","","","0.71073","MoKα","","5.25","0.0388","","","0.047","","","","","1.6","1.6","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2005690","14.88","0.005","7.044","0.004","16.836","0.008","90","","110.93","0.05","90","","1648.2","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","mer-triaquaO,O'chloranilatoiron(III)","","- C6 H16 Cl3 Fe O12 -","- C6 H16 Cl3 Fe O12 -","- C24 H64 Cl12 Fe4 O48 -","4","1","TA1074","Abrahams, B. F.; Hoskins, B. F.; Robson, R.","<i>mer</i>-Triaqua(chloranilato-<i>O</i>,<i>O</i>')chloroiron(III) Pentahydrate","Acta Crystallographica Section C","1996","52","11","2766","2768","10.1107/S010827019600577X","","","0.71069","MoKα","","0.056","0.0345","","0.074","0.0663","","","","1.027","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005691","8.5879","0.0007","17.461","0.0008","7.893","0.001","90","","113.82","0.01","90","","1082.76","0.19","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H13 N O5 -","- C10 H13 N O5 -","- C40 H52 N4 O20 -","4","1","TA1075","Zhu, Y.; Jia, Z.-J.; Shi, J.-G.; Wang, H.-Q.","A Pyridine-2,6(1<i>H</i>,3<i>H</i>)-dione Alkaloid","Acta Crystallographica Section C","1996","52","11","2791","2793","10.1107/S010827019600131X","","","1.54184","CuKα","","","0.054","","","0.055","","","","","0.801","0.801","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005692","8.856","0.001","24.985","0.002","10.507","0.001","90","","90","","90","","2324.9","0.4","291","2","291","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Methyl-3-phenyl-2,5-dihydro-1,2,4-triazin-6(1H)-one Methanol Solvate","","- C11 H15 N3 O2 -","- C11 H14 N3 O2 -","- C88 H112 N24 O16 -","8","1","TA1096","Collins, D. J.; Hughes, T. C.; Johnson, W. M.; Mackay, M. F.","2-Methyl-3-phenyl-2,5-dihydro-1,2,4-triazin-6(1<i>H</i>)-one Methanol Solvate and 4-Methyl-3-phenyl-4,5-dihydro-1,2,4-triazin-6(1<i>H</i>)-one","Acta Crystallographica Section C","1996","52","11","2865","2868","10.1107/S0108270196008335","","","1.5418","CuKα","","","0.05","","","0.131","","","","","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005693","6.6707","0.0005","7.0151","0.0005","20.722","0.001","90","","98.71","0.01","90","","958.52","0.11","291","2","293","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Methyl-3-phenyl-4,5-dihydro-1,2,4-triazin-6(1H)-one","","- C10 H11 N3 O -","- C10 H11 N3 O -","- C40 H44 N12 O4 -","4","1","TA1096","Collins, D. J.; Hughes, T. C.; Johnson, W. M.; Mackay, M. F.","2-Methyl-3-phenyl-2,5-dihydro-1,2,4-triazin-6(1<i>H</i>)-one Methanol Solvate and 4-Methyl-3-phenyl-4,5-dihydro-1,2,4-triazin-6(1<i>H</i>)-one","Acta Crystallographica Section C","1996","52","11","2865","2868","10.1107/S0108270196008335","","","1.5418","CuKα","","","0.037","","","0.093","","","","","1.172","1.172","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005694","13.841","0.002","9.308","0.003","26.308","0.006","90","0.02","90","0.02","90","0.02","3389.3","1.4","200","0.1","200","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C16 H22 N2 O5 S -","- C16 H22 N2 O5 S -","- C128 H176 N16 O40 S8 -","8","1","TA1098","White, J. M.; Giordano, J.; Green, A. J.","<i>trans</i>-4-<i>tert</i>-Butylcyclohexyl 2,4-Dinitrobenzenesulfenate","Acta Crystallographica Section C","1996","52","11","2783","2785","10.1107/S0108270196008347","","","1.5418","CuKα(Ni-filtered)","","0.0552","0.0384","","0.1001","0.0898","","","","1.028","1.052","1.052","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005695","6.07","0.002","12.824","0.003","18.457","0.005","90","","93.14","0.03","90","","1434.6","0.7","151","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Methyl 2-benzoyloxy-3-oxo-3-phenylpropanoate","","- C17 H14 O5 -","- C17 H14 O5 -","- C68 H56 O20 -","4","1","TA1103","Shaw, J. P.; Tan, E. W.; Blackman, A. G.","Methyl 2-Benzoyloxy-3-oxo-3-phenylpropanoate","Acta Crystallographica Section C","1996","52","11","2883","2885","10.1107/S0108270196008323","","","0.71073","MoKα","","0.0574","0.0332","","0.0665","0.0627","","","","0.831","0.993","0.993","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005696","5.197","0.002","16.097","0.002","18.718","0.002","90","","90","","90","","1565.9","0.7","298","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H24 N2 O4 S -","- C11 H18 N2 O4 S2 -","- C44 H72 N8 O16 S8 -","4","1","VJ1038","Mitra, S. N.; Govindasamy, L.; Subramanian, E.","<small>L</small>-Leucyl-<small>L</small>-alanine Dimethyl Sulfoxide Solvate","Acta Crystallographica Section C","1996","52","11","2871","2873","10.1107/S0108270196007743","","","1.54184","CuKα","","","0.075","","","0.083","","","","","1.02","1.02","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005697","12.202","0.001","12.364","0.002","13.29","0.002","79.8","0.01","88.9","0.01","82.6","0.01","1956.9","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(E)-1,3-diferrocenyl-2-buten-1-one","","- C48 H45 Fe4 O2.5 -","- C48 H44 Fe4 O2.5 -","- C96 H88 Fe8 O5 -","2","1","AB1313","Erasmus, J. J. C.; Lamprecht, G. J.; Swarts, J. C.; Roodt, A.; Oskarsson, Å.","(<i>E</i>)-1,3-Diferrocenyl-2-buten-1-one‒Water (4/1)","Acta Crystallographica Section C","1996","52","12","3000","3002","10.1107/S0108270196004258","","","0.71073","MoKα","","0.0739","0.0398","","0.1203","0.0951","","","","1.11","1.119","1.119","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005698","10.075","0.002","10.075","0.002","10.075","0.002","90","","90","","90","","1022.7","0.2","293","","","","","","","","","","Synthetic","4","P 21 3","P 2ac 2ab 3","198","","","","- Be3 F12 K2 Mn2 -","- Be3 F12 K2 Mn2 -","- Be12 F48 K8 Mn8 -","4","0.333333","","Guelylah A; Breczewski T; Madariaga G","A New Langbeinite: Dipotassium Dimanganese Tetrafluoroberyllate","Acta Crystallographica C","1996","52","","2951","2954","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:03",""
"2005699","10.421","0.001","10.421","0.001","10.421","0.001","90","","90","","90","","1131.69","0.19","295","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","","","- Cd2 O12 S3 Tl2 -","- Cd2 O12 S3 Tl2 -","- Cd8 O48 S12 Tl8 -","4","0.333333","AB1353","Guelylah, A.; Madariaga, G.; Breczewski, T.","Langbeinite-Type Cubic Dithallium Dicadmium Sulfate","Acta Crystallographica Section C","1996","52","12","2954","2956","10.1107/S0108270196008815","","","0.71073","MoKα","","","0.051","","","0.04","","","","","1.412","1.412","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005700","6.245","0.002","20.797","0.002","6.7034","0.0014","90","","105.42","0.02","90","","839.3","0.3","293","","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H26 N2 O9 Pt -","- C12 H26 N2 O9 Pt -","- C24 H52 N4 O18 Pt2 -","2","1","AB1376","Yuge, H.; Miyamoto, T. K.","(<i>trans</i>-1<i>R</i>,2<i>R</i>-Cyclohexanediamine-<i>N</i>,<i>N</i>')(<small>L</small>-ascorbato-<i>C</i>^2^,<i>O</i>^5^)platinum(II)‒Water (1/3)","Acta Crystallographica Section C","1996","52","12","3002","3005","10.1107/S0108270196009493","","","0.71069","MoKα","","0.0327","0.0283","","0.0652","0.0638","","","","1.17","1.188","1.188","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005701","10.029","0.001","11.051","0.001","13.794","0.001","71.81","0.01","73.87","0.01","73.61","0.01","1362.9","0.2","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- C15 H23 Cl7 N4 O P4 -","- C15 H23 Cl7 N4 O P4 -","- C30 H46 Cl14 N8 O2 P8 -","2","1","AB1378","Hökelek, T.; Kiliç, A.; Begeç, S.; Kiliç, Z.; Yildiz, M.","2-(2,6-Di-<i>tert</i>-butyl-4-methylphenoxy)-2,4,4,6,6,8,8-heptachlorocyclo-2λ^5^,4λ^5^,6λ^5^,8λ^5^-tetraphosphazatetraene","Acta Crystallographica Section C","1996","52","12","3243","3246","10.1107/S0108270196009420","","","0.71073","MoKα","","","0.033","","","0.043","","","","","1.45","1.45","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005702","6.99","0.003","13.887","0.004","16.389","0.003","90","","92.47","0.04","90","","1589.4","0.9","294","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H20 N O5 P -","- C15 H20 N O5 P -","- C60 H80 N4 O20 P4 -","4","1","AB1384","Tahir, M. N.; Ülkü, D.; Yilmaz, H.; Nazir, H.","Ethyl {[<i>N</i>-(2-Hydroxyethyl)amino](2-hydroxy-1-naphthyl)methyl}phosphonate","Acta Crystallographica Section C","1996","52","12","3133","3135","10.1107/S0108270196009304","","","0.71073","MoKα","","","0.049","","","0.054","","","","","1.24","1.24","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005703","8.397","0.001","6.083","0.001","9.671","0.001","90","","111.53","0.01","90","","459.52","0.11","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","2,4,6-Trinitro-1,3,5-benzenetriol","","- C6 H3 N3 O9 -","- C6 H3 N3 O9 -","- C12 H6 N6 O18 -","2","1","AB1389","Wolff, J. J.; Gredel, F.; Irngartinger, H.; Dreier, T.","Trinitrophloroglucinol","Acta Crystallographica Section C","1996","52","12","3225","3227","10.1107/S0108270196009523","","","0.71073","MoKα","","0.048","0.037","","","0.047","","","","","2.3","2.3","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005704","14.945","0.003","11.416","0.002","9.674","0.002","90","","105.03","0.03","90","","1594","0.6","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H22 Cl2 N8 O2 -","- C7 H22 Cl2 N8 O2 -","- C28 H88 Cl8 N32 O8 -","4","1","AB1391","Koskinen, J.; Koskinen, M.; Mutikainen, I.; Mannfors, B.; Elo, H.","Ethylmethylglyoxal Bis(amidinohydrazonium) Dichloride‒Water (1/2)","Acta Crystallographica Section C","1996","52","12","3167","3169","10.1107/S0108270196009535","","","0.71073","MoKα","","0.1126","0.0696","","0.2017","0.1666","","","","0.944","1.025","1.025","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005705","10.745","0.001","13.546","0.002","14.3","0.002","90","","90","","90","","2081.4","0.5","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","[1(1,2,3,3a,6a-η)-1,4-dihydropentalenyl]-μ-[1(1,2,3,3a,6a-η): 2(3a,4,5,6,6a-η)]pentalene-[2(η^5^)-1,2,3,4,5-pentamethylcyclopentadienyl]- cobaltiron","","- C26 H28 Co Fe -","- C26 H28 Co Fe -","- C104 H112 Co4 Fe4 -","4","1","AB1392","Miravitlles, C.; Molins, E.; Maniukiewicz, W.; Mas, M.; Manríquez, J. M.; Chávez, I.; Oelckers, B.; Alvarez-Larena, A.; Briansó, J. L.","Triple-Decker Pentalene Complex of Iron and Cobalt","Acta Crystallographica Section C","1996","52","12","3047","3049","10.1107/S0108270196009961","","","0.71069","MoKα","","0.0882","0.0335","","0.0878","0.0644","","","","0.978","1.116","1.116","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005706","5.268","0.005","9.826","0.007","16.572","0.008","90","","96.48","0.05","90","","852.3","1.1","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,4'-[1,6-Hexanediylbis(oxy)]-bisbenzaldehyde","","- C20 H22 O4 -","- C20 H22 O4 -","- C40 H44 O8 -","2","0.5","AB1393","Artzner, F.; Albouy, P.-A.; Berruyer, G.; Veber, M.; Mérienne, C.; Robert, F.","4,4'-[1,6-Hexanediylbis(oxy)]bisbenzaldehyde","Acta Crystallographica Section C","1996","52","12","3234","3236","10.1107/S0108270196009973","","","0.71069","MoKα","","","0.032","","","0.03","","","","","2.92","2.92","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005707","36.429","0.003","10.703","0.001","16.53","0.001","90","","90","","90","","6445","0.9","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C53 H70 B18 Cl2 P4 Rh2 S2 -","- C53 H68 B18 Cl2 P4 Rh2 S2 -","- C212 H272 B72 Cl8 P16 Rh8 S8 -","4","1","AB1398","Rosair, G. M.; Welch, A. J.; Weller, A. S.","8-[1,2-Bis(diphenylphosphino)ethane]-9,10-μ-hydrido-8-rhoda-7-thia-<i>nido</i>-undecaborane(10)‒Dichloromethane (2/1)","Acta Crystallographica Section C","1996","52","12","3020","3024","10.1107/S0108270196010748","","","0.71073","MoKα","","0.0858","0.0529","","0.1406","0.1051","","","","1.104","1.049","1.049","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005708","10.572","0.011","11.07","0.01","17.109","0.014","97.05","0.07","101.34","0.09","108.38","0.09","1826","3","193","1","193","1","","","","","","","","5","P -1","-P 1","2","Bis(dianilinopyridine)tantalumtrichloride","Trichlorobis[2,6-di(phenylamino)pyridinato-N,N')tantalum(V)","","- C41 H36 Cl3 N6 Ta -","- C41 H36 Cl3 N6 Ta -","- C82 H72 Cl6 N12 Ta2 -","2","1","AB1399","Polamo, M.","Trichlorobis[2,6-di(phenylamino)pyridinato-<i>N</i>,<i>N</i>']tantalum(V) Toluene Solvate (1/1)","Acta Crystallographica Section C","1996","52","12","2977","2980","10.1107/S0108270196011328","","","0.71073","MoKα","","0.0685","0.068","","0.1908","0.1902","","","","1.152","1.162","1.162","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005709","11.505","0.002","11.785","0.002","19.95","0.003","74.93","0.02","78.32","0.02","87.122","0.013","2557.8","0.8","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","Ferrocene-1,1'-diylbis[bis(4-methoxyphenyl)methanol]-methanol (3/2)","","- C40.66667 H40.66667 Fe O6.66667 -","- C40.6667 H40.6667 Fe O6.66667 -","- C122 H122 Fe3 O20 -","3","1.5","AB1403","Bell, W.; Ferguson, G.; Glidewell, C.","A Paucity of Hydrogen Bonds in Ferrocene-1,1'-diylbis[bis(4-methoxyphenyl)methanol]‒ Methanol (3/2)","Acta Crystallographica Section C","1996","52","12","3009","3013","10.1107/S010827019601075X","","","0.7107","MolybdenumKα","","0.2113","0.0686","","0.127","0.1035","","","","0.86","1.277","1.277","","","","","has coordinates","196234","2020-10-21","18:00:00",""
"2005710","9.45","0.002","24.456","0.003","9.484","0.002","90","","103.607","0.013","90","","2130.3","0.7","294","1","294","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4,4'-Dihydroxybenzophenone","","- C13 H10 O3 -","- C13 H9.722 O3 -","- C104 H77.776 O24 -","8","2","AB1407","Ferguson, G.; Glidewell, C.","Two- and Three-Dimensional Hydrogen-Bonding Networks in the Structures of 4,4'-Dihydroxybenzophenone and 4,4'-Thiodiphenol","Acta Crystallographica Section C","1996","52","12","3057","3062","10.1107/S0108270196011377","","","0.7107","MolybdenumKα","","0.2265","0.07","","0.2188","0.1809","","","","0.917","1.454","1.454","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005711","5.5808","0.0008","21.128","0.003","8.8006","0.0012","90","","93.192","0.01","90","","1036.1","0.3","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,4'-Thiodiphenol","","- C12 H10 O2 S -","- C12 H10 O2 S -","- C48 H40 O8 S4 -","4","1","AB1407","Ferguson, G.; Glidewell, C.","Two- and Three-Dimensional Hydrogen-Bonding Networks in the Structures of 4,4'-Dihydroxybenzophenone and 4,4'-Thiodiphenol","Acta Crystallographica Section C","1996","52","12","3057","3062","10.1107/S0108270196011377","","","0.7107","MolybdenumKα","","0.2068","0.0472","","0.1044","0.0837","","","","0.825","1.197","1.197","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005712","5.6703","0.0005","11.4012","0.0012","11.6108","0.0013","100.619","0.013","92.757","0.007","96.479","0.008","731.22","0.13","294","1","294","1","","","","","","","","5","P -1","-P 1","2","Piperazine‒4,4'-sulfonyldiphenol (1/2)","piperazin-1,4-diium di(4,4'-sulfonyldiphenolate) .","","- C28 H30 N2 O8 S2 -","- C28 H30 N2 O8 S2 -","- C28 H30 N2 O8 S2 -","1","0.5","AB1418","Coupar, P. I.; Ferguson, G.; Glidewell, C.","Piperazine‒4,4'-Sulfonyldiphenol (1/2): a Self-Assembled Channel Structure","Acta Crystallographica Section C","1996","52","12","3052","3055","10.1107/S010827019601133X","","","0.7107","MolybdenumKα","","0.0951","0.0531","","0.1416","0.1276","","","","0.981","1.127","1.127","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005713","10.689","0.001","11.577","0.001","12.355","0.001","117.86","0.01","94.35","0.01","100.75","0.01","1304.4","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,2,3,4-Tetraphenyl-5-(4-pyridyl)bicyclo[2.2.1]hept-2-ene-7-one","","- C36 H27 N O -","- C36 H27 N O -","- C72 H54 N2 O2 -","2","1","BK1217","Wheeler, K. A.; Carrow, C. J.","A Bicyclo[2.2.1]heptenone System","Acta Crystallographica Section C","1996","52","12","3183","3185","10.1107/S0108270196009821","","","0.71073","MoKα","","0.149","0.0589","","0.142","0.109","","","","1.03","1.12","1.12","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005714","14.438","0.002","14.508","0.005","16.827","0.001","73.89","0.02","68.23","0.01","87.44","0.02","3138.1","1.3","294","","294","","","","","","","","","4","P -1","-P 1","2","","2,4,6-tri-O-benzyl-myo-inositol 1,3,5-tris(dibenzyl-phosphate)","","- C69 H69 O15 P3 -","- C69 H69 O15 P3 -","- C138 H138 O30 P6 -","2","1","BK1235","Graingeot, V.; Brigando, C.; Faure, B.; Benlian, D.","2,4,6-Tri-<i>O</i>-benzyl-<i>myo</i>-inositol 1,3,5-Tris(dibenzylphosphate)","Acta Crystallographica Section C","1996","52","12","3229","3232","10.1107/S0108270196010037","","","0.71073","MoKα","","0.055","0.05","","","0.066","","","","","2.18","2.18","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2005715","10.02","0.003","15.493","0.004","13.851","0.005","90","","93.81","0.03","90","","2145.5","1.2","293","2","243","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(N,N,N',N'-tetramethylethylenediamine)-1,1,3,3-tetrakis(trifluoromethyl) -2-oxo-propanediolato copper(II)","","- C15 H19 Cu F12 N2 O3 -","- C15 H19 Cu F12 N2 O3 -","- C60 H76 Cu4 F48 N8 O12 -","4","1","BK1239","George, C.; Purdy, A. P.","[2,2'-Oxybis(1,1,1,3,3,3-hexafluoro-2-propanolato-<i>O</i>)](<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-<i>N</i>,<i>N</i>')copper(II) Hemibenzene Solvate","Acta Crystallographica Section C","1996","52","12","2987","2989","10.1107/S0108270196010700","","","0.71073","MoKα","","0.104","0.052","","0.125","0.1017","","","","1.03","1.076","1.076","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005716","18.104","0.003","7.6912","0.0011","17.6","0.003","90","","93.687","0.007","90","","2445.6","0.7","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","cis-Diaqua-bis(2,2'-bipyrimidine-N,N')cobalt(II) Diperchlorate Dihydrate","","- C16 H20 Cl2 Co N8 O12 -","- C16 H20 Cl2 Co N8 O12 -","- C64 H80 Cl8 Co4 N32 O48 -","4","0.5","BK1247","Brunzelle, J.; Fitch, A.; Wang, Y.; Pavkovic, S. F.","<i>cis</i>-Diaquabis(2,2'-bipyrimidine-<i>N</i>,<i>N</i>')cobalt(II) Diperchlorate Dihydrate, [Co(C~8~H~6~N~4~)~2~(H~2~ O)~2~](ClO~4~)~2~.2H~2~O","Acta Crystallographica Section C","1996","52","12","2984","2987","10.1107/S0108270196010426","","","0.7107","MoKα","","0.0392","0.034","","0.102","0.0988","","","","1.06","1.115","1.115","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005717","5.655","0.001","12.248","0.002","4.736","0.001","99.54","0.01","106.34","0.01","96.27","0.01","306.19","0.1","173","","173","2","","","","","","","","4","P 1","P 1","1","","","","- C12 H18 N2 O5 -","- C12 H18 N2 O5 -","- C12 H18 N2 O5 -","1","1","BK1257","Ojala, W. H.; Gleason, W. B.","Mannose Phenylhydrazone, an Acyclic Monosaccharide Derivative","Acta Crystallographica Section C","1996","52","12","3188","3190","10.1107/S0108270196009882","","","1.5418","CuKα","","","0.027","","","0.033","","","","","2.46","2.46","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005718","10.4304","0.0003","10.8912","0.0009","15.8159","0.0015","72.231","0.007","72.719","0.011","82.798","0.007","1632.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Nitrato(2,3,7,8,12,13,17,18-octaethylporphyrinato)iron(III)","","- C36 H44 Fe N5 O3 -","- C36 H44 Fe N5 O3 -","- C72 H88 Fe2 N10 O6 -","2","1","BK1259","Ellison, M. K.; Shang, M.; Kim, J.; Scheidt, W. R.","Nitrato(2,3,7,8,12,13,17,18-octaethylporphyrinato)iron(III)","Acta Crystallographica Section C","1996","52","12","3040","3043","10.1107/S0108270196010062","","","0.71073","MoKα","","0.0932","0.06","","0.1548","0.134","","","","1.027","1.071","1.071","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005719","10.058","0.001","4.971","0.002","22.924","0.002","90","","97.897","0.009","90","","1135.3","0.5","296","","296","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","2-naphthylbutyric acid","4-(2-naphthyl)butanoic acid","","- C14 H14 O2 -","- C14 H14 O2 -","- C56 H56 O8 -","4","1","BK1262","Dobson, A. J.; Gerkin, R. E.","4-(2-Naphthyl)butanoic Acid","Acta Crystallographica Section C","1996","52","12","3083","3086","10.1107/S0108270196009547","","","0.71073","MoKα","","","0.04","","","0.048","","","","","1.63","1.63","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005720","5.737","0.002","11.622","0.003","20.827","0.005","90","","93.61","0.02","90","","1385.9","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H26 B P -","- C12 H26 B P -","- C48 H104 B4 P4 -","4","1","BK1263","Day, M. W.; Mohr, B.; Grubbs, R. H.","(Dicyclohexylphosphino)borane, BH~3~PH(C~6~H~11~)~2~, a Precursor to Water-Soluble Phosphine Ligands","Acta Crystallographica Section C","1996","52","12","3106","3108","10.1107/S0108270196010050","","","0.71073","MoKα","","0.055","0.043","","0.092","0.087","","","","2.29","2.48","2.48","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005721","11.4","0.002","7.135","0.001","13.113","0.002","90","","114.49","0.01","90","","970.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Triaqua(oxydiacetato-O,O',O'')strontium(II) Monohydrate","","- C4 H12 O9 Sr -","- C4 H12 O9 Sr -","- C16 H48 O36 Sr4 -","4","1","BK1264","Baggio, R.; Perec, M.; Garland, M. T.","Triaqua(oxydiacetato-<i>O</i>,<i>O</i>',<i>O</i>'')strontium(II) Monohydrate","Acta Crystallographica Section C","1996","52","12","2996","2999","10.1107/S0108270196010049","","","0.71073","MoKα","","0.0501","0.034","","0.085","0.0771","","","","1.029","1.057","1.057","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005722","40.877","0.002","6.96","0.003","7.371","0.002","90","","90","","90","","2097.1","1.1","296","","296","","","","","","","","","3","P b c n","-P 2n 2ab","60","3-phenylsalicylic acid","2-hydroxybiphenyl-3-carboxylic acid","","- C13 H10 O3 -","- C13 H10 O3 -","- C104 H80 O24 -","8","1","BK1266","Dobson, A. J.; Gerkin, R. E.","2-Hydroxybiphenyl-3-carboxylic Acid (3-Phenylsalicylic Acid)","Acta Crystallographica Section C","1996","52","12","3088","3091","10.1107/S0108270196010530","","","0.71073","MoKα","","","0.037","","","0.046","","","","","1.79","1.79","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005723","7.317","0.0001","17.3766","0.0001","19.7908","0.0003","90","","98.025","0.001","90","","2491.65","0.05","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aqua(2,6-diacetylpyridinedi(benzoic acid hydrazone)nitratocobalt(II) nitrate","","- C23 H23 Co N7 O9 -","- C23 H23 Co N7 O9 -","- C92 H92 Co4 N28 O36 -","4","1","BK1270","Abboud, K. A.; Palenik, R. C.; Palenik, G. J.","Aqua[2,6-diacetylpyridinedi(benzoic acid hydrazone)]nitratocobalt(II) Nitrate at 173K","Acta Crystallographica Section C","1996","52","12","2994","2996","10.1107/S0108270196011407","","","0.71073","MoKα","","0.0406","0.034","","0.095","0.0879","","","","1.04","1.055","1.055","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005724","10.659","0.005","15.827","0.006","17.315","0.003","65.22","0.02","81.6","0.02","81.69","0.03","2612.3","1.7","163","2","163","2","","","","","","","","5","P -1","-P 1","2","","9,10-bis(1-pyridylmethyl)anthracene dichloride dimethanol water solvate","","- C28 H32 Cl2 N2 O3 -","- C28 H32 Cl2 N2 O3 -","- C112 H128 Cl8 N8 O12 -","4","2","BK1271","Bryan, J. C.; Gakh, A. A.; Sachleben, R. A.","9,10-Bis(1-pyridiniomethyl)anthracene Dichloride‒Methanol‒Water (1/2/1)","Acta Crystallographica Section C","1996","52","12","3091","3093","10.1107/S0108270196011432","","","0.71073","MoKα","","0.075","0.038","","0.118","0.101","","","","1.01","1.07","1.07","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005725","12.529","0.004","12.529","0.004","12.635","0.008","90","","90","","90","","1983.4","1.5","233","2","293","2","","","","","","","","5","P 42/m b c","-P 4c 2ab","135","","","","- C19 H14 Cl2 Mn2 O6 -","- C19 H12 Cl2 Mn2 O6 -","- C76 H48 Cl8 Mn8 O24 -","4","0.25","BK1272","Utz, T. L.; Geib, S. J.; Cooper, N. J.","Solvate-Dependent Polymorphism: Crystallization of [{Mn(CO)~3~}~2~{μ-(η^5^-C~6~H~6~-η^5^-C~6~H~6~)}] from CH~2~Cl~2~ as a Mono-Solvate in the Rare Tetragonal Space Group <i>P</i>4~2~/<i>mbc</i>","Acta Crystallographica Section C","1996","52","12","2992","2994","10.1107/S0108270196010815","","","0.71073","MoKα","","0.0835","0.052","","0.155","0.1253","","","","1.062","1.092","1.092","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005726","10.413","0.002","15.7825","0.0013","15.503","0.002","90","","99.513","0.007","90","","2512.8","0.6","163","2","163","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","9,10-bis(7-fluoro-2,5-dioxaheptyl)triptycene","","","- C30 H32 F2 O4 -","- C30 H32 F2 O4 -","- C120 H128 F8 O16 -","4","1","BK1273","Gakh, A. A.; Bryan, J. C.; Sachleben, R. A.","9,10-Bis(7-fluoro-2,5-dioxaheptyl)triptycene","Acta Crystallographica Section C","1996","52","12","3093","3095","10.1107/S0108270196010694","","","0.71073","MoKα","","0.035","0.035","","0.095","0.095","","","","1.017","1.046","1.046","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005727","6.9888","0.001","5.6836","0.0005","16.019","0.002","90","","101.822","0.011","90","","622.8","0.13","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,7-(Di-2-thienyl)-1,5,2,4,6,8-dithiatetrazocine","","- C10 H6 N4 S4 -","- C10 H6 N4 S4 -","- C20 H12 N8 S8 -","2","0.5","BK1274","Barclay, T. M.; Cordes, A. W.; Oakley, R. T.; Preuss, K. E.","3,7-Bis(2-thienyl)-1,5,2,4,6,8-dithiatetrazocine","Acta Crystallographica Section C","1996","52","12","3250","3252","10.1107/S0108270196010797","","","0.7107","MolybdenumKα","","0.035","0.035","","0.059","0.059","","","","","1.05","1.05","","","","","has coordinates,has disorder","200183","2020-10-21","18:00:00",""
"2005728","8.7472","0.0007","34.341","0.006","18.952","0.002","90","","97.854","0.007","90","","5639.5","1.2","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(2,2'-bipyridine-1κ^2^N)(2,2':6',2''-terpyridine-1κ^3^N)(pentaammino-2κ^5^N)- (μ-4,4'-bipyridine-N,N')diruthenium Tetrakis(pentafluorophosphate) Acetonitrile Solvate","","- C37 H45 F24 N13 P4 Ru2 -","- C37 H42 F24 N13 P4 Ru2 -","- C148 H168 F96 N52 P16 Ru8 -","4","1","BK1275","Szalda, D. J.; Fagalde, F.; Katz, N. E.","Pentaammine-2κ^5^<i>N</i>-(μ-4,4'-bipyridine-1κ<i>N</i>:2κ<i>N</i>')(2,2'-bipyridine-1κ^2^<i>N</i>,<i>N</i>')(2,2':6',2''-terpyridine-1κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')diruthenium Tetrakis(hexafluorophosphate) Acetonitrile Solvate","Acta Crystallographica Section C","1996","52","12","3013","3016","10.1107/S0108270196011249","","","1.5418","CuKα","","0.1361","0.066","","0.2086","0.177","","","","0.925","1.07","1.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005729","10.6297","0.001","6.2597","0.0004","9.9677","0.0007","90","","93.034","0.007","90","","662.31","0.09","200","1","200","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,1,3,3-tetramethylurea","","","- C5 H12 N2 O -","- C5 H12 N2 O -","- C20 H48 N8 O4 -","4","0.5","BM1063","Frampton, C. S.; Parkes, K. E. B.","1,1,3,3-Tetramethylurea","Acta Crystallographica Section C","1996","52","12","3246","3248","10.1107/S0108270196011146","","","1.54178","CuKα","","0.0372","0.0337","","0.1309","0.0994","","","","1.064","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005730","7.974","0.002","21.692","0.004","10.038","0.007","90","","90","","90","","1736.3","1.3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H16 B2 Cu F8 N4 -","- C12 H16 B2 Cu F8 N4 -","- C48 H64 B8 Cu4 F32 N16 -","4","0.5","BM1074","Narayanan, B.; Bhadbhade, M. M.","Restricting Chelate Ring Flipping in Cu^II^ Complexes. I. Non-Thermochromic Bis(<i>o</i>-phenylenediamine-<i>N</i>,<i>N</i>')copper(II) Bis(tetrafluoroborate)","Acta Crystallographica Section C","1996","52","12","3049","3051","10.1107/S0108270196007354","","","0.71073","MoKα","","0.0628","0.0346","","0.1014","0.0925","","","","0.991","1.168","1.168","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005731","9.625","0.003","20.989","0.003","17.653","0.002","90","","90","","90","","3566.2","1.3","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H46 N2 O12 Si2 -","- C32 H46 N2 O12 Si2 -","- C128 H184 N8 O48 Si8 -","4","1","BM1085","Wang, Z.-G.; Liu, S.-G.; Wang, D.; Sui, X.-M.","An Optically Active Pentacoordinate Silicate: (+)-Bis(triethylammonium) Bis[(<i>R</i>,<i>R</i>)-tartrato(4‒)]diphenyldisilicate","Acta Crystallographica Section C","1996","52","12","3179","3181","10.1107/S0108270196009432","","","0.71073","MoKα","","","0.049","","","0.064","","","","","2.11","2.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005732","12.443","0.01","13.286","0.009","13.093","0.008","90","","108.37","0.05","90","","2054","3","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[2,2-dimethyl-1,3-propanediylbis(nitrilopropylidyne)]diphenol","","- C23 H30 N2 O2 -","- C23 H30 N2 O2 -","- C92 H120 N8 O8 -","4","1","BM1090","Corden, J. P.; Errington, W.; Moore, P.; Phillips, P. R.; Wallbridge, M. G. H.","Two Schiff Base Ligands Derived from 2,2-Dimethyl-1,3-propanediamine","Acta Crystallographica Section C","1996","52","12","3199","3202","10.1107/S0108270196011134","","","0.71073","MoKα","","0.073","0.0453","","0.1052","0.0985","","","","0.852","1.038","1.038","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005733","10.261","0.009","10.786","0.006","12.425","0.005","99.39","0.06","110.22","0.05","99.35","0.05","1237","1.5","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","2,2'-[2,2-dimethyl-1,3-propanediylbis(nitrilophenylmethylidyne)]diphenol","","- C31 H30 N2 O2 -","- C31 H30 N2 O2 -","- C62 H60 N4 O4 -","2","1","BM1090","Corden, J. P.; Errington, W.; Moore, P.; Phillips, P. R.; Wallbridge, M. G. H.","Two Schiff Base Ligands Derived from 2,2-Dimethyl-1,3-propanediamine","Acta Crystallographica Section C","1996","52","12","3199","3202","10.1107/S0108270196011134","","","0.71073","MoKα","","0.0676","0.0514","","0.1402","0.1259","","","","0.95","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005734","5.806","0.001","7.714","0.002","17.081","0.003","90","","90","","90","","765","0.3","103","2","103","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Me-alpha-D lyxopyranoside","Methyl alpha-D lyxopyranoside","","- C6 H12 O5 -","- C6 H12 O5 -","- C24 H48 O20 -","4","1","BM1092","Evdokimov, A. G.; Frolow, F.","Methyl α-<small>D</small>-Lyxopyranoside","Acta Crystallographica Section C","1996","52","12","3218","3219","10.1107/S0108270196009122","","","0.71073","MoKα","","0.0599","0.0577","","0.1502","0.1464","","","","1.073","1.081","1.081","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005735","9.0659","0.0009","10.0897","0.001","10.4858","0.001","109.35","0.011","108.26","0.011","97.64","0.01","828.86","0.18","293","","293","","","","","","","","","5","P -1","-P 1","2","","6-ammonio-1H^+^-1,4,8,11-tetraazacyclotridecane-5,7-dione dichloride methanol solvate","","- C10 H25 Cl2 N5 O3 -","- C10 H25 Cl2 N5 O3 -","- C20 H50 Cl4 N10 O6 -","2","1","BM1095","Mishra, A. K.; Gestin, J. F.; Faivre-Chauvet, A.; Chatal, J. F.; Evain, M.","6-Ammonio-(1<i>H</i>^+^)-1,4,8,11-tetraazacyclotridecane-5,7-dione Dichloride Methanol Solvate: an Amino-Pendant Tetraazacyclotridecane Derivative","Acta Crystallographica Section C","1996","52","12","3100","3102","10.1107/S0108270196009559","","","0.71073","MoKα","","0.04","0.04","","0.052","0.052","","","","1.753","1.753","1.753","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005736","11.911","0.009","15.794","0.008","7.468","0.014","90","","90","","90","","1405","3","153","","153","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C17 H12 N4 S -","- C17 H12 N4 S -","- C68 H48 N16 S4 -","4","1","BM1096","Alves, J. A. C.; Dillon, C. J.; Johnstone, R. A. W.","5-(2-Naphthyl)thio-1-phenyltetrazole: Chemical Reactivity and Electronic Effects of Conjugation through Sulfur","Acta Crystallographica Section C","1996","52","12","3163","3165","10.1107/S0108270196010839","","","0.71073","MoKα","","","0.0594","","","0.0632","","","","","1.746","1.746","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005737","7.7176","0.0016","17.328","0.004","7.8162","0.0015","90","","93.62","0.016","90","","1043.2","0.4","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","9α-fluoro-11β-hydroxy-21-methoxy-16α-methyl-pregna-1,4-diene-3,20,21-trione","","- C23 H29 F O5 -","- C23 H29 F O5 -","- C46 H58 F2 O10 -","2","1","BM1097","Negriolli, J.; Evain, M.; André, F.","A Corticosteroid Ester","Acta Crystallographica Section C","1996","52","12","3102","3104","10.1107/S0108270196009444","","","0.71073","MoKα","","0.059","0.059","","0.059","0.059","","","","1.421","1.421","1.421","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005738","10.806","0.001","21.947","0.004","9.614","0.004","90","","90","","90","","2280","1.1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S),(E)-5-Methoxycarbonyl-2-triphenylmethylaminohex-4-en-4-olide","","- C27 H25 N O4 -","- C27 H25 N O4 -","- C108 H100 N4 O16 -","4","1","BM1098","Nastopoulos, V.; Athanassopoulos, C.; Papaioannou, D.; Gavuzzo, E.","(<i>S</i>),(<i>E</i>)-5-Methoxycarbonyl-2-triphenylmethylaminohex-4-en-4-olide","Acta Crystallographica Section C","1996","52","12","3227","3229","10.1107/S0108270196011158","","","1.5418","CuKα","","0.0406","0.0347","","0.0977","0.0963","","","","1.045","1.075","1.075","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005739","6.276","0.001","15.232","0.001","16.616","0.002","90","","90","","90","","1588.4","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Z-N-formylnornuciferin","4,5,6a,7-tetrahydro-1,2-dimethoxy-6H-dibenzo[de,g]quinoline-6-carbaldehyde","","- C19 H19 N O3 -","- C19 H19 N O3 -","- C76 H76 N4 O12 -","4","1","BM1101","Simonsen, O.; Singh, S. K.; Wengel, J.; Parmar, V. S.","(<i>Z</i>)-<i>N</i>-Formylnornuciferin Isolated from <i>Piper argyrophylum</i>","Acta Crystallographica Section C","1996","52","12","3195","3196","10.1107/S0108270196010360","","","0.71073","MoKα","","0.095","0.041","","0.03","0.028","","","","2.131","2.484","2.484","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005740","12.454","0.007","11.382","0.008","17.841","0.007","90","","90","","90","","2529","2","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,3-diphenyl-4-imidazoline-2-thione","","- C15 H12 N2 S -","- C15 H12 N2 S -","- C120 H96 N16 S8 -","8","1","BM1103","Cox, P. J.; Sohal, B.; Skellern, G. G.; Love, S. W.; Shankland, N.","1,3-Diphenyl-4-imidazoline-2-thione","Acta Crystallographica Section C","1996","52","12","3152","3154","10.1107/S0108270196010931","","","0.71073","MoKα","","0.0941","0.0492","","0.1075","0.0971","","","","0.82","1.032","1.032","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005741","8.518","0.002","16.514","0.003","17.25","0.003","90","","90","","90","","2426.5","0.8","150","0.2","150","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5R-(2,3,4-Tri-O-acetyl-β-D-xylopyranosyl)-5-(2,3-O-isopropylidene- 1-O-methyl-α-D-lyxo-tetrafuranos-4-yl)-4,5-dihydroisoxazole","","- C22 H31 N O12 -","- C22 H31 N O12 -","- C88 H124 N4 O48 -","4","1","BM1111","Ferguson, W. J.; Parsons, S.; Paton, R. M.","The Major Isoxazoline Cycloadduct from Reaction of a Xylopyranosylnitrile Oxide with a Hex-5-enopyranoside","Acta Crystallographica Section C","1996","52","12","3067","3069","10.1107/S010827019601178X","","","1.54184","CuKα","","0.0827","0.0569","","0.1226","0.1073","","","","1.065","1.076","1.076","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005742","14.8887","0.001","20.4239","0.0013","7.1847","0.0005","90","","100.743","0.002","90","","2146.5","0.2","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","methyl 8-chlorobicyclo[7.1.0]deca-1,8-dien-4-yn-2-carboxylate","","- C12 H11 Cl O2 -","- C12 H11 Cl O2 -","- C96 H88 Cl8 O16 -","8","2","BM1113","Clegg, W.; Al Dulayymi, A. R.; Baird, M. S.","A Strained Cyclononadienyne","Acta Crystallographica Section C","1996","52","12","3219","3222","10.1107/S0108270196012152","","","0.71073","MoKα","","0.0824","0.0454","","0.1133","0.0999","","","","1.02","1.109","1.109","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005743","10.076","0.001","10.076","0.001","6.807","0.001","90","","90","","120","","598.4","0.2","296","2","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- As3 Ca5 Cl O12 -","- As3 Ca5 Cl O12 -","- As6 Ca10 Cl2 O24 -","2","0.166667","","","Chlorapatite: Ca~5~(AsO~4~)~3~Cl","Acta Crystallographica C","1996","52","","2959","2960","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2005744","7.004","0.001","5.374","0.0008","8.691","0.001","90","","110.18","0.01","90","","307.04","0.08","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","sodium yttrium diphosphate","","- Na O7 P2 Y -","- Na O7 P2 Y -","- Na2 O14 P4 Y2 -","2","1","BR1148","Hamady, A.; Jouini, T.","NaYP~2~O~7~","Acta Crystallographica Section C","1996","52","12","2949","2951","10.1107/S0108270196009626","","","0.71069","MoKα","","0.0718","0.0425","","0.1023","0.091","","","","1.087","1.159","1.159","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005745","15.555","0.002","7.5692","0.0006","17.362","0.007","90","","90.598","0.014","90","","2044.1","0.9","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Rubidium Indium Antimonide","Dirubidium phyllo-triantimonododiindate","","- In2 Rb2 Sb3 -","- In2 Rb2 Sb3 -","- In16 Rb16 Sb24 -","8","2","BR1152","Gourdon, O.; Boucher, F.; Gareh, J.; Evain, M.; O'Connor, C.; Jin-Seung, J.","Rubidium Indium Antimonide, Rb~2~In~2~Sb~3~","Acta Crystallographica Section C","1996","52","12","2963","2964","10.1107/S0108270196010104","","","0.56086","AgKα","","0.1039","0.0388","","0.0732","0.0637","","","","0.699","0.874","0.874","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005746","12.632","0.003","13.618","0.002","7.2249","0.0007","90","","90","","90","","1242.8","0.4","292","","292","","","","","","","","","7","P n m a","-P 2ac 2n","62","Gadolinium potassium iron hexacyanide trihydrate","Gadolinium potassium hexacyanoferrate (II) trihydrate","","- C6 H6 Fe Gd K N6 O3 -","- C6 Fe Gd K N6 O3 -","- C24 Fe4 Gd4 K4 N24 O12 -","4","0.5","BR1153","Mullica, D. F.; Ward, J. L.; Sappenfield, E. L.","Gadolinium Potassium Hexacyanoferrate(II) Trihydrate","Acta Crystallographica Section C","1996","52","12","2956","2959","10.1107/S0108270196010840","","","0.71073","MoKα","","0.027","0.023","","0.407","0.043","","","","","1.165","1.165","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005747","13.904","0.002","17.525","0.002","13.406","0.002","90","","95.964","0.006","90","","3248.9","0.8","300","2","300","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Tris(N,N-diethyldithiocarbamato-S,S')nickel(IV) 1,1,2,3,3-pentacyanopropenide","","- C23 H30 N8 Ni S6 -","- C23 H20 N8 Ni S6 -","- C92 H80 N32 Ni4 S24 -","4","1","CF1075","Chen, W.; Li, H.; Zhong, Z.-J.; Zhang, K.; You, X.-Z.","Tris(<i>N</i>,<i>N</i>-diethyldithiocarbamato-<i>S</i>,<i>S</i>')nickel(IV) 1,1,2,3,3-Pentacyanopropenide","Acta Crystallographica Section C","1996","52","12","3030","3033","10.1107/S0108270196009663","","","0.71073","MoKα","","0.0544","0.0443","","0.1063","0.0994","","","","1.083","1.101","1.101","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005748","25.348","0.003","7.8824","0.0007","11.928","0.001","90","","96.8","0.02","90","","2366.5","0.4","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","C24 H29 O9 Cl","18-chloro,4α-hydroxy derivative of 19-acetylteupolin IV","","- C24 H29 Cl O9 -","- C24 H29 Cl O9 -","- C96 H116 Cl4 O36 -","4","1","CF1084","","An 18-Chloro-4α-hydroxy Derivative of 19-Acetylteupolin IV: a Neo-clerodane Diterpenoid of Biological Interest","Acta Crystallographica C","1996","52","","3157","3159","10.1107/S0108270196009110","","","1.5418","CuKα","","0.0554","0.0522","","0.1322","0.1288","","","","1.016","1.05","1.05","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005749","20.074","0.004","14.331","0.003","23.334","0.005","90","","106.77","0.03","90","","6427","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Bis(hexafluoroacetylacetonato)barium^.^(pentaglyme)","Bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato)barium^.^(2,5,8,11,14,17- hexaoxaoctadecane)","","- C22 H28 Ba F12 O10 -","- C22 H28 Ba F12 O10 -","- C176 H224 Ba8 F96 O80 -","8","1","CF1089","Motevalli, M.; O'Brien, P.; Watson, I. M.","Bis(1,1,1,5,5,5-hexafluoro-2,4-pentanedionato)(2,5,8,11,14,17-hexaoxaoctadecane)barium","Acta Crystallographica Section C","1996","52","12","3028","3030","10.1107/S0108270196011122","","","0.71073","MoKα","","0.0455","0.037","","0.1108","0.106","","","","1.07","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005750","12.334","0.002","11.742","0.003","13.236","0.002","90","","116.9","0.01","90","","1709.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-(N'-Benzoylimino)-5H-benzimidazo[2,1-b][1,3,5]benzothiadiazepine","","- C21 H14 N4 O S -","- C21 H14 N4 O S -","- C84 H56 N16 O4 S4 -","4","1","CF1101","Song, C. E.; Jin, B. W.; Jeong, J. H.","12-(<i>N</i>-Benzoylimino)-11,12-dihydrobenzimidazo[2,1-<i>b</i>][1,3,5]benzothiadiazepine","Acta Crystallographica Section C","1996","52","12","3131","3133","10.1107/S0108270196009249","","","0.71073","MoKα","","0.0738","0.0613","","0.1126","0.1068","","","","1.148","1.172","1.172","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005751","5.739","0.001","7.621","0.002","36.561","0.005","90","","90","","90","","1599.1","0.6","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H14 Cl N S -","- C18 H14 Cl N S -","- C72 H56 Cl4 N4 S4 -","4","1","","","(E)-3-(4-Chlorophenyl)-3-cyclopropyl-2-(phenylthio)acrylonitrile","Acta Crystallographica C","1996","52","","2945","2947","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005752","9.841","0.001","21.845","0.002","13.015","0.003","90","0.2","94.43","0.05","90","0.3","2789.6","0.8","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H28 Cl2 N6 O4 -","- C28 H23 Cl2 N6 O4 -","- C112 H92 Cl8 N24 O16 -","4","1","CF1108","Hasnaoui, A.; El Messaoudi, M.; Lavergne, J. P.; Giorgi, M.; Pierrot, M.","A Strained Tricyclic Product of a Dipolar 1,3-Cycloaddition Reaction of Diazepine","Acta Crystallographica Section C","1996","52","12","3213","3215","10.1107/S0108270196009675","","","0.71073","MoKα","","0.144","0.057","","","0.082","","","","","2.885","2.885","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2005753","9.414","0.001","10.339","0.002","14.675","0.002","90","","102.1","0.02","90","","1396.6","0.4","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","penicillin V benzhydryl ester sulfoxide","diphenylmethyl 3,3-dimethyl- 7-oxo-6-phenoxyacetamido-4-thia-1-azabicylo[3.2.0] heptane-2-carboxylate-4-oxide monohydrate","","- C29 H30 N2 O7 S -","- C29 H30 N2 O7 S -","- C58 H60 N4 O14 S2 -","2","1","CF1116","Yoon, T.-S.; Shin, W.","Penicillin V Benzhydryl Ester Sulfoxide Monohydrate","Acta Crystallographica Section C","1996","52","12","3142","3144","10.1107/S0108270196009250","","","1.5418","CuKα","","0.0479","0.0341","","0.0905","0.0854","","","","1.069","1.077","1.077","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005754","23.896","0.002","10.608","0.004","20.173","0.003","90","","114.218","0.006","90","","4663.6","1.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H25 B10 P -","- C20 H25 B10 P -","- C160 H200 B80 P8 -","8","2","CF1123","McWhannell, M. A.; Rosair, G. M.; Welch, A. J.; Teixidor, F.; Viñas, C.","1-Diphenylphosphino-2-phenyl-1,2-dicarba-<i>closo</i>-dodecaborane(12)","Acta Crystallographica Section C","1996","52","12","3135","3138","10.1107/S0108270196009109","","","0.71073","MoKα","","0.1776","0.0689","","0.181","0.1294","","","","0.988","1.101","1.101","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005755","9.747","0.002","5.747","0.001","18.971","0.004","90","","91.08","0.03","90","","1062.5","0.4","205","2","205","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N-Benzyl-1-deoxy-1-(2-furyl)-1-(hydroxiamino)-2,3:4,5-di- O-isopropylidene-L-manno-pentitol","","- C22 H29 N O6 -","- C22 H29 N O6 -","- C44 H58 N2 O12 -","2","1","CF1124","Merino, P.; Junquera, F.; Merchan, F. L.; Tejero, T.","Chiral Hydroxylamines. III. 1-(<i>N</i>-Benzyl-<i>N</i>-hydroxyamino)-1-deoxy-1-(2-furyl)-2,3:4,5-di-<i>O</i>-isopropylidene-<small>L</small>-<i>manno</i>-pentitol","Acta Crystallographica Section C","1996","52","12","3197","3198","10.1107/S0108270196009687","","","0.71073","MoKα","","0.0876","0.0732","","0.1824","0.1696","","","","1.038","1.078","1.078","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005756","7.43","0.001","14.676","0.002","13.406","0.002","90","","91.06","0.01","90","","1461.6","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetracarbonylbis(pyridino)tungsten(0)","","- C14 H10 N2 O4 W -","- C14 H10 N2 O4 W -","- C56 H40 N8 O16 W4 -","4","0.5","CF1125","Holzbock, J.; Sawodny, W.; Grosse, E.; Haseidl, M.; Walz, L.","<i>cis</i>-Tetracarbonyldi(pyridine-<i>N</i>)tungsten(0), [W(CO)~4~(py)~2~]","Acta Crystallographica Section C","1996","52","12","3039","3040","10.1107/S0108270196010128","","","0.71073","MoKα","","0.022","0.0185","","0.0456","0.0447","","","","1.009","1.035","1.035","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005757","11.628","0.002","5.5524","0.0006","23.931","0.003","90","","96.82","0.02","90","","1534.1","0.4","294","1","294","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4,4'-Thiodiphenol-piperazine (1/1)","","- C16 H20 N2 O2 S -","- C16 H20 N2 O2 S -","- C64 H80 N8 O8 S4 -","4","0.5","CF1131","Coupar, P. I.; Ferguson, G.; Glidewell, C.","N—H···pi(arene) Hydrogen Bonding in 4,4'-Thiodiphenol-Piperazine (1/1)","Acta Crystallographica Section C","1996","52","12","3055","3057","10.1107/S010827019601013X","","","0.7107","MolybdenumKα","","0.1329","0.0543","","0.1155","0.0994","","","","0.937","1.179","1.179","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005758","17.494","0.003","9.172","0.002","17.388","0.003","90","","116.7","0.1","90","","2492","2","298","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","β-meso (5,7,7,12,12,14-hexamethyl-1,4,8,11-tetraazzcyclo- tetradecane) Nickel(II) Diperchlorate Monohydrate","","- C16 H38 Cl2 N4 Ni O9 -","- C16 H38 Cl2 N4 Ni O9 -","- C64 H152 Cl8 N16 Ni4 O36 -","4","1","DE1023","Wang, A.; Lee, T.-J.; Chen, B.-H.; Yuan, Y.-Z.; Chung, C.-S.","β-<i>meso</i>-(5,7,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane)nickel(II) Diperchlorate Monohydrate","Acta Crystallographica Section C","1996","52","12","3033","3035","10.1107/S0108270196010608","","","0.71069","MoKα","","","0.0596","","","0.0581","","","","","1.81","1.81","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2005759","6.06","0.002","7.185","0.003","16.872","0.006","101.44","0.03","91.93","0.03","86.93","0.04","718.8","0.5","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C19 H13 N O3 -","- C19 H13 N O3 -","- C38 H26 N2 O6 -","2","1","DE1029","Raj, S. S. S.; Ponnuswamy, M. N.; Shanmugam, G.; Nanjundan, S.","1-(2-Naphthyl)-3-(4-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section C","1996","52","12","3145","3146","10.1107/S0108270196009377","","","1.54184","CuKα","","","0.058","","","0.064","","","","","2.16","2.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005760","7.694","0.0001","11.135","0.0001","17.6949","0.0001","90","","101.62","0.01","90","","1484.9","0.06","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H22 N2 O -","- C16 H22 N2 O -","- C64 H88 N8 O4 -","4","1","DE1035","Ganesh, V. K.; Velmurugan, D.; Thiruvalluvar, A.; Parthasarathi, V.; Ramasubbu, N.; Natarajan, D.","1-Methyl-2-phenyldecahydroquinolin-4-one Oxime","Acta Crystallographica Section C","1996","52","12","3177","3179","10.1107/S0108270196009456","","","1.54184","CuKα","","","0.05","","","0.067","","","","","0.95","0.95","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005761","4.6512","0.0016","6.3261","0.0024","7.499","0.003","101.375","0.023","105.923","0.017","101.237","0.019","200.63","0.14","293","","293","","","","","","","","","3","P -1","-P 1","2","","","","- Al2 Fe3 Si3 -","- Al2 Fe3 Si3 -","- Al4 Fe6 Si6 -","2","1","DU1157","Yanson, T. I.; Manyako, M. B.; Bodak, O. I.; German, N. V.; Zarechnyuk, O. S.; Cerný, R.; Pacheco, J. V.; Yvon, K.","Triclinic Fe~3~Al~2~Si~3~ and Orthorhombic Fe~3~Al~2~Si~4~ with New Structure Types","Acta Crystallographica Section C","1996","52","12","2964","2967","10.1107/S0108270196008694","","","0.71073","x-ray","","0.068","0.056","","0.031","0.031","","","","1.217","1.27","1.27","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005762","3.6687","0.0015","12.385","0.007","10.147","0.005","90","","90","","90","","461","0.4","293","","293","","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Al2 Fe3 Si4 -","- Al2 Fe3 Si4 -","- Al8 Fe12 Si16 -","4","0.25","DU1157","Yanson, T. I.; Manyako, M. B.; Bodak, O. I.; German, N. V.; Zarechnyuk, O. S.; Cerný, R.; Pacheco, J. V.; Yvon, K.","Triclinic Fe~3~Al~2~Si~3~ and Orthorhombic Fe~3~Al~2~Si~4~ with New Structure Types","Acta Crystallographica Section C","1996","52","12","2964","2967","10.1107/S0108270196008694","","","0.71073","x-ray","","0.065","0.061","","0.039","0.039","","","","1.638","1.685","1.685","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005763","8.648","0.002","8.8428","0.0007","12.316","0.002","90","","90.13","0.02","90","","941.8","0.3","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- In1.5 Li2 Nb0.5 O12 P3 -","- In1.34 Li2 Nb0.66 O12 P3 -","- In5.36 Li8 Nb2.64 O48 P12 -","4","1","DU1158","Cieren, X.; Jaulmes, S.; Angenault, J.; Couturier, J. C.; Quarton, M.","La Phase Monoclinique Li~2~Nb~0,5~In~1,5~(PO~4~)~3~","Acta Crystallographica Section C","1996","52","12","2967","2969","10.1107/S0108270196008153","","","0.71069","MoKα","","","0.0527","","","0.0525","","","","","25.9","25.9","","","","","has coordinates","176342","2020-10-21","18:00:00",""
"2005764","24.904","0.005","6.029","0.0012","5.164","0.001","90","","90","","90","","775.4","0.3","153","2","153","2","","","","","","","","5","P n a 21","P 2c -2n","33","","4-Bromo-2H-1,3-Benzoxazine-2,4(1H)-dione","","- C8 H4 Br N O3 -","- C8 H4 Br N O3 -","- C32 H16 Br4 N4 O12 -","4","1","DU1159","Lubini, P.; Wouters, J.","6-Bromo-2<i>H</i>-3,1-benzoxazine-2,4(1<i>H</i>)-dione at 153K","Acta Crystallographica Section C","1996","52","12","3108","3110","10.1107/S0108270196008888","","","0.71073","MoKα","","0.0625","0.0559","","0.1424","0.1343","","","","1.026","1.02","1.02","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2005765","17.479","0.004","8.929","0.002","11.959","0.003","90","","113.1","0.2","90","","1717","3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Molybdenyl diarseniate de potassium","","- As4 K2 Mo3 O20 -","- As4 K2 Mo3 O20 -","- As16 K8 Mo12 O80 -","4","0.5","DU1162","Zid, M. F.; Jouini, T.","K~2~MoO~2~(MoO~2~As~2~O~7~)~2~","Acta Crystallographica Section C","1996","52","12","2947","2949","10.1107/S0108270196008700","","","0.71069","MoKα","","0.0436","0.0303","","0.0744","0.067","","","","1.106","1.108","1.108","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005766","4.8366","0.0007","12.539","0.0009","9.3207","0.0009","90","","93.03","0.01","90","","564.47","0.11","296","","296","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","sym-Hexahydropyrene","","","- C16 H16 -","- C16 H16 -","- C32 H32 -","2","0.5","FG1217","A. J. Dobson; R. E. Gerkin","<i>sym</i>-Hexahydropyrene","Acta Crystallographica Section C","1996","52","12","3086","3088","10.1107/S0108270196010013","","","0.71073","MoKα","","","0.035","","","0.047","","","","","2.04","2.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005767","16.094","0.001","16.094","0.001","6.717","0.001","90","","90","","120","","1506.7","0.3","293","2","293","2","","","","","","","","5","R 3 :H","R 3","146","Chlorotris(m-methoxyphenyl)Tin(IV)","Chlorotris(m-methoxyphenyl)Tin(IV)","","- C21 H21 Cl O3 Sn -","- C21 H21 Cl O3 Sn -","- C63 H63 Cl3 O9 Sn3 -","3","0.333333","FG1223","Wharf, I.; Lebuis, A.-M.","Chlorotris(<i>m</i>-methoxyphenyl)tin(IV)","Acta Crystallographica Section C","1996","52","12","3025","3027","10.1107/S0108270196012115","","","0.7093","MoKα","","0.0246","0.0244","","0.0522","0.0521","","","","1.049","1.048","1.048","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005768","8.1693","0.0005","21.7076","0.0012","8.375","0.0008","90","","96.515","0.009","90","","1475.6","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(±)-1,11-dimethyl-3,9-dinitro-5,7-dihydrodibenz[c,e]oxepin","","- C16 H14 N2 O5 -","- C16 H14 N2 O5 -","- C64 H56 N8 O20 -","4","1","FG1226","Roszak, A. W.; Williams, V. E.; Lemieux, R. P.","(±)-1,11-Dimethyl-3,9-dinitro-5,7-dihydrodibenz[<i>c</i>,<i>e</i>]oxepine","Acta Crystallographica Section C","1996","52","12","3190","3193","10.1107/S0108270196011900","","","1.54178","CuKα","","0.073","0.0498","","0.1691","0.1419","","","","1.116","1.172","1.172","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005769","6.4957","0.0006","24.723","0.002","5.1393","0.0004","90","","90","","90","","825.34","0.12","294","","294","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H7 N3 O2 -","- C8 H7 N3 O2 -","- C32 H28 N12 O8 -","4","1","FG1227","Davidson, J. S.; Trotter, J.","5-(2-Aminophenyl)-1,3,4-oxadiazol-2(3<i>H</i>)-one","Acta Crystallographica Section C","1996","52","12","3236","3238","10.1107/S0108270196011912","","","1.5418","CuKα","","0.055","0.031","","0.049","0.041","","","","1.6","1.51","1.51","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005770","11.963","0.001","11.963","0.001","15.282","0.002","90","","90","","90","","2187.1","0.4","296","","296","","","","","","","","","4","I 41 c d","I 4bw -2c","110","γ-aminobutyric acid","4-aminobutanoic acid","","- C4 H9 N O2 -","- C4 H9 N O2 -","- C64 H144 N16 O32 -","16","1","FR1001","Dobson, A. J.; Gerkin, R. E.","γ-Aminobutyric Acid: a Novel Tetragonal Phase","Acta Crystallographica Section C","1996","52","12","3075","3078","10.1107/S0108270196010001","","","0.71073","MoKα","","","0.033","","","0.037","","","","","1.46","1.46","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005771","15.962","0.002","5.218","0.002","9.613","0.002","90","","90","","90","","800.7","0.4","296","","296","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2-acetylbenzoic acid, phthalide form","","","- C9 H8 O3 -","- C9 H8 O3 -","- C36 H32 O12 -","4","1","FR1004","Dobson, A. J.; Gerkin, R. E.","2-Acetylbenzoic Acid: Phthalide Form","Acta Crystallographica Section C","1996","52","12","3078","3081","10.1107/S0108270196010414","","","0.71073","MoKα","","","0.027","","","0.034","","","","","1.4","1.4","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005772","11.342","0.001","5.517","0.001","13.823","0.001","90","","106.39","0.01","90","","829.81","0.18","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","coumarin-3-carboxylic acid","","","- C10 H6 O4 -","- C10 H6 O4 -","- C40 H24 O16 -","4","1","FR1005","Dobson, A. J.; Gerkin, R. E.","Coumarin-3-carboxylic Acid","Acta Crystallographica Section C","1996","52","12","3081","3083","10.1107/S0108270196010852","","","0.71073","MoKα","","","0.037","","","0.045","","","","","1.5","1.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005773","7.46","0.001","17.118","0.003","20.707","0.003","90","","90","","90","","2644.3","0.7","296","","296","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Pregnenolone-4-allyloxybenzoate","Pregn-5-en-20-one-3-yl_4-allyloxybenzoate","","- C31 H40 O4 -","- C31 H40 O4 -","- C124 H160 O16 -","4","1","HA1161","Tomlin, D. W.; Bunning, T. J.; McHugh, C. M.; Adams, W. W.","Oxopregnenyl 4-Allyloxybenzoate","Acta Crystallographica Section C","1996","52","12","3181","3183","10.1107/S0108270196005562","","","0.71073","MoKα","","","0.079","","","0.053","","","","","2.473","2.473","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005774","33.01","0.03","7.915","0.004","7.096","0.004","90","","90","","90","","1854","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-5,6-Dimethoxy-1,2,3,4-tetrahydro-2-naphthalenamine (S)-mandelic acid salt","","- C20 H25 N O5 -","- C20 H25 N O5 -","- C80 H100 N4 O20 -","4","1","HA1167","Fantucci, M.; Montanari, S.; Santangelo, F.; Ianelli, S.; Nardelli, M.","(<i>S</i>)-5,6-Dimethoxy-1,2,3,4-tetrahydro-2-naphthalenamine‒ <small>L</small>-(+)-Mandelic Acid (1/1): the Absolute Configuration of a Precursor of the Active Stereoisomer of 5,6-ADTN, an Important Dopaminergic Agonist","Acta Crystallographica Section C","1996","52","12","3147","3150","10.1107/S0108270196009614","","","1.54178","CuKα","","0.072","0.0302","","0.0768","0.0602","","","","1.027","1.099","1.099","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005775","10.246","0.003","16.104","0.005","10.462","0.005","90","","106.94","0.02","90","","1651.3","1.1","150","0.2","150","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N2 O2 S3 -","- C16 H18 N2 O2 S3 -","- C64 H72 N8 O8 S12 -","4","1","HA1177","Blake, A. J.; Danks, J. P.; Parsons, S.; Schröder, M.","4,7-Bis(2-thiophenoyl)-1-thia-4,7-diazacyclononane","Acta Crystallographica Section C","1996","52","12","3062","3064","10.1107/S0108270196012012","","","0.71073","MoKα","","0.0445","0.0317","","0.0895","0.0746","","","","1.073","1.059","1.059","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005776","7.189","0.001","7.744","0.002","9.331","0.002","90","0.02","110.32","0.04","90","0.03","487.1","0.2","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Li Ni1.5 O7 P2 -","- Li Ni1.5 O7 P2 -","- Li4 Ni6 O28 P8 -","4","1","JZ1112","Rissouli, K.; Benkhouja, K.; Sadel, A.; Bettach, M.; Zahir, M.; Giorgi, M.; Pierrot, M.","A Mixed Nickel‒Lithium Pyrophosphate, LiNi~1.5~P~2~O~7~","Acta Crystallographica Section C","1996","52","12","2960","2963","10.1107/S0108270196002739","","","0.71073","MoKα","","0.03","0.028","","","0.04","","","","","1.521","1.521","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005777","13.885","0.001","13.885","0.001","26.207","0.003","90","","90","","90","","5052.5","0.8","295","","295","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H30 Cd I4 S2 -","- C12 Cd I4 S2 -","- C96 Cd8 I32 S16 -","8","0.5","JZ1124","Bengtsson-Kloo, L.; Berglund, J.; Stegemann, H.; Svensson, C.; Svensson, P. H.","Bis(triethylsulfonium) Tetraiodocadmate(II)","Acta Crystallographica Section C","1996","52","12","3045","3047","10.1107/S0108270196006956","","","0.7107","MoKα","","","0.0486","","","0.0525","","","","","1.702","1.702","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2005778","11.916","0.002","9.2894","0.0013","12.835","0.002","90","","117.607","0.011","90","","1259","0.4","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-amino-1,3-dimethyl-5-(3-penten-2-one-4-yl)-aminouracil","","- C11 H16 N4 O3 -","- C11 H16 N4 O3 -","- C44 H64 N16 O12 -","4","1","JZ1155","Jimenez-Pulido, S. B.; Low, J. N.; Ferguson, G.; Moreno-Carretero, M. N.; Hueso-Ureña, F.","6-Amino-1,3-dimethyl-5-(4-oxo-2-penten-2-yl)aminouracil","Acta Crystallographica Section C","1996","52","12","3110","3112","10.1107/S0108270196010773","","","0.7107","MolybdenumKα","","0.1272","0.0477","","0.1361","0.1164","","","","0.929","1.216","1.216","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005779","6.284","0.001","23.51","0.001","9.033","0.001","90","","101.7","0.01","90","","1306.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetra(2-pyridinium)pyrazine-tetrachloride-dihydrate","","- C24 H24 Cl4 N6 O2 -","- C24 H24 Cl4 N6 O2 -","- C48 H48 Cl8 N12 O4 -","2","0.5","JZ1156","Graf, M.; Stoeckli-Evans, H.","Tetraprotonated Tetra(2-pyridyl)pyrazine: Pyrazine-2,3,5,6-tetra(2-pyridinium) Tetrachloride Dihydrate","Acta Crystallographica Section C","1996","52","12","3073","3075","10.1107/S0108270196010943","","","0.71073","MoKα","","0.0505","0.0323","","0.0955","0.08","","","","1.108","1.075","1.075","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005780","7.939","0.002","7.713","0.003","25.291","0.006","90","","90","","90","","1548.7","0.8","100","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6,7,8,14-tetradehydro-4,5-epoxy-3,6-dimethoxy-17-methylmorphinan","","- C19 H21 N O3 -","- C19 H21 N O3 -","- C76 H84 N4 O12 -","4","1","KA1169","Mahler, C. H.; Stevens, E. D.; Trudell, M. L.; Nolan, S. P.","({-})-Thebaine","Acta Crystallographica Section C","1996","52","12","3193","3195","10.1107/S0108270196005392","","","0.71073","Mo-Kα","","","0.042","","","0.054","","","","","1.874","1.874","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2005781","9.4429","0.0006","11.3908","0.0008","21.123","0.002","90","0.007","90","0.008","90","0.005","2272","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3S,5S,1'S)-3-benzyl-5-[1'-(tert-butoxycarbonylamino)- -2'-phenylethyl]-4,5-dihydrofuran-2(3H)-one","","- C24 H29 N O4 -","- C24 H29 N O4 -","- C96 H116 N4 O16 -","4","1","KA1190","Sopková, J.; Vojtísek, P.; Litera, J.; Soucek, M.","(3<i>S</i>,5<i>S</i>,1'<i>S</i>)-3-Benzyl-5-[1'-(<i>tert</i>-butoxycarbonylamino)-2'-phenylethyl]-4,5-dihydrofuran-2(3<i>H</i>)-one","Acta Crystallographica Section C","1996","52","12","3165","3167","10.1107/S0108270196009754","","","0.71073","MoKα","","0.0709","0.0325","","0.0876","0.0744","","","","1.045","1.105","1.105","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005782","5.202","0.001","16.329","0.005","9.745","0.007","90","","98.33","0.04","90","","819","0.7","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Zearalenone","","- C18 H22 O5 -","- C18 H22 O5 -","- C36 H44 O10 -","2","1","KA1200","Panneerselvam, K.; Rudiño-Piñera, E.; Soriano-García, M.","3,4,5,6,9,10-Hexahydro-14,16-dihydroxy-3-methyl-1<i>H</i>-2-benzoxacyclotetradecin-1,7(8<i>H</i>)-dione (Zearalenone)","Acta Crystallographica Section C","1996","52","12","3095","3097","10.1107/S0108270196011055","","","1.54178","CuKα","","0.0653","0.0503","","0.0852","0.08","","","","1.166","1.287","1.287","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005783","11.929","0.003","9.357","0.003","10.434","0.003","90","","113.32","0.02","90","","1069.5","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N-bis-(4-methoxybenziliden)ethylendiamine:Hydroquinone (1:1)","","- C24 H26 N2 O4 -","- C24 H26 N2 O4 -","- C48 H52 N4 O8 -","2","0.5","KA1210","Panneerselvam, K.; Soriano-García, M.; Reyes-Arellano, A.; Tamariz-Mascarúa, J.; Mendoza-Sánchez, R. I.","The 1:1 Molecular Complex of <i>N</i>,<i>N</i>'-Bis(4-methoxybenzylidene)ethylenediamine and Hydroquinone","Acta Crystallographica Section C","1996","52","12","3098","3100","10.1107/S0108270196011067","","","1.54178","CuKα","","0.0393","0.035","","0.0952","0.0904","","","","1.098","1.109","1.109","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005784","10.739","0.003","15.452","0.005","14.522","0.005","90","","109.59","0.03","90","","2270.3","1.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4,5-dihydroxy-1-nitro-anthraquinone","4,5-dihydroxy-1-nitro-9,10-anthracenedione","","- C14 H7 N O6 -","- C14 H7 N O6 -","- C112 H56 N8 O48 -","8","2","KA1211","Yatsenko, A. V.; Paseshnichenko, K. A.; Popov, S. I.","4,5-Dihydroxy-1-nitroanthracene-9,10-dione","Acta Crystallographica Section C","1996","52","12","3258","3260","10.1107/S0108270196011754","","","0.71073","MoKα","","0.0839","0.044","","0.1204","0.1065","","","","0.912","1.111","1.111","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005785","17.5555","0.0011","7.3717","0.0007","26.736","0.002","90","","90","","90","","3460","0.5","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(Z)-2-acetoxy-3,3',4'-trimethoxystilbene","","- C19 H20 O5 -","- C19 H20 O5 -","- C152 H160 O40 -","8","1","KA1212","Li, S.; Lundquist, K.; Stomberg, R.","(<i>Z</i>)-2-Acetoxy-3,3',4'-trimethoxystilbene","Acta Crystallographica Section C","1996","52","12","3118","3121","10.1107/S0108270196011079","","","0.71069","MoKα","","0.1793","0.0474","","0.1629","0.1035","","","","1","1.081","1.081","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2005786","10.477","0.002","6.953","0.001","19.865","0.003","90","","99.55","0.02","90","","1427","0.4","294","","294","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,3-diphenyl-1,2,4-benzotriazin-4(1H)-yl","","- C19 H14 N3 -","- C19 H14 N3 -","- C76 H56 N12 -","4","1","KA1215","Krieger, C.; Neugebauer, F. A.","Columnar Stacking of 1,3-Diphenyl-1,2,4-benzotriazin-4(1<i>H</i>)-yl Radicals","Acta Crystallographica Section C","1996","52","12","3124","3126","10.1107/S0108270196011092","","","0.71073","MoKα","","0.041","0.057","","","0.05","","","","","2.187","2.187","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005787","14.79","0.002","8.562","0.0012","14.38","0.003","90","","98.853","0.0013","90","","1799.3","0.5","298","","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","ethyl 2-fluoro-2(p-toluoyl)-3-oxo-3-(p-tolyl)propanoate","","- C20 H19 F O4 -","- C20 H19 F O4 -","- C80 H76 F4 O16 -","4","1","KH1096","Kim, M.-J.; Shin, J.-C.; Lee, J.-H.; Rhie, D.-Y.; Kim, D.-Y.; Suh, I.-H.; Choi, S.-S.; Jensen, W. P.; Lewis, D. E.","Ethyl 2-Fluoro-3-oxo-2-(<i>p</i>-toluoyl)-3-(<i>p</i>-tolyl)propanoate, C~20~H~19~O~4~F","Acta Crystallographica Section C","1996","52","12","3127","3128","10.1107/S0108270196011250","","","0.71069","MoKα","","0.146","0.0675","","0.1321","0.1092","","","","0.984","1.227","1.227","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005788","10.529","0.002","10.9805","0.0014","18.362","0.004","90","","99.72","0.02","90","","2092.4","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H30 N2 -","- C23 H30 N2 -","- C92 H120 N8 -","4","1","KH1109","Lin, K.-J.; Wu, J.-Y.; Chen, C.-T.","<i>meso</i>-(3,5-Di-<i>tert</i>-butylphenyl)-2,2'-dipyrromethane","Acta Crystallographica Section C","1996","52","12","3114","3116","10.1107/S0108270196010542","","","0.71073","MoKα","","0.0713","0.0434","","0.1495","0.1304","","","","0.921","0.999","0.999","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005789","8.526","0.001","13.857","0.001","18.519","0.001","90","","90","","90","","2187.9","0.3","294","2","294","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","rac. Cyclododeca-2.8-diyne-1.10-diole","","- C12 H16 O2 -","- C12 H16 O2 -","- C96 H128 O16 -","8","1","KH1110","Boss, C.; Stoeckli-Evans, H.; Keese, R.","The First Crystal Structure Analysis of Cyclododeca-2,8-diyne-1,10-diols","Acta Crystallographica Section C","1996","52","12","3069","3073","10.1107/S0108270196009080","","","0.71073","MoKα","","0.1054","0.0444","","0.0929","0.0783","","","","0.882","1.044","1.044","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005790","8.115","0.002","10.4765","0.0011","15.093","0.004","90","","94.59","0.03","90","","1279","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","rac. 1,10-dimethyl-cyclododeca-2,8-diyne-1,10-diol","","- C14 H20 O2 -","- C14 H20 O2 -","- C56 H80 O8 -","4","1","KH1110","Boss, C.; Stoeckli-Evans, H.; Keese, R.","The First Crystal Structure Analysis of Cyclododeca-2,8-diyne-1,10-diols","Acta Crystallographica Section C","1996","52","12","3069","3073","10.1107/S0108270196009080","","","0.71073","MoKα","","0.0567","0.0515","","0.1094","0.1053","","","","1.215","1.221","1.221","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005791","6.699","0.0015","9.3743","0.0003","12.892","0.004","90","","90","","90","","809.6","0.3","293","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4,4-dimethylcycohexan-1.3-dione","","- C8 H12 O2 -","- C8 H12.624 O2 -","- C32 H50.496 O8 -","4","1","LI1150","Barnes, J. C.","Hydrogen Bonding in 4,4-Dimethylcyclohexane-1,3-dione and 2,5,5-Trimethylcyclohexane-1,3-dione Monohydrate","Acta Crystallographica Section C","1996","52","12","3159","3162","10.1107/S0108270196008980","","","0.71069","MoKα","","0.0557","0.0387","","0.0986","0.0873","","","","0.564","0.637","0.637","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005792","5.863","0.01","13.558","0.01","11.225","0.008","90","","97.8","0.1","90","","884","1.8","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,5,5-trimethylcyclohexan-1,3-dione monohydrate","","- C9 H16 O3 -","- C9 H16 O3 -","- C36 H64 O12 -","4","1","LI1150","Barnes, J. C.","Hydrogen Bonding in 4,4-Dimethylcyclohexane-1,3-dione and 2,5,5-Trimethylcyclohexane-1,3-dione Monohydrate","Acta Crystallographica Section C","1996","52","12","3159","3162","10.1107/S0108270196008980","","","0.71069","MoKα","","0.085","0.0652","","0.1823","0.1644","","","","1.266","1.392","1.392","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005793","9.448","0.003","9.918","0.003","15.173","0.005","107.85","0.02","93.67","0.02","104.74","0.02","1293.1","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis(dicyanamide)tetrakis(4-methylimidazole) nickel(II) complex, C~20~H~24~N~14~Ni~1~","","- C20 H24 N14 Ni -","- C20 H24 N14 Ni -","- C40 H48 N28 Ni2 -","2","1","MU1201","Kožíšek, J.; Paulus, H.; Danková, M.; Hvastijová, M.","<i>trans</i>-Bis(dicyanamido-<i>N</i>)tetrakis(4-methylimidazole-<i>N</i>^1^)nickel(II)","Acta Crystallographica Section C","1996","52","12","3019","3020","10.1107/S0108270196010311","","","0.71069","MoKα","","0.0584","0.037","","0.1118","0.0872","","","","1.113","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005794","15.181","0.002","9.911","0.001","19.114","0.004","90","","93.64","0.01","90","","2870.1","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(1.8-bis(2-hydroxyethyl)-1,3,6,8,10,13-hexaazacyclotetradecane) nickel(II)Bis(maleonitriledithiolate)nickelate(II)","","- C20 H30 N10 Ni2 O2 S4 -","- C20 H30 N10 Ni2 O2 S4 -","- C80 H120 N40 Ni8 O8 S16 -","4","0.5","MU1259","Shan, B.-Z.; You, X.-Z.; Fun, H.-K.; Sivakumar, K.","[1,8-Bis(2-hydroxyethyl)-1,3,6,8,10,13-hexaazacyclotetradecane]nickel(II) Bis(maleonitriledithiolato)nickelate(II)","Acta Crystallographica Section C","1996","52","12","3035","3037","10.1107/S0108270196009389","","","0.71073","MoKα","","0.0395","0.033","","0.0993","0.0932","","","","1.059","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005795","21.86","0.02","12.48","0.02","11.047","0.008","90","","90","","90","","3014","6","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-methyl-4-methylamino-3,5-diphenyl-1,2,4,3,5-triazadiborole","","- C14 H18 B2 N4 -","- C14 H18 B2 N4 -","- C112 H144 B16 N32 -","8","1","MU1263","Engelhardt, U.; Park, S. S.","An Inorganic <i>N</i>-Amino Analogue of Pyrrole: a Five-Membered Ring with Methylhydrazine and Two B Atoms as Building Blocks","Acta Crystallographica Section C","1996","52","12","3248","3250","10.1107/S0108270196010232","","","0.71069","MoKα","","0.035","0.08","","0.197","0.03","","","","1.38","1.99","1.99","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005796","9.842","0.004","15.775","0.002","7.382","0.001","100.04","0.01","95.75","0.02","79.02","0.02","1105.2","0.5","293","5","293","3","","","","","","","","5","P -1","-P 1","2","","3,7-bis(dimethylamino)-(N-carboxymethyl)phenothiazine-10-carboxamide","","- C21 H28 N4 O4 S -","- C21 H28 N4 O4 S -","- C42 H56 N8 O8 S2 -","2","1","MU1269","Fujii, I.; Hirayama, N.; Aoyama, N.; Miike, A.","10-(<i>N</i>-Carboxymethylcarbamoyl)-3,7-bis(dimethylamino)phenothiazine (CCAP)‒Ethanol (1/1), C~19~H~22~N~4~O~3~S.C~2~H~6~O","Acta Crystallographica Section C","1996","52","12","3140","3142","10.1107/S0108270196010244","","","1.5418","CuKα","","","0.065","","","0.087","","","","","2.76","2.76","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005797","9.027","0.005","10.945","0.005","10.913","0.005","112.79","0.005","99.24","0.005","109.72","0.005","881.5","0.8","150","0.2","150","","","","","","","","","4","P -1","-P 1","2","","","","- C19 H18 N2 O7 -","- C19 H18 N2 O7 -","- C38 H36 N4 O14 -","2","1","MU1270","Despinoy, X. L. M.; McNab, H.; Parsons, S.","An Unusual 3<i>H</i>-Pyrrole at 150K","Acta Crystallographica Section C","1996","52","12","3064","3067","10.1107/S0108270196010256","","","0.71073","MoKα","","0.1159","0.0698","","0.2021","0.1665","","","","1.024","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005798","6.246","0.003","7.187","0.004","31.334","0.002","90","","90","","90","","1406.6","1","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C14 H12 Cl N O2 -","- C14 H12 Cl N O2 -","- C56 H48 Cl4 N4 O8 -","4","1","MU1276","Kevran, S.; Elmali, A.; Elerman, Y.","5-Chloro-2-[(2-hydroxybenzylidene)aminomethyl]phenol","Acta Crystallographica Section C","1996","52","12","3256","3258","10.1107/S0108270196010268","","","0.71069","MoKα","","0.0418","0.0402","","0.0969","0.0958","","","","1.111","1.159","1.159","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005799","7.4614","0.0004","16.5571","0.0013","20.6129","0.0014","90","","90","","90","","2546.5","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","o-cyanophenol","o-Cyanophenol","","- C7 H5 N O -","- C7 H5 N O -","- C112 H80 N16 O16 -","16","2","MU1277","Beswick, C.; Kubicki, M.; Codding, P. W.","<i>o</i>-Cyanophenol","Acta Crystallographica Section C","1996","52","12","3171","3173","10.1107/S0108270196009419","","","1.54178","CuKα","","0.053","0.0401","","0.1033","0.0965","","","","1.059","1.154","1.154","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005800","15.789","0.013","8.139","0.01","10.719","0.007","90","","90","","90","","1377","2","193","1","193","1","","","","","","","","6","P n a 21","P 2c -2n","33","2-Anilidopyridinetungstenoxotrichloride","trichloro-2-(phenylamido)pyridineoxotungsten","","- C11 H9 Cl3 N2 O W -","- C11 H9 Cl3 N2 O W -","- C44 H36 Cl12 N8 O4 W4 -","4","1","MU1278","Polamo, M.","<i>mer</i>-Trichloro[2-(phenylamino)pyridinato]oxotungsten(VI)","Acta Crystallographica Section C","1996","52","12","2980","2982","10.1107/S010827019601027X","","","0.71073","MoKα","","0.0351","0.0295","","0.0753","0.0735","","","","1.04","1.064","1.064","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005801","22.37","0.003","5.692","0.001","9.39","0.002","90","","90","","90","","1195.6","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl (1R,2R)-1-cyano-2-[(S)-2,2-dimethyl-1,3-dioxolan-4-yl]cyclopropane- 1-carboxylate","","- C11 H15 N O4 -","- C11 H15 N O4 -","- C44 H60 N4 O16 -","4","1","MU1282","Cativiela, C.; Díaz-de-Villegas, M. D.; Gálvez, J. A.; Jiménez, A. I.; López, M. P.","Methyl (1<i>R</i>,2<i>R</i>)- and (1<i>S</i>,2<i>S</i>)-1-Cyano-2-[(<i>S</i>)-2,2-dimethyl-1,3-dioxolan-4-yl]cyclopropane-1-carboxylate","Acta Crystallographica Section C","1996","52","12","3210","3213","10.1107/S0108270196010281","","","0.71073","MoKα","","0.0496","0.0424","","0.1156","0.1083","","","","1.036","1.046","1.046","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005802","5.911","0.001","9.445","0.002","22.051","0.004","90","","90","","90","","1231.1","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl (1S,2S)-1-cyano-2-[(S)-2,2-dimethyl-1,3-dioxolan-4-yl]cyclopropane- 1-carboxylate","","- C11 H15 N O4 -","- C11 H15 N O4 -","- C44 H60 N4 O16 -","4","1","MU1282","Cativiela, C.; Díaz-de-Villegas, M. D.; Gálvez, J. A.; Jiménez, A. I.; López, M. P.","Methyl (1<i>R</i>,2<i>R</i>)- and (1<i>S</i>,2<i>S</i>)-1-Cyano-2-[(<i>S</i>)-2,2-dimethyl-1,3-dioxolan-4-yl]cyclopropane-1-carboxylate","Acta Crystallographica Section C","1996","52","12","3210","3213","10.1107/S0108270196010281","","","0.71073","MoKα","","0.104","0.0675","","0.1897","0.1594","","","","1.021","1.078","1.078","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005803","11.936","0.002","20.053","0.003","12.306","0.003","90","","93.48","0.01","90","","2940","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis(μ-thiobenzoato-O,S)bis(triphenylphosphineoxide-O)dimolybdenum(II)","","- C64 H50 Mo2 O6 P2 S4 -","- C64 H50 Mo2 O6 P2 S4 -","- C128 H100 Mo4 O12 P4 S8 -","2","0.5","MU1284","Cindrić, M.; Vrdoljak, V.; Matković-Čalogović, D.; Kamenar, B.","A 1:2 Adduct of Tetrakis(μ-thiobenzoato-<i>O</i>,<i>S</i>)dimolybdenum(II)(<i>Mo{—</i>Mo}) with Triphenylphosphine Oxide, [Mo~2~(C~7~H~5~OS)~4~].2[(C~6~H~5~)~3~OP]","Acta Crystallographica Section C","1996","52","12","3016","3018","10.1107/S0108270196010293","","","0.71073","MoKα","","0.1239","0.0494","","0.1144","0.0933","","","","0.974","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005804","9.821","0.004","11.855","0.005","32.703","0.005","90","","93.97","0.03","90","","3798","2","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","chloro(η^6^-p-cymene)[1-(dimethylphosphino-κP)-2-(methylthio-κS)ethane]- ruthenium(II) tetraphenylborate hemidichloromethane solvate","","- C39.5 H48 B Cl2 P Ru S -","- C39.5 H48 B Cl2 P Ru S -","- C158 H192 B4 Cl8 P4 Ru4 S4 -","4","1","MU1286","Suzuki, T.; Taguchi, N.; Kashiwabara, K.","Ruthenium(II) Complex Containing a New Hybrid Bidentate Phosphine‒Thioether Ligand: [(<i>p</i>-Cymene)RuCl(Me~2~PCH~2~CH~2~SMe)][BPh~4~].0.5CH~2~Cl~2~","Acta Crystallographica Section C","1996","52","12","2982","2984","10.1107/S010827019601030X","","","0.71073","MoKα","","","0.056","","","0.056","","","","","1.62","1.62","","","","","has coordinates,has disorder","202198","2020-10-21","18:00:00",""
"2005805","9.58","0.015","9.652","0.012","14.625","0.019","94.18","0.13","90.27","0.15","118.44","0.09","1185","3","193","1","193","1","","","","","","","","5","P -1","-P 1","2","2-(Phenylamino)pyridinium tetrachloro-2-(phenylamido)pyridinetitanate(IV)","2-(Phenylamino)pyridinium tetrachloro(2-phenylaminopyridinato)titanate(IV)","","- C22 H20 Cl4 N4 Ti -","- C22 H20 Cl4 N4 Ti -","- C44 H40 Cl8 N8 Ti2 -","2","1","MU1287","Polamo, M.; Leskelä, M.","Tetrachloro[2-(phenylamino)pyridinato]titanate(IV) with a 2-(Phenylamino)pyridinium Counterion","Acta Crystallographica Section C","1996","52","12","2975","2977","10.1107/S0108270196010347","","","0.71073","MoKα","","0.1002","0.0667","","0.1359","0.1248","","","","1.053","1.177","1.177","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005806","5.113","0.002","8.279","0.002","14.86","0.005","93.01","0.02","96.27","0.03","99.87","0.03","614.4","0.4","292","","292","","","","","","","","","4","P 1","P 1","1","","L-Argininium squarate","","- C10 H16 N4 O6 -","- C10 H16 N4 O6 -","- C20 H32 N8 O12 -","2","2","NA1228","Angelova, O.; Velikova, V.; Kolev, T.; Radomirska, V.","Crystalline Complexes Involving Amino Acids. I. <small>L</small>-Argininium Hydrogen Squarate","Acta Crystallographica Section C","1996","52","12","3252","3256","10.1107/S0108270196010219","","","0.71073","MoKα","","0.055","0.039","","0.052","0.052","","","","1.011","1.026","1.026","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2005807","9.42","0.001","20.13","0.003","18.887","0.003","90","","95.1","0.01","90","","3567.3","0.9","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(5'-oxo-3'-phenylpyrazonyl)-3-phenylpyrazol-5-ones","","- C46 H38 N4 O2 -","- C46 H38 N4 O2 -","- C184 H152 N16 O8 -","4","1","NA1248","Bruno, G.; Grassi, G.; Nicoló, F.; Risitano, F.; Scopelliti, R.","4-[5'-Oxo-1',3'-diphenyl-4'-(<i>p</i>-tolylmethyl)]-1,3-diphenyl-4-(<i>p</i>-tolylmethyl)pyrazol-5-one: Product of a Reductive Dimerization Reaction","Acta Crystallographica Section C","1996","52","12","3129","3131","10.1107/S010827019600916X","","","0.71073","MoKα","","","0.0618","","","0.0716","","","","","1.84","1.84","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005808","6.68","0.001","13.996","0.002","10.816","0.001","90","","104.22","0.01","90","","980.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","diμ-chloro bis-diethylene triamine dicopper(II) dinitrate","","- C4 H13 Cl Cu N4 O3 -","- C4 H13 Cl Cu N4 O3 -","- C16 H52 Cl4 Cu4 N16 O12 -","4","1","NA1250","Urtiaga, M. K.; Arriortua, M. I.; Cortés, R.; Rojo, T.","Di-μ-chloro-bis[(diethylenetriamine)copper(II)] Dinitrate","Acta Crystallographica Section C","1996","52","12","3007","3009","10.1107/S010827019600978X","","","0.7107","MoKα","","0.0368","0.0222","","0.0737","0.0621","","","","0.651","0.602","0.602","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005809","3.846","0.001","25.673","0.002","13.992","0.001","90","","96.36","0.01","90","","1373","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","5-methoxy-1,4-benzoquinone-4-oxime","","- C7 H7 N O3 -","- C7 H7 N O3 -","- C56 H56 N8 O24 -","8","2","NA1253","Sardone, N.; Carugo, O.; Charalambous, J.; Raghvani, D. V.","3-Methoxy-1,4-benzoquinone 4-Oxime","Acta Crystallographica Section C","1996","52","12","3202","3204","10.1107/S0108270196009171","","","1.54184","CuKα","","0.05","0.038","","","0.034","","","","","0.627","0.627","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005810","23.953","0.003","22.097","0.003","11.477","0.004","90","","90","","90","","6075","2","150","","150","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(3R^*^,4S^*^)-3-Hexyl-3-(trimethylsilyl)-4-[(S^*^)-2'-(tert-butyl- dimethylsiloxy)-2'-cyclohexylethyl]-2-oxetanone","","- C26 H52 O3 Si2 -","- C26 H52 O3 Si2 -","- C208 H416 O24 Si16 -","8","1","NA1256","Kocienski, P. J.; Pelotier, B.; Webster, M.","(3<i>R</i>*,4<i>S</i>*)-4-[(<i>S</i>*)-2-Cyclohexyl-2-(<i>tert</i>-butyldimethylsiloxy)ethyl]-3-hexyl-3-(trimethylsilyl)oxetan-2-one","Acta Crystallographica Section C","1996","52","12","3150","3152","10.1107/S0108270196009158","","","0.71069","MoKα","","","0.0591","","","0.051","","","","","2.301","2.301","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005811","9.282","0.004","17.837","0.005","8.488","0.004","90","","90","","90","","1405.3","1","295","","295","","","","","","","","","6","P c c n","-P 2ab 2ac","56","Cadmium dimethyl dithiophosphate","Bis(O,O'-dimethyl dithiophosphato)Cadmium(II)","","- C4 H12 Cd O4 P2 S4 -","- C4 H12 Cd O4 P2 S4 -","- C16 H48 Cd4 O16 P8 S16 -","4","0.5","OA1003","Ito, T.; Otake, M.","Linear-Chain Structure of Bis(<i>O</i>,<i>O</i>'-dimethyldithiophosphato)cadmium(II)","Acta Crystallographica Section C","1996","52","12","3024","3025","10.1107/S0108270196010463","","","0.71069","MoKα","","","0.0365","","","0.0545","","","","","2.375","2.375","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005812","7.755","","7.755","","35.137","0.002","90","","90","","120","","1830.03","0.1","296","","","","","","","","","","","3","P 65","P 65","170","","","","- C12 H20 O4 -","- C12 H20 O4 -","- C72 H120 O24 -","6","1","OA1006","Kiyotani, T.; Masuda, K.; Ageta, H.; Chakravarty, A. K.; Das, B.","Glycoric Acid, a New Degraded Carotenoid from <i>Glycosmis arborea</i>","Acta Crystallographica Section C","1996","52","12","3216","3217","10.1107/S0108270196010475","","","0.71073","MoKα","","","0.028","","","0.036","","","","","1.31","1.31","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005813","8.542","0.006","13.823","0.008","22.941","0.012","90","","90","","90","","2709","3","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3α, 4α, 8α, 9α-diépoxy-cis-himachalane","","- C15 H24 O2 -","- C15 H24 O2 -","- C120 H192 O16 -","8","2","PA1242","Chiaroni, A.; Riche, C.; Lassaba, E.; Benharref, A.","2α,3α:7α,8α-Diépoxy-<i>cis</i>-himachalane","Acta Crystallographica Section C","1996","52","12","3240","3243","10.1107/S0108270196008797","","","0.7107","MoKα","","","0.0538","","","0.0757","","","","","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005814","21.562","0.003","14.055","0.002","8.072","0.001","90","","90","","90","","2446.3","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","quitenidinium ethyl ester ethyl sulfate","","","- C23 H32 N2 O8 S -","- C23 H32 N2 O8 S -","- C92 H128 N8 O32 S4 -","4","1","SK1021","Lewinski, K.; Nitek, W.; Oleksyn, B. J.; Kostrzewa, A.; Lipinska, T.; Suszko-Purzycka, A.","Quitenidinium Ethyl Ester Ethyl Sulfate","Acta Crystallographica Section C","1996","52","12","3121","3124","10.1107/S0108270196009572","","","1.54178","CuKα","","0.0356","0.0356","","0.0984","0.0984","","","","1.06","1.06","1.06","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005815","5.588","0.001","11.645","0.001","18.561","0.002","90","","97.56","0.01","90","","1197.3","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","none","2',3'-dideoxy-3'-nitro-thymidine","","- C10 H13 N3 O6 -","- C10 H13 N3 O6 -","- C40 H52 N12 O24 -","4","2","SK1024","Neidle, S.; Chattopadhyaya, J. P.; Hossain, N.; Papchikhin, A.","2',3'-Dideoxy-3'-nitrothymidine and 2'-Propoxy-3'-nitrothymidine","Acta Crystallographica Section C","1996","52","12","3173","3177","10.1107/S0108270196009481","","","1.54178","CuKα","","0.0608","0.0551","","0.1722","0.1639","","","","0.894","0.899","0.899","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005816","15.746","0.002","9.373","0.001","11.304","0.002","90","","100.19","0.01","90","","1642","0.4","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","none","2'-oxapropyl-3'-nitro-thymidine","","- C13 H19 N3 O7 -","- C13 H19 N3 O7 -","- C52 H76 N12 O28 -","4","1","SK1024","Neidle, S.; Chattopadhyaya, J. P.; Hossain, N.; Papchikhin, A.","2',3'-Dideoxy-3'-nitrothymidine and 2'-Propoxy-3'-nitrothymidine","Acta Crystallographica Section C","1996","52","12","3173","3177","10.1107/S0108270196009481","","","1.54178","CuKα","","0.0657","0.064","","0.1748","0.1725","","","","1.192","1.194","1.194","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005817","12.155","0.002","10.867","0.001","6.415","0.001","77.5","0.01","89.76","0.02","76.51","0.02","803.5","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2,2':6',2""-Terpyridinium Trifluoromethanesulfonate","","- C16 H12 F3 N3 O3 S -","- C16 H12 F3 N3 O3 S -","- C32 H24 F6 N6 O6 S2 -","2","1","SK1032","Hergold-Brundic, A.; Popovic, Z.; Matkovic-Calogovic, D.","2,2':6',2''-Terpyridinium Trifluoromethanesulfonate, [terpyH](CF~3~SO~3~)","Acta Crystallographica Section C","1996","52","12","3154","3157","10.1107/S0108270196009584","","","0.71073","MoKα","","","0.0448","","","0.0431","","","","","0.646","0.646","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005818","20.568","0.004","9.057","0.002","7.295","0.002","90","","90","","90","","1358.9","0.5","300","2","300","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","Sodium Inosinate(1-) 2.5 Water, Na(inosineH~-1~) . 2.5 H~2~O","","- C10 H16 N4 Na O7.5 -","- C10 H16 N4 Na O7.5 -","- C40 H64 N16 Na4 O30 -","4","1","SK1041","Klüfers, P.; Mayer, P.","The Sodium Salt of N1-Deprotonated Inosine, Na^+^.C~10~H~11~N~4~O~5~^{-^}.2.5H~2~O","Acta Crystallographica Section C","1996","52","12","2970","2972","10.1107/S0108270196009043","","","0.71069","MoKa","","0.0248","0.0233","","0.0614","0.0605","","","","1.058","1.072","1.072","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005819","7.732","0.004","8.879","0.006","9.772","0.008","66.92","0.06","85.13","0.06","64.39","0.04","553.6","0.7","293","2","293","2","","","","","","","","5","P 1","P 1","1","","Lithium Bis(1,6-anhydro-β-D-glucosidato(2-)-O^2^,O^4^)cuprate(II) Octahydrate","","- C12 H32 Cu Li2 O18 -","- C12 H32 Cu Li2 O18 -","- C12 H32 Cu Li2 O18 -","1","1","SK1042","Gack, C.; Klüfers, P.","A Homoleptic Cuprate(II) Complex with Deprotonated 1,6-Anhydro-β-<small>D</small>-glucose (Levoglucosan) Ligands","Acta Crystallographica Section C","1996","52","12","2972","2975","10.1107/S010827019600947X","","","0.71073","MoKα","","0.0362","0.0342","","0.0899","0.0871","","","","1.067","1.054","1.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005820","12.383","0.003","12.383","0.003","7.188","0.002","90","","90","","90","","1102.2","0.5","293","2","293","2","","","","","","","","5","I -4","I -4","82","Tetraphenylphosphonium perchlorate","Tetraphenylphosphonium perchlorate","","- C24 H20 Cl O4 P -","- C24 H20 Cl O4 P -","- C48 H40 Cl2 O8 P2 -","2","0.25","SK1044","Vittal, J. J.; Dean, P. A. W.","Tetraphenylphosphonium Perchlorate","Acta Crystallographica Section C","1996","52","12","3185","3188","10.1107/S0108270196010980","","","0.71073","MoKα","","0.1127","0.0491","","0.1236","0.0944","","","","1.046","1.087","1.087","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005821","12.815","0.001","22.5637","0.0008","13.224","0.001","90","","101.306","0.004","90","","3749.6","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(dicyclohexylammonium) aquadimethyldioxalatostannate.ethanol","","- C32 H62 N2 O10 Sn -","- C32 H62 N2 O10 Sn -","- C128 H248 N8 O40 Sn4 -","4","1","SK1050","Ng, S. W.","Bis(dicyclohexylammonium) Aquadimethyldi(oxalato-<i>O</i>,<i>O</i>')stannate Ethanol Solvate","Acta Crystallographica Section C","1996","52","12","2990","2992","10.1107/S0108270196011286","","","0.71073","MoKα","","0.0465","0.0345","","0.0883","0.0836","","","","1.027","1.096","1.096","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005822","16.164","0.008","7.194","0.005","11.923","0.005","90","","90","","90","","1386.5","1.3","293","2","290","2","","","","","","","","5","P n a 21","P 2c -2n","33","","[(Trimethylstannyl)cyclopentadienyl]titaniumtrichloride","","- C8 H13 Cl3 Sn Ti -","- C8 H13 Cl3 Sn Ti -","- C32 H52 Cl12 Sn4 Ti4 -","4","1","SK1054","Churakov, A. V.; Kuz'mina, L. G.","Trichloro[η^5^-(trimethylstannyl)cyclopentadienyl]titanium","Acta Crystallographica Section C","1996","52","12","3037","3038","10.1107/S0108270196011365","","","0.71069","MoKα","","0.0666","0.0351","","0.0913","0.0824","","","","1.043","1.168","1.168","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2005823","5.1536","0.0002","12.4441","0.0003","41.2592","0.0011","90","","90","","90","","2646.03","0.14","133","2","133","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H30 Cl N3 O5 -","- C28 H30 Cl N3 O5 -","- C112 H120 Cl4 N12 O20 -","4","1","SX1013","Janetka, J. W.; Satyshur, K. A.; Rich, D. H.","A Cyclic Side-Chain-Linked Biphenyl Ether Tripeptide: H~3~N^+^-<i>cyclo</i>-[Phe^(4{-^<i>O</i>)}-Phe-Phe^(3{-^<i>O</i>)}]-OMe.Cl^{-^}","Acta Crystallographica Section C","1996","52","12","3112","3114","10.1107/S0108270196009262","","","0.71073","MoKα","","0.0631","0.0497","","0.1198","0.1033","","","","1.173","1.129","1.129","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005824","5.188","0.001","38.076","0.007","9.049","0.001","90","","96.32","0.01","90","","1776.7","0.5","293","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","[(S)-(4,5-dihydro-2-phenyl-4-oxazolyl)methyl]-(S)-sulfinyloctane","","- C18 H27 N O2 S -","- C18 H27 N O2 S -","- C72 H108 N4 O8 S4 -","4","2","SX1014","Hempel, A.; Camerman, N.; Grierson, J.; Mastropaolo, D.; Camerman, A.","Stereochemistry of Chiral Sulfoxides used for the Synthesis of Antitumor Antibiotic Analogues of Sparsomycin","Acta Crystallographica Section C","1996","52","12","3207","3210","10.1107/S0108270196009948","","","0.71073","MoKα","","0.1846","0.0781","","0.2351","0.1656","","","","0.947","1.007","1.007","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005825","4.828","0.001","34.865","0.006","5.317","0.001","90","","98.93","0.01","90","","884.2","0.3","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","[(S)-(4,5-dihydro-2-phenyl-4-oxazolyl)methyl]-(R)-sulfinyloctane","","- C18 H27 N O2 S -","- C18 H27 N O2 S -","- C36 H54 N2 O4 S2 -","2","1","SX1014","Hempel, A.; Camerman, N.; Grierson, J.; Mastropaolo, D.; Camerman, A.","Stereochemistry of Chiral Sulfoxides used for the Synthesis of Antitumor Antibiotic Analogues of Sparsomycin","Acta Crystallographica Section C","1996","52","12","3207","3210","10.1107/S0108270196009948","","","0.71073","MoKα","","0.0832","0.0445","","0.1326","0.1083","","","","0.668","0.698","0.698","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005826","32.492","0.008","7.756","0.003","5.817","0.002","90","","90","","90","","1465.9","0.8","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-[(S)-(4,5-dihydro-2-phenyl-4-oxazolyl)methyl]-(S)-sulfinylphenol","","- C16 H15 N O3 S -","- C16 H15 N O3 S -","- C64 H60 N4 O12 S4 -","4","1","SX1014","Hempel, A.; Camerman, N.; Grierson, J.; Mastropaolo, D.; Camerman, A.","Stereochemistry of Chiral Sulfoxides used for the Synthesis of Antitumor Antibiotic Analogues of Sparsomycin","Acta Crystallographica Section C","1996","52","12","3207","3210","10.1107/S0108270196009948","","","1.54178","CuKα","","0.0737","0.0535","","0.1739","0.1623","","","","1.002","1.05","1.05","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005827","27.031","0.001","13.838","0.001","15.286","0.001","90","","123.27","0.01","90","","4780.6","0.7","295","","295","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","triaquahexakis(μ~2~-acetato)μ~3~-oxocobalt(II)diiron(III) diaquo solvate","","- C12 H28 Co Fe2 O18 -","- C12 Co0.999 Fe2.001 O18 -","- C96 Co7.992 Fe16.008 O144 -","8","1","TA1083","Sato, T.; Ambe, F.","An Oxo-Centered Trinuclear Cobalt(II)–Diiron(III) Acetate–Aqua Complex","Acta Crystallographica Section C","1996","52","12","3005","3007","10.1107/S0108270196008682","","","0.71073","MoKα","","","0.061","","","0.085","","","","","2.2","2.2","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2005828","6.853","0.002","17.675","0.002","10.203","0.002","90","","92.37","0.02","90","","1234.8","0.5","213","1","213","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H11 N O2 -","- C16 H11 N O2 -","- C64 H44 N4 O8 -","4","1","TA1091","Hockless, D. C. R.; Whittall, I. R.; Humphrey, M. G.","(<i>E</i>)- and (<i>Z</i>)-4-Ethynyl-4'-nitrostilbene","Acta Crystallographica Section C","1996","52","12","3222","3224","10.1107/S0108270196009845","","","1.5418","CuKα","","","0.0358","","","0.0386","","","","","2.857","2.857","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005829","10.027","0.001","11.037","0.002","12.472","0.001","90","","112.015","0.009","90","","1279.6","0.3","296","1","296","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C16 H11 N O2 -","- C16 H11 N O2 -","- C64 H44 N4 O8 -","4","1","TA1091","Hockless, D. C. R.; Whittall, I. R.; Humphrey, M. G.","(<i>E</i>)- and (<i>Z</i>)-4-Ethynyl-4'-nitrostilbene","Acta Crystallographica Section C","1996","52","12","3222","3224","10.1107/S0108270196009845","","","1.5418","CuKα","","","0.0377","","","0.04","","","","","2.876","2.876","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005830","5.309","0.005","10.548","0.004","12.514","0.004","104.55","0.003","95.6","0.005","103.43","0.005","650.6","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-(tert-Butoxycarbonyl)-2-phenylglycine","","- C13 H17 N O4 -","- C13 H17 N O4 -","- C26 H34 N2 O8 -","2","1","TA1093","González-Cameno, A. M.; Badía, D.; Domínguez, E.; Arriortua, M. I.; Urtiaga, M. K.; Solans, X.","<i>N</i>-(<i>tert</i>-Butoxycarbonyl)-2-phenylglycine","Acta Crystallographica Section C","1996","52","12","3169","3171","10.1107/S0108270196009857","","","0.71069","MoKα","","0.1159","0.0676","","0.3275","0.2115","","","","1.054","1.051","1.051","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005831","13.793","0.007","8.247","0.004","13.699","0.007","90","","104.52","0.01","90","","1508.5","1.3","293","","293","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","3-(4'-Methoxyphenyl)-2,2,4,4-tetramethylpentane","","- C16 H26 O -","- C16 H26 O -","- C64 H104 O4 -","4","1","TA1097","Collins, D. J.; Fallon, G. D.; Jacobs, H. A.","Conformation of Crystalline 3-(4-Methoxyphenyl)-2,2,4,4-tetramethylpentane","Acta Crystallographica Section C","1996","52","12","3232","3234","10.1107/S0108270196011031","","","1.5418","CuKα","","","0.066","","","0.069","","","","","1.72","1.72","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005832","12.603","0.003","9.52","0.001","14.762","0.005","90","0.02","107.81","0.02","90","0.01","1686.3","0.7","130","0.1","130","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(1) trans-4-tert-butylcyclohexyl p-nitrobenzenesulfonate","","- C16 H23 N O5 S -","- C16 H23 N O5 S -","- C64 H92 N4 O20 S4 -","4","1","TA1099","White, J. M.; Giordano, J.; Green, A. J.","<i>cis</i>- and <i>trans</i>-4-<i>tert</i>-Butylcyclohexyl <i>p</i>-Nitrobenzenesulfonate at 130K","Acta Crystallographica Section C","1996","52","12","3204","3207","10.1107/S0108270196009912","","","0.71069","MoKα","","0.0449","0.0379","","0.1064","0.0998","","","","1.041","1.055","1.055","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005833","6.612","0.002","9.333","0.002","13.819","0.003","90","0.02","96.72","0.03","90","0.02","846.9","0.4","130","0.1","130","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","(2) cis-4-tert-butylcyclohexyl p-nitrobenzenesulfonate","","- C16 H23 N O5 S -","- C16 H23 N O5 S -","- C32 H46 N2 O10 S2 -","2","1","TA1099","White, J. M.; Giordano, J.; Green, A. J.","<i>cis</i>- and <i>trans</i>-4-<i>tert</i>-Butylcyclohexyl <i>p</i>-Nitrobenzenesulfonate at 130K","Acta Crystallographica Section C","1996","52","12","3204","3207","10.1107/S0108270196009912","","","1.5418","CuKα(nickelfiltered)","","0.0479","0.0408","","0.1755","0.1175","","","","0.837","0.833","0.833","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005834","13.791","0.002","13.791","0.002","20.313","0.004","90","","90","","90","","3863.4","1.1","294","","294","","","","","","","","","5","I 41/a","I 4bw -1bw","","","","","- C12 H21 Cd N6 O6.5 -","- C12 H20 Cd N6 O6.5 -","- C96 H160 Cd8 N48 O52 -","8","","TA1102","Chotalia, R.; Hambley, T. W.; Ridley, D. D.; Turner, P.","A Cadmium(II) Complex of Creatinine, [Cd(C~2~H~3~O~2~)~2~(C~4~H~7~N~3~O)~2~].0.5H~2~O","Acta Crystallographica Section C","1996","52","12","3043","3045","10.1107/S0108270196009833","","","0.7107","MoKα","","0.0305","0.0305","","0.0302","0.0302","","","","2.798","2.798","2.798","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005835","7.7523","0.0007","9.3535","0.0007","6.8139","0.0006","95.432","0.008","111.021","0.007","99.112","0.008","449.19","0.07","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Diethyl 3,4-di(ethoxycarbonyl)-(2Z,4Z)-hexa-2,4-diene-1,6-dioate","","- C16 H22 O8 -","- C16 H22 O8 -","- C16 H22 O8 -","1","0.5","TA1105","Tani, K.; Yamagata, T.; Kataoka, Y.","Tetraethyl (1<i>Z</i>,3<i>Z</i>)-Buta-1,3-diene-1,2,3,4-tetracarboxylate","Acta Crystallographica Section C","1996","52","12","3138","3140","10.1107/S0108270196009195","","","1.54178","CuKα","","","0.0668","","","0.0558","","","","","1.99","1.99","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005836","7.97","0.002","14.544","0.003","16.502","0.004","90","","100.58","0.05","90","","1880.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,2-di(o-methyl-phenyl)-3,3-(oxydiethyl)-guanidine hydrochloride monohydrate","","- C19 H26 Cl N3 O2 -","- C19 H26 Cl N3 O2 -","- C76 H104 Cl4 N12 O8 -","4","1","TA1111","Sudha, L.; Subramanian, K.; Senthil Selvan, J.; Steiner, Th.; Koellner, G.; Ramdas, K.; Srinivasan, N.","3,3-(Oxydiethyl)-1,2-di(<i>o</i>-methylphenyl)guanidinium Chloride Monohydrate","Acta Crystallographica Section C","1996","52","12","3238","3240","10.1107/S0108270196011274","","","1.54176","CuKα","","0.041","0.0389","","0.1118","0.111","","","","1.036","1.058","1.058","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005837","12.661","0.003","7.216","0.001","14.796","0.002","90","","105.44","0.02","90","","1303","0.4","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H9 Cl2 N O6 -","- C11 H9 Cl2 N O6 -","- C44 H36 Cl8 N4 O24 -","4","1","TA1112","Huang, S. D.; Cox, O.; Cordero, M.; Piñeiro, S.","α,α-Diacetoxy-2,4-dichloro-5-nitrobenzaldehyde","Acta Crystallographica Section C","1996","52","12","3116","3118","10.1107/S010827019601102X","","","0.7107","MoKα","","","0.0571","","","0.0665","","","","","2.63","2.63","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005838","14.852","0.001","9.91","0.001","13.036","0.002","90","","113.749","0.008","90","","1756.2","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C7 H9 N4 O2.5 -","- C7 H9 N4 O2.5 -","- C56 H72 N32 O20 -","8","1","AB1405","Gallardo, H.; Begnini, I. M.; Vencato, I.","5-(4-Hydroxyphenyl)tetrazole‒Water (2/3)","Acta Crystallographica Section C","1997","53","1","143","144","10.1107/S0108270196012474","","","0.71073","MoKα","","0.0453","0.0335","","0.1055","0.0916","","","","1.067","1.031","1.031","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005839","5.644","0.002","13.624","0.002","22.617","0.001","90","","95.31","0.01","90","","1731.6","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Oxo-6-phenyl-6-phospha-3,9-dithiabicyclo[9,4,0]pentadeca-1(11),12,14-triene","","- C18 H21 O P S2 -","- C18 H21 O P S2 -","- C72 H84 O4 P4 S8 -","4","1","AB1413","Kivekäs, R.; Muñoz, J. A.; Escriche, L.; Casabó, J.; Sillanpää, R.","6-Oxo-6-phenyl-6-phospha-3,9-dithiabicyclo[9.4.0]pentadeca-1(11),12,14-triene","Acta Crystallographica Section C","1997","53","1","126","128","10.1107/S0108270196012140","","","0.71069","MoKα","","0.0992","0.0425","","0.162","0.0872","","","","1.041","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005840","5.223","0.0007","38.371","0.005","9.417","0.001","90","","96.98","0.01","90","","1873.3","0.4","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","40<[OS(2,5)1,3,4-thiadiazolo,S]~4~-coronand-16>","10,11,21,22,32,33,43,44-octaaza-5,16,27,38-tetraoxa-2,8,13,19,24,30,35,41,45,46,47,48-dodecathiapentacyclo[40.2.1.1^9,12^.1^20,23^.1^31,34^]octatetracontane","","- C24 H32 N8 O4 S12 -","- C24 H32 N8 O4 S12 -","- C48 H64 N16 O8 S24 -","2","0.5","BK1223","Rugutt, J. K.; Fronczek, F. R.; Watkins, S. F.; Pappalardo, S.","A Tetrameric Macrocycle with 2,5-Dithio-1,3,4-thiadiazole Subunits","Acta Crystallographica Section C","1997","53","1","81","84","10.1107/S010827019601236X","","","1.54184","CuKα","","","0.047","","","0.062","","","","","1.731","1.731","","","","","has coordinates","211401","2020-10-21","18:00:00",""
"2005841","18.8917","0.0008","4.6858","0.0003","12.7916","0.0008","90","","127.95","0.01","90","","892.91","0.15","298","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C8 H10 Br2 -","- C8 H10 Br2 -","- C32 H40 Br8 -","4","0.5","BK1224","Dávila, A.; McLaughlin, M. L.; Fronczek, F. R.; Watkins, S. F.","1,5-Dibromocycloocta-1,5-diene","Acta Crystallographica Section C","1997","53","1","84","86","10.1107/S0108270196012322","","","0.71073","MoKα","","","0.069","","","0.038","","","","","1.128","1.128","","","","","has coordinates","198476","2020-10-21","18:00:00",""
"2005842","9.3811","0.0011","13.2775","0.0012","10.487","0.001","90","","98.177","0.009","90","","1293","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tricarbonyl(2-methoxycyclohexadienyl)-iron(II)-tatrafluoroborate","","- C10 H9 B F4 Fe O4 -","- C10 H9 B F4 Fe O4 -","- C40 H36 B4 F16 Fe4 O16 -","4","1","BK1242","DeBord, J. R. D.; George, T. A.; Ross, II, C. R.; Stezowski, J. J.","Tetrafluoroborate Salt of Tricarbonyl(2-methoxy-η^5^-cyclohexadienyl)iron(II)","Acta Crystallographica Section C","1997","53","1","45","47","10.1107/S0108270196011584","","","0.71073","MoKα","","0.1174","0.067","","0.15","0.1174","","","","1.08","1.144","1.144","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005843","3.897","0.003","9.355","0.002","28.98","0.003","90","","90.79","0.04","90","","1056.4","0.9","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","anthracene-9-carboxylic acid","anthracene-9-carboxylic acid","","- C15 H10 O2 -","- C15 H10 O2 -","- C60 H40 O8 -","4","1","BK1282","Fitzgerald, L. J.; Gerkin, R. E.","Anthracene-9-carboxylic Acid","Acta Crystallographica Section C","1997","53","1","71","73","10.1107/S0108270196011213","","","0.71073","MoKα","","","0.044","","","0.049","","","","","1.6","1.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005844","7.956","0.002","8.193","0.002","9.313","0.002","89.89","0.01","94.79","0.01","90.95","0.01","604.9","0.2","294","","294","","","","","","","","","3","P -1","-P 1","2","","","","- C14 H13 N3 -","- C14 H13 N3 -","- C28 H26 N6 -","2","1","BM1071","Mefetah, H.; Giorgi, M.; Brouant, P.","2-Anilino-4,6-dimethylpyridine-3-carbonitrile, an Intermediate in the Synthesis of 5-Aminobenzo[<i>b</i>][1,8]naphthyridines","Acta Crystallographica Section C","1997","53","1","101","102","10.1107/S0108270196005276","","","0.71073","MoKα","","0.239","0.047","","","0.054","","","","","1.613","1.613","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2005845","21.454","0.004","9.107","0.002","17.364","0.003","90","","93.57","0.03","90","","3386","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","tetramethylammonium sodium nitroprusside 2.5-hydrate","tetramethylammonium sodium nitrosylpentacyanoferrate (II) 2.5-hydrate","","- C9 H17 Fe N7 Na O3.5 -","- C9 H17 Fe N7 Na O3.5 -","- C72 H136 Fe8 N56 Na8 O28 -","8","1","BM1089","Longridge, J. J.; Rawson, J. M.; Davies, J. E.","A Mixed Cation Ternary Nitroprusside: [(CH~3~)~4~N][Na][Fe(CN)~5~(NO)].2.5H~2~O","Acta Crystallographica Section C","1997","53","1","15","17","10.1107/S0108270196011468","","","0.71073","MoKα","","0.066","0.0477","","0.1259","0.1155","","","","1.086","1.14","1.14","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2005846","16.088","0.002","16.088","0.002","5.197","0.001","90","","90","","120","","1164.9","0.3","120","1","120","1","","","","","","","","3","R -3 :H","-R 3","148","","hexakis[mercaptomethyl]benzene","","- C12 H18 S6 -","- C12 H18 S6 -","- C36 H54 S18 -","3","0.166667","BM1105","Mallinson, P. R.; MacNicol, D. D.; McCormack, K. L.; Yufit, D. S.; Gall, J. H.; Henderson, R. K.","Hexakis(mercaptomethyl)benzene: a Structure Possessing Well Ordered Homodromic [SH···S]~6~ Interactions","Acta Crystallographica Section C","1997","53","1","90","92","10.1107/S0108270196010499","","","0.71073","MoKα","","0.1663","0.0554","","0.123","0.104","","","","0.847","1.076","1.076","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005847","13.62","0.005","12.088","0.005","4.115","0.002","90","","90","","90","","677.5","0.5","150","2","150","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","Bis(2-nitrophenyl)trisulphide","","- C12 H8 N2 O4 S3 -","- C12 H8 N2 O4 S3 -","- C24 H16 N4 O8 S6 -","2","0.5","BM1114","Cox, P. J.; Wardell, J. L.","A Polymorph of Bis(2-nitrophenyl) Trisulfide","Acta Crystallographica Section C","1997","53","1","122","124","10.1107/S0108270196012838","","","0.71069","MoKα","","0.0496","0.0478","","0.1105","0.1098","","","","1.089","1.129","1.129","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005848","21.393","0.004","11.586","0.002","22.635","0.005","90","","90.09","0.03","90","","5610.3","1.9","150","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H72 Cr2 N4 Na2 O22 -","- C46 H72 Cr2 N4 Na2 O22 -","- C184 H288 Cr8 N16 Na8 O88 -","4","0.5","BR1160","Borrmann, H.; Pirani, A. M.; Schrobilgen, G. J.","[2,2,2-Crypt-Na]~2~[Cr~2~(CO)~10~]: a Chromium(‒1) Carbonyl Structure with a Very Weakly Coordinating Cation","Acta Crystallographica Section C","1997","53","1","19","22","10.1107/S0108270196011390","","","0.71073","MoKα","","0.0486","","","0.0977","0.0879","","","","1.048","1.085","1.085","","","","","has coordinates","198515","2020-10-21","18:00:00",""
"2005849","16.505","0.004","11.657","0.003","21.918","0.006","90","","99.79","0.02","90","","4155.6","1.9","178","2","178","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","{trans-(2,2,4,4-tetrafluoro-1,3-di-t-butyl-1,3-diphosphetane)}- pentacarbonyltungsten(0)","","- C15 H18 F4 O5 P2 W -","- C15 H18 F4 O5 P2 W -","- C120 H144 F32 O40 P16 W8 -","8","2","BS1001","Jones, P. G.; Thöne, C.","Metal Complexes of <i>trans</i>-2,2,4,4-Tetrafluoro-1,3-di-<i>tert</i>-butyl-1,3-diphosphetane","Acta Crystallographica Section C","1997","53","1","42","45","10.1107/S0108270196011870","","","0.71073","MoKα","","0.056","0.0306","","0.0786","0.0677","","","","0.993","1.037","1.037","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005850","19.99","0.006","7.096","0.003","8.606","0.003","90","","92.48","0.03","90","","1219.6","0.8","178","2","178","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","{trans-(2,2,4,4-tetrafluoro-1,3-di-t-butyl-1,3-diphosphetane)}- bis(chlorogold(I)) bis-dichloromethane solvate","","- C12 H22 Au2 Cl6 F4 P2 -","- C12 H22 Au2 Cl6 F4 P2 -","- C24 H44 Au4 Cl12 F8 P4 -","2","0.25","BS1001","Jones, P. G.; Thöne, C.","Metal Complexes of <i>trans</i>-2,2,4,4-Tetrafluoro-1,3-di-<i>tert</i>-butyl-1,3-diphosphetane","Acta Crystallographica Section C","1997","53","1","42","45","10.1107/S0108270196011870","","","0.71073","MoKα","","0.04","0.0268","","0.0618","0.0567","","","","1.045","1.057","1.057","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005851","11.368","0.002","13.49","0.003","13.573","0.003","61.62","0.03","84.55","0.03","87.83","0.03","1823","0.8","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","Bis (bistriphenylphosphineimine) hexamolybdate","","- C72 H60 Mo6 N2 O19 P4 -","- C72 H60 Mo6 N2 O19 P4 -","- C72 H60 Mo6 N2 O19 P4 -","1","0.5","BS1007","Hoppe, S.; Stark, J. L.; Whitmire, K. H.","Bis[bis(triphenylphosphine)iminium] Hexamolybdate","Acta Crystallographica Section C","1997","53","1","68","70","10.1107/S0108270196011791","","","0.71073","MoKα","","0.0713","0.0471","","0.1228","0.1086","","","","1.046","1.078","1.078","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005852","9.217","0.003","24.675","0.005","15.698","0.004","90","","102.89","0.02","90","","3480.2","1.6","300","","300","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","di-μ-thio-bis[chloro(oxo)bis(pyridine)molybdenum](Mo-Mo)","","- C30 H30 Cl2 Mo2 N6 O2 S2 -","- C30 Cl2 Mo2 N6 O2 S2 -","- C120 Cl8 Mo8 N24 O8 S8 -","4","1","CF1119","Mizutani, J.; Imoto, H.; Saito, T.","A Dinuclear Molybdenum Complex: [{MoClO(pyridine)~2~}~2~(μ-S)~2~].2C~5~H~5~N","Acta Crystallographica Section C","1997","53","1","47","50","10.1107/S0108270196010116","","","0.7107","MoKα","","","0.0633","","","0.0384","","","","","2.65","2.65","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005853","10.241","0.004","8.649","0.003","13.848","0.005","90","","109.93","0.03","90","","1153.2","0.7","293","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- As4 In2 Na2 O14 -","- As4 In2 Na2 O14 -","- As16 In8 Na8 O56 -","4","0.5","","","NaInAs~2~O~7~","Acta Crystallographica C","1997","53","","05","07","","","","","","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005854","8.789","0.004","17.3","0.007","8.595","0.003","90","","90","","90","","1306.9","0.9","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","aluminum potassium phospho-arsenate","","- Al2 As1.92 K3 O12 P1.08 -","- Al2 As1.925 K3 O12 P1.075 -","- Al8 As7.7 K12 O48 P4.3 -","4","1","DU1164","Boughzala, H.; Driss, A.; Jouini, T.","K~3~Al~2~As~1,92~P~1,08~O~12~","Acta Crystallographica Section C","1997","53","1","3","5","10.1107/S0108270196009894","","","0.71069","MoKα","","0.0923","0.0493","","0.0609","0.0537","","","","1.318","1.462","1.462","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005855","33.775","0.006","9.5143","0.0011","14.987","0.003","90","","105.433","0.014","90","","4642.4","1.4","294","","294","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Di(hydridotetracarbonylosmium)diphenylgermane","","- C20 H12 Ge O8 Os2 -","- C20 H12 Ge O8 Os2 -","- C160 H96 Ge8 O64 Os16 -","8","1","FG1150","Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K.","Bisphenylbis[tetracarbonyl(hydrido)osmio]germane, Ph~2~Ge[Os(CO)~4~H]~2~","Acta Crystallographica Section C","1997","53","1","22","24","10.1107/S0108270196012061","","","0.7093","MoKα","","","0.045","","","0.055","","","","","3","3","","","","","has coordinates","192299","2020-10-21","18:00:00",""
"2005856","9.5247","0.0008","16.7749","0.0018","12.9718","0.0019","90","","97.574","0.009","90","","2054.5","0.4","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(mu-chloro)tri(mu-hydrido)dodecacarbonyltetraosmium","","- C12 H3 Cl O12 Os4 -","- C12 H3 Cl O12 Os4 -","- C48 H12 Cl4 O48 Os16 -","4","1","FG1152","Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K.","Two Chloro-Bridged Osmium Clusters","Acta Crystallographica Section C","1997","53","1","24","27","10.1107/S0108270196012073","","","0.7093","MolybdenumKα","","0.038","0.038","","0.041","0.041","","","","","3.2","3.2","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005857","8.8621","0.0015","9.3825","0.0015","15.9148","0.0023","80.815","0.013","85.332","0.013","62.828","0.013","1162.1","0.3","294","","294","","","","","","","","","5","P -1","-P 1","2","","(mu-chloro)tri(mu-hydrido)tetradecacarbonylpentaosmium","","- C14 H3 Cl O14 Os5 -","- C14 H3 Cl O14 Os5 -","- C28 H6 Cl2 O28 Os10 -","2","1","FG1152","Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K.","Two Chloro-Bridged Osmium Clusters","Acta Crystallographica Section C","1997","53","1","24","27","10.1107/S0108270196012073","","","0.7093","MolybdenumKα","","0.054","0.054","","0.063","0.063","","","","","3.2","3.2","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005858","9.493","0.001","11.426","0.001","14.932","0.002","90","","102.77","0.01","90","","1579.6","0.3","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","5-Deoxy-1,2-O-isopropylidene-5-C-(5-carboethoxy-1,2,3-triazol-1-yl)- α-D-xylofuranose","","- C13 H19 N3 O6 -","- C13 H19 N3 O6 -","- C52 H76 N12 O24 -","4","2","FG1203","Horton, D.; Levine, B. R.; Norris, P.; Luck, R. L.; Silverton, J. V.","5-Deoxy-5-<i>C</i>-(5-ethoxycarbonyl-1,2,3-triazol-1-yl)-1,2-<i>O</i>-isopropylidene-α-<small>D</small>-xylofuranose","Acta Crystallographica Section C","1997","53","1","120","122","10.1107/S0108270196012097","","","1.54184","copperKα","","","0.052","","","0.06","","","","","2.19","2.19","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005859","4.898","0.001","12.925","0.002","13.875","0.001","90","","90","","90","","878.4","0.2","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-acetyl-L-glutamic acid","","","- C7 H11 N O5 -","- C7 H11 N O5 -","- C28 H44 N4 O20 -","4","1","FG1211","Dobson, A. J.; Gerkin, R. E.","<i>N</i>-Acetyl-<small>L</small>-glutamic Acid","Acta Crystallographica Section C","1997","53","1","73","76","10.1107/S0108270196011882","","","0.71073","MoKα","","","0.031","","","0.039","","","","","1.66","1.66","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005860","5.8824","0.0007","12.451","0.002","6.7557","0.0008","90","","110.186","0.006","90","","464.41","0.11","296","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","(-)-cis Pinononic acid","(-)-cis-3-acetyl-2,2-dimethylcyclobutanecarboxylic acid","","- C9 H14 O3 -","- C9 H14 O3 -","- C18 H28 O6 -","2","1","FG1213","Coté, M. L.; Thompson, H. W.; Lalancette, R. A.","({-})-<i>cis</i>-Pinononic Acid: Hydrogen-Bonding Pattern of a δ-Keto Acid","Acta Crystallographica Section C","1997","53","1","102","106","10.1107/S0108270196012103","","","0.71073","MoKα","","0.0766","0.0425","","0.1016","0.0922","","","","0.836","1.033","1.033","","","","","has coordinates,has disorder","200179","2020-10-21","18:00:00",""
"2005861","7.6532","0.0015","7.769","0.002","12.177","0.002","90","","98.228","0.014","90","","716.6","0.3","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2,4-trimethyl-1,2,4-triazolidine-3,5-dione","","- C5 H9 N3 O2 -","- C5 H9 N3 O2 -","- C20 H36 N12 O8 -","4","1","FG1225","Meyers, C. Y.; Lutfi, H. G.; Hou, Y.; Robinson, P. D.","Racemic 1,2,4-Trimethylurazole","Acta Crystallographica Section C","1997","53","1","98","100","10.1107/S0108270196011894","","","0.71069","MoKα","","","0.059","","","0.041","","","","","3.8","3.8","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005862","8.48","0.002","7.436","0.002","20.783","0.002","90","","93.5","0.02","90","","1308.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-methylperimidinium acetate monohydrate","","- C14 H16 N2 O3 -","- C14 H16 N2 O3 -","- C56 H64 N8 O12 -","4","1","FG1235","Patnaik, S.; Vishnumurthy, K.; Sridhar, M.; Chandrasekhar, S.; Usha, K.; Guru Row, T. N.","2-Methylperimidinium Acetate Monohydrate","Acta Crystallographica Section C","1997","53","1","130","132","10.1107/S0108270196012589","","","1.5418","CuK~α~","","0.0753","0.0531","","0.1656","0.1289","","","","1.093","1.026","1.026","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005863","5.592","0.0001","21.3403","0.0005","9.7192","0.0002","90","","96.197","0.001","90","","1153.06","0.04","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H23 N O12 -","- C20 H23 N O12 -","- C40 H46 N2 O24 -","2","1","FR1003","Abboud, K. A.; Toporek, S. S.; Horenstein, B. A.","<i>p</i>-Nitrophenyl 2,3,4,6-Tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section C","1997","53","1","118","120","10.1107/S0108270196012784","","","0.71073","MoKα","","0.0383","0.0344","","0.0909","0.0846","","","","1.124","1.108","1.108","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005864","7.046","0.004","6.287","0.004","24.486","0.005","90","","90.04","0.04","90","","1084.7","1","296","","296","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H28 Co N2 O12 S2 -","- C14 H28 Co N2 O12 S2 -","- C28 H56 Co2 N4 O24 S4 -","2","0.5","FR1012","Gunderman, B. J.; Dubey, S. N.; Squattrito, P. J.","Hexaaquacobalt(II) Bis(2-aminotoluene-4-sulfonate)","Acta Crystallographica Section C","1997","53","1","17","19","10.1107/S0108270196011419","","","0.7107","MoKα","","0.065","0.032","","0.049","0.03","","","","","1.76","1.76","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005865","11.503","0.002","18.218","0.005","9.305","0.002","90","","110.359","0.005","90","","1828.2","0.7","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","N,N'-Bis(1-pyrenylmethyl)-1,4,10,13-tetraoxa-7,16-diaza-cyclooctadecane","","- C46 H46 N2 O4 -","- C46 H46 N2 O4 -","- C92 H92 N4 O8 -","2","0.5","HA1169","Kubo, K.; Kato, N.; Sakurai, T.","<i>N</i>,<i>N</i>'-Bis(1-pyrenylmethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane","Acta Crystallographica Section C","1997","53","1","132","134","10.1107/S0108270196011808","","","1.54184","CuKα","","0.07","0.0474","","0.1506","0.1325","","","","1.03","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005866","18.0187","0.002","13.546","0.004","18.092","0.003","90","","115.389","0.012","90","","3989.4","1.5","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,5-Bis[4,4-dimethyl-1-(4-methylphenyl)-5-(1-piperidinio)-1-penten-3-ylidene]- carbonohydrazide Dichloride Methanol Solvate","","- C40 H62 Cl2 N6 O2 -","- C40 H62 Cl2 N6 O2 -","- C160 H248 Cl8 N24 O8 -","4","1","HA1170","Yang, J.; Kumar, P.; Dimmock, J. R.; Quail, J. W.","1,5-Bis[4,4-dimethyl-1-(4-methylphenyl)-5-(1-piperidinio)-1-penten-3-ylidene]carbonohydrazide Dichloride Methanol Solvate","Acta Crystallographica Section C","1997","53","1","140","143","10.1107/S0108270196012607","","","0.71073","MolybdenumKα","","0.123","0.056","","0.059","0.055","","","","","1.57","1.57","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005867","8.23","0.001","18.205","0.002","16.384","0.002","90","","99","0.01","90","","2424.5","0.5","288","2","288","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,2-dihydronaphtho[3,4-b]cyclopenteno[1,2-e]-4H-pyran-4-one","","- C16 H14 O2 -","- C16 H14 O2 -","- C128 H112 O16 -","8","2","HA1171","Cao, Z.; Cao, X.; Zhang, D.-C.; Xu, F.; Yu, K.","1,2-Dihydronaphtho[3,4-<i>b</i>]cyclopenteno[1,2-<i>e</i>]-4<i>H</i>-pyran-4-one","Acta Crystallographica Section C","1997","53","1","144","146","10.1107/S010827019601270X","","","0.71073","MoKα","","0.0771","0.0377","","0.1093","0.0818","","","","0.85","1.034","1.034","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005868","6.3561","0.0014","9.892","0.002","14.937","0.003","90","","95.04","0.02","90","","935.5","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","5S-3-Phenyl-5-(6'R,7R,14'R-1',8',13',16'-tetraoxadispiro[5.0.5.4] hexadecan-14'-yl)-4,5-dihydrooxisoxazole","","- C21 H27 N O5 -","- C21 H27 N O5 -","- C42 H54 N2 O10 -","2","1","HA1176","Blake, A. J.; Gould, R. O.; Paton, R. M.; Todd, C. J.","(5<i>S</i>)-3-Phenyl-5-[(6<i>R</i>,7<i>R</i>,14<i>R</i>)-1,8,13,16-tetraoxadispiro[5.0.5.4]hexadecan-14-yl]-4,5-dihydroisoxazole: the Major Adduct Resulting from Cycloaddition of Benzonitrile Oxide to (6<i>R</i>,7<i>R</i>,14<i>S</i>)-14-Vinyl-1,8,13,16-tetraoxadispiro[5.0.5.4]hexadecane","Acta Crystallographica Section C","1997","53","1","116","117","10.1107/S0108270196012243","","","0.71073","MoKα","","0.0305","0.0276","","0.0766","0.0714","","","","1.095","1.096","1.096","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005869","13.366","0.001","7.3869","0.0007","29.892","0.003","90","","90","","90","","2951.3","0.5","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","1-(4-bromophenyl)-2-fluoroethanone (2,4-dinitrophenyl)hydrazone","","- C14 H10 Br F N4 O4 -","- C14 H10 Br F N4 O4 -","- C112 H80 Br8 F8 N32 O32 -","8","1","HA1178","Borwick, S. J.; Howard, J. A. K.; Lehmann, C. W.; O'Hagan, D.","1-(4-Bromophenyl)-2-fluoroethanone (2,4-Dinitrophenyl)hydrazone Containing a Particularly Short Fluorine‒Hydrogen Bond","Acta Crystallographica Section C","1997","53","1","124","126","10.1107/S0108270196013133","","","0.71073","MoKα","","0.0496","0.0373","","0.0857","0.0771","","","","1.211","1.215","1.215","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005870","4.8781","0.001","10.475","0.001","30.2952","0.001","90","","90","","90","","1548","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(Pyrazole-κN^2^)[N-salicylidene-κO-(S)-alaninato-κN,κO]copper(II) Dihydrate","","- C13 H17 Cu N3 O5 -","- C13 H17 Cu N3 O5 -","- C52 H68 Cu4 N12 O20 -","4","1","JZ1116","Warda, S. A.; Friebel, C.; Sivý, J.; Plesch, G.; Bláhová, M.","(Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Dihydrate and (Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>R</i>,<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Pyrazole Solvate","Acta Crystallographica Section C","1997","53","1","50","54","10.1107/S0108270196010992","","","1.54178","CuKα","","0.0436","0.0423","","0.1166","0.1152","","","","1.037","1.041","1.041","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005871","10.3223","0.0005","8.3892","0.0003","19.9025","0.0009","90","","97.533","0.004","90","","1708.6","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Pyrazole-κN^2^)[N-salicylidene-κO-(R,S)-alaninato-κN,κO]copper(II) Pyrazole Solvate","","- C16 H17 Cu N5 O3 -","- C16 H17 Cu N5 O3 -","- C64 H68 Cu4 N20 O12 -","4","1","JZ1116","Warda, S. A.; Friebel, C.; Sivý, J.; Plesch, G.; Bláhová, M.","(Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Dihydrate and (Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>R</i>,<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Pyrazole Solvate","Acta Crystallographica Section C","1997","53","1","50","54","10.1107/S0108270196010992","","","1.54178","CuKα","","0.0686","0.0681","","0.1833","0.1826","","","","1.145","1.152","1.152","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005872","21.374","0.006","13.072","0.008","23.771","0.012","90","","105.11","0.03","90","","6412","5","208","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Di-[bis-(triphenylphosphoranylidene)-ammonium Fluoropentachloroosmate(IV) Hydrate","","- C72 H62 Cl5 F N2 O Os P4 -","- C72 H62 Cl5 F N2 O Os P4 -","- C288 H248 Cl20 F4 N8 O4 Os4 P16 -","4","1","JZ1142","Bruhn, C.; Preetz, W.","Bis[bis(triphenylphosphoranylidene)ammonium] Pentachlorofluoroosmate(IV) Hydrate, [(C~6~H~5~)~3~P= N= P(C~6~H~5~)~3~]~2~[OsFCl~5~].H~2~O","Acta Crystallographica Section C","1997","53","1","63","66","10.1107/S010827019601061X","","","0.71069","MoKα","","0.1222","0.0479","","0.106","0.076","","","","1.162","1.108","1.108","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005873","9.141","0.002","9.16","0.002","10.736","0.004","90.28","0.02","90.52","0.02","90.11","0.02","898.9","0.4","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- K2 Mg O10 P2 W -","- K2 Mg O10 P2 W -","- K8 Mg4 O40 P8 W4 -","4","4","JZ1148","Peuchert, U.; Bohatý, L.; Schreuer, J.","The Triclinic Room-Temperature Modification of K~2~MgWO~2~(PO~4~)~2~","Acta Crystallographica Section C","1997","53","1","11","14","10.1107/S0108270196011389","","","0.71073","MoKα","","0.0227","0.0213","","0.0514","0.0507","","","","1.067","1.071","1.071","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005874","5.377","0.001","10.488","0.001","20.32","0.002","77.41","0.01","86.14","0.01","80.28","0.01","1101.8","0.3","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H7 N3 O2 S -","- C12 H7 N3 O2 S -","- C48 H28 N12 O8 S4 -","4","2","KA1205","Özbey, S.; Temel, A.; Özgün, B. H.; Ertan, N.","2-(2-Thiazolylhydrazono)indan-1,3-dione","Acta Crystallographica Section C","1997","53","1","113","116","10.1107/S0108270196011742","","","0.71073","MoKα","","","0.038","","","0.041","","","","","0.93","0.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005875","30.136","0.009","6.902","0.002","16.92","0.006","90","","120.23","0.02","90","","3040.7","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Aquabis(salicyaldoximato)zinc","","- C14 H14 N2 O5 Zn -","- C14 H14 N2 O5 Zn -","- C112 H112 N16 O40 Zn8 -","8","1","KA1207","Potočňák, I.; Heinemann, F. W.; Rausch, M.; Steinborn, D.","Aquabis(salicylaldoximato)zinc","Acta Crystallographica Section C","1997","53","1","54","56","10.1107/S0108270196011353","","","0.71073","MoKα","","0.072","0.0526","","0.1746","0.1342","","","","1.171","1.204","1.204","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2005876","14.978","0.003","16.703","0.003","18.847","0.003","90","","90","","90","","4715.1","1.5","293","2","293","2","","","","","","","","4","A b a 2","A 2 -2ab","41","","1,2-bis(2,6-diethylphenyl)-3,3-(oxydiethyl)guanidine","","- C25 H35 N3 O -","- C25 H35 N3 O -","- C200 H280 N24 O8 -","8","","KA1214","Sudha, L.; Subramanian, K.; Senthil Selvan, J.; Steiner, Th.; Koellner, G.; Ramdas, K.; Srinivasan, N.","1,2-Bis(2,6-diethylphenyl)-3,3-(oxydiethyl)guanidine","Acta Crystallographica Section C","1997","53","1","88","90","10.1107/S0108270196011080","","","1.54176","CuKα","","0.0573","0.045","","0.1331","0.1268","","","","1.056","1.123","1.123","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005877","14.996","0.002","9.8324","0.0012","13.461","0.002","90","","116.609","0.006","90","","1774.6","0.4","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4,6,8-Trimethylazulene-Picric Acid","","","- C19 H17 N3 O7 -","- C19 H17 N3 O7 -","- C76 H68 N12 O28 -","4","1","KA1217","Näther, C.; Arad, C.; Bock, H.","The Donor‒Acceptor Complex between 4,6,8-Trimethylazulene and Picric Acid","Acta Crystallographica Section C","1997","53","1","76","79","10.1107/S0108270196011766","","","0.71073","MoKα","","0.0627","0.0459","","0.1334","0.1203","","","","1.025","1.053","1.053","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005878","5.3243","0.0007","6.9487","0.0011","12.1489","0.0014","83.429","0.011","87.055","0.009","71.914","0.009","424.4","0.1","200","2","200","2","","","","","","","","4","P -1","-P 1","2","N,N'-bis(4-metylbenzoyl)-p-phenylenediamine","N,N'-bis(4-methylbenzoyl)-1,4-benzenediamine","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","1","0.5","KA1219","Nagel, N.; Näther, C.; Bock, H.","<i>N</i>,<i>N</i>'-Bis(4-methylbenzoyl)-<i>p</i>-phenylenediamine at 200K","Acta Crystallographica Section C","1997","53","1","79","81","10.1107/S0108270196011778","","","0.71073","MoKα","","0.0511","0.0399","","0.1094","0.1011","","","","1.061","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005879","18.07","0.003","21.23","0.004","9.021","0.002","90","","90","","90","","3460.7","1.2","296","1","","","","","","","","","","5","A b a 2","A 2 -2ab","41","","1,2-Bis(diphenylphosphino)ethanebis(toluenethiol)palladium(II), Pd{Ph~2~P(CH~2~)~2~PPh~2~}(SCH~2~Ph)~2~","","- C40 H38 P2 Pd S2 -","- C40 H38 P2 Pd S2 -","- C160 H152 P8 Pd4 S8 -","4","","KH1116","Su, W.; Hong, M.; Cao, R.; Liu, H.","[1,2-Bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']bis(α-toluenethiolato-<i>S</i>)palladium(II), [Pd{Ph~2~P(CH~2~)~2~PPh~2~}(SCH~2~Ph)~2~]","Acta Crystallographica Section C","1997","53","1","66","67","10.1107/S0108270196012036","","","0.71073","MoKα","","","0.039","","","0.054","","","","","1.23","1.23","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005880","6.09","0.004","7.66","0.004","10.356","0.007","90","","90","","90","","483.1","0.5","298","1","298","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Phosphonoacetic acid","","- C2 H5 O5 P -","- C2 H5 O5 P -","- C8 H20 O20 P4 -","4","1","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","0.71073","MoKα","","0.0318","0.0252","","0.0712","0.068","","","","1.127","1.135","1.135","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005881","6.99","0.004","6.266","0.003","15.932","0.008","90","","98.41","0.04","90","","690.3","0.6","297","1","297","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Potassium phosphonoacetate hydrate","","- C2 H6 K O6 P -","- C2 H6 K O6 P -","- C8 H24 K4 O24 P4 -","4","1","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","0.71073","MoKα","","0.0555","0.0353","","0.0995","0.0923","","","","1.075","1.124","1.124","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005882","7.949","0.004","9.931","0.005","8.407","0.004","90","","99.73","0.04","90","","654.1","0.6","297","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Potassium phosphonoacetate hydrate","","- C2 H6 K O6 P -","- C2 H6 K O6 P -","- C8 H24 K4 O24 P4 -","4","1","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","0.71073","MoKα","","0.0822","0.0375","","0.105","0.0934","","","","1.041","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005883","6.812","0.004","10.258","0.004","9.285","0.004","90","","100.84","0.04","90","","637.2","0.5","303","1","303","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ammonium phosphonoacetate","","- C2 H8 N O5 P -","- C2 H8 N O5 P -","- C8 H32 N4 O20 P4 -","4","1","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","0.71073","MoKα","","0.0665","0.0293","","0.0879","0.0768","","","","1.042","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005884","6.516","0.003","10.596","0.004","7.348","0.003","90","","95.82","0.04","90","","504.7","0.4","297","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Lithium phosphonoacetate","","- C2 H4 Li O5 P -","- C2 H4 Li O5 P -","- C8 H16 Li4 O20 P4 -","4","1","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","0.71073","MoKα","","0.033","0.024","","0.074","0.0702","","","","1.076","1.101","1.101","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005885","5.806","0.002","17.43","0.006","14.607","0.005","90","","90","","90","","1478.2","0.9","295","1","295","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","sodium phosphonoacetate dihydrate","","- C2 H8 Na O7 P -","- C2 H8 Na O7 P -","- C16 H64 Na8 O56 P8 -","8","2","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","1.5418","CuKα","","0.0408","0.0378","","0.1048","0.1026","","","","1.082","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005886","9.26","0.004","10.163","0.004","6.885","0.004","90","","95.95","0.04","90","","644.5","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dipotassium phosphonoacetate","","- C2 H3 K2 O5 P -","- C2 H3 K2 O5 P -","- C8 H12 K8 O20 P4 -","4","1","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","0.71073","MoKα","","0.0545","0.0272","","0.0806","0.0731","","","","1.013","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005887","9.568","0.007","10.407","0.009","7.087","0.006","90","","93.89","0.07","90","","704.1","1","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","diammonium phosphonoacetate","","- C2 H11 N2 O5 P -","- C2 H11 N2 O5 P -","- C8 H44 N8 O20 P4 -","4","1","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","0.71073","MoKα","","0.039","0.0352","","0.0955","0.0928","","","","1.1","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005888","11.76","0.02","6.78","0.004","19.64","0.02","90","","101.42","0.09","90","","1535","3","297","1","297","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","disodium phosphonoacetate dihydrate","","- C2 H7 Na2 O7 P -","- C2 H7 Na2 O7 P -","- C16 H56 Na16 O56 P8 -","8","1","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","0.71073","MoKα","","0.0801","0.0513","","0.1532","0.1371","","","","1.034","1.104","1.104","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005889","6.883","0.006","10.982","0.009","14.148","0.009","90","","90.19","0.06","90","","1069.4","1.4","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","triammonium phosphonoacetate dihydrate","","- C2 H18 N3 O7 P -","- C2 H18 N3 O7 P -","- C8 H72 N12 O28 P4 -","4","1","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","0.71073","MoKα","","0.0592","0.0284","","0.0863","0.0771","","","","1.063","1.14","1.14","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005890","7.891","0.006","24.846","0.017","8.324","0.006","90","","101.46","0.06","90","","1599","2","297","1","297","1","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","trisodium phosphonoacetate decahydrate","","- C2 H22 Na3 O15 P -","- C2 H22 Na3 O15 P -","- C8 H88 Na12 O60 P4 -","4","1","MU1260","Lis, T.","Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O","Acta Crystallographica Section C","1997","53","1","28","42","10.1107/S0108270196009390","","","0.71073","MoKα","","0.0719","0.0372","","0.1027","0.0922","","","","1.019","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005891","12.688","0.002","11.894","0.004","16.876","0.002","90","","101.78","0.01","90","","2493.1","1","295","","298","","","","","","","","","4","P 1 21 1","","","","(+)-1-allyl-N'-(5R,8S)[9,10-didehydro-6-methylergolin-8-yl]-N,N-diethylurea (+)(S)-2-(6-methoxy-2-naphthyl)propionic acid","","- C54 H68 N4 O9 -","- C54 H68 N4 O9 -","- C108 H136 N8 O18 -","2","1","NA1243","Bachechi, F.; Flieger, M.; Sinibaldi, M.","Complex of a Lisuride Derivative and (<i>S</i>)-Naproxen","Acta Crystallographica Section C","1997","53","1","136","140","10.1107/S0108270196009870","","","1.54178","CuKα","","","0.049","","","0.0566","","","","","2.03","2.03","","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2005892","12.6","0.003","7.258","0.001","6.162","0.001","90","","114.49","0.03","90","","512.8","0.2","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","Diguanidinium hexafluorate silicate","","","- C2 H12 F6 N6 Si -","- C2 H12 F6 N6 Si -","- C4 H24 F12 N12 Si2 -","2","0.25","NA1247","Waskowska, A.","Diguanidinium Hexafluorosilicate","Acta Crystallographica Section C","1997","53","1","128","130","10.1107/S0108270196011717","","","0.71073","MoKα","","0.0389","0.0304","","0.062","0.059","","","","1.04","1.052","1.052","","","","","has coordinates","209447","2020-10-21","18:00:00",""
"2005893","13.6293","0.0006","10.364","0.001","33.859","0.002","90","","100.236","0.003","90","","4706.6","0.6","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,8-Dimethyl-5-(4-fluorophenyl)-2-(p-toluolylaminomethyl)-2,3-dihydro- 1H-1,4-benzodiazepine Monohydrate.","","- C26 H28 F N3 O2 -","- C26 H28 F N3 O2 -","- C208 H224 F8 N24 O16 -","8","2","NA1261","Peeters, O. M.; Blaton, N. M.; de Ranter, C. J.","5-(4-Fluorophenyl)-1,8-dimethyl-2-(<i>p</i>-toluoylaminomethyl)-2,3-dihydro-1<i>H</i>-1,4-benzodiazepine Monohydrate","Acta Crystallographica Section C","1997","53","1","95","97","10.1107/S0108270196011729","","","1.54184","CuKα","","0.1319","0.0532","","0.1799","0.1418","","","","0.853","1.255","1.255","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005894","8.813","0.001","9.597","0.001","12.805","0.002","70.12","0.01","84.45","0.01","67.87","0.01","942.8","0.2","298","","298","","","","","","","","","4","P -1","-P 1","2","","2,6-dimethyl-4-(3-nitrophenyl)pyridinium-3,5-dicarboxylate nitrate monohydrate","","- C15 H15 N3 O10 -","- C15 H21 N3 O13 -","- C30 H42 N6 O26 -","2","1","PA1241","Rowan, K. R.; Holt, E. M.","3,5-Dicarboxy-2,6-dimethyl-4-(3-nitrophenyl)pyridinium Nitrate Monohydrate","Acta Crystallographica Section C","1997","53","1","106","108","10.1107/S0108270196011821","","","0.71073","MoKα","","","0.046","","","0.0561","","","","","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005895","12.399","0.001","7.09","0.001","12.939","0.002","90","","108.49","0.01","90","","1078.7","0.2","293","2","293","2","","","","","","","","3","C 1 m 1","C -2y","8","","Osmiumstannat","","- O14 Os3 Sn15 -","- O14 Os3 Sn15 -","- O28 Os6 Sn30 -","2","0.5","SK1025","Söhnel, T.; Reichelt, W.","Os~3~Sn~15~O~14~, ein ternäres Oxid mit osmiumgefüllten Sn~6~-Oktaedern","Acta Crystallographica Section C","1997","53","1","9","11","10.1107/S0108270196009560","","","0.71073","MoKα","","0.041","0.0344","","0.0893","0.0871","","","","1.049","1.074","1.074","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005896","14.6057","0.0002","9.237","0.0001","18.6333","0.0003","90","","91.79","0.001","90","","2512.64","0.06","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H28 O11 -","- C25 H28 O11 -","- C100 H112 O44 -","4","1","SK1033","Boehlow, T. R.; Rath, N. P.; Spilling, C. D.","Methyl 4-Hydroxy-3-[4-methoxy-2-(methoxymethyleneoxy)phenyl]-2-{[4-methoxy-2-(methoxymethyleneoxy)phenyl]methyl}-5-oxo-2,5-dihydrofuran-2-carboxylate","Acta Crystallographica Section C","1997","53","1","92","95","10.1107/S0108270196011602","","","0.71073","MoKα","","0.0913","0.0753","","0.25","0.2142","","","","1.095","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005897","16.942","0.001","16.942","0.001","5.9187","0.0004","90","","90","","120","","1471.25","0.16","298","2","298","2","","","","","","","","4","R 3 :H","R 3","146","tribenzyltin chloride","chlorotris(phenylmethyl)stannane","","- C21 H21 Cl Sn -","- C21 H21 Cl Sn -","- C63 H63 Cl3 Sn3 -","3","0.333333","SK1046","Ng, S. W.","Tribenzyltin Chloride","Acta Crystallographica Section C","1997","53","1","56","58","10.1107/S0108270196011614","","","0.71073","MoKα","","0.0229","0.0229","","0.0563","0.0563","","","","1.065","1.065","1.065","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005898","9.4512","0.0007","9.8717","0.0006","21.145","0.002","90","","90.693","0.009","90","","1972.7","0.3","291","","291","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 F3 O2 -","- C10 H7 F3 O2 -","- C80 H56 F24 O16 -","8","2","SX1008","Swenson, D. C.; Lu, H.; Burton, D. J.","(<i>Z</i>)-3-Phenyl-2-(trifluoromethyl)prop-2-enoic Acid: a Hydrogen-Bonded Dimer","Acta Crystallographica Section C","1997","53","1","111","113","10.1107/S0108270196010803","","","1.54184","CuKα","","0","0.056","","","0.082","","","","","1.175","1.175","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2005899","17.133","0.003","13.714","0.001","10.776","0.001","90","","98.6","0.01","90","","2503.5","0.5","292.7","","292.7","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C50 H44 Cl2 Cu2 N2 O2 P2 S4 -","- C50 H44 Cl2 Cu2 N2 O2 P2 S4 -","- C100 H88 Cl4 Cu4 N4 O4 P4 S8 -","2","0.5","TA1094","Shibahara, T.; Kobayashi, S.; Long, D.; Xin, X.","Bis{μ-chloro-[2(3<i>H</i>)-benzothiazolethione](triphenylphosphine)copper(I)} Dihydrate","Acta Crystallographica Section C","1997","53","1","58","60","10.1107/S0108270196011961","","","1.5418","CuKα","","","0.065","","","0.0859","","","","","1.658","1.658","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2005900","14.453","0.002","10.149","0.003","17.136","0.001","90","","91.315","0.007","90","","2512.9","0.8","213","1","213","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Cl3 N O8 -","- C22 H23 Cl3 N O8 -","- C88 H92 Cl12 N4 O32 -","4","1","TA1095","Banwell, M. G.; Hockless, D. C. R.; Peters, S. C.","A Possible Synthetic Precursor to the Tropoloisoquinoline Alkaloid Pareirubrine A","Acta Crystallographica Section C","1997","53","1","109","111","10.1107/S0108270196009092","","","1.5418","CuKα","","","0.0615","","","0.0641","","","","","2.175","2.175","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005902","9.405","0.001","7.669","0.002","9.436","0.001","90","","104.177","0.009","90","","659.9","0.2","296","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H20 N3 O8 P -","- C6 H20 N3 O8 P -","- C12 H40 N6 O16 P2 -","2","1","TA1109","Suga, T.; Okabe, N.","<small>L</small>-Histidinol Phosphate Tetrahydrate","Acta Crystallographica Section C","1997","53","1","134","136","10.1107/S0108270196012516","","","0.71069","MoKα","","","0.036","","","0.049","","","","","1.87","1.87","","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2005903","15.804","0.002","15.112","0.002","12.684","0.002","90","","104.89","0.01","90","","2927.6","0.7","296","","23","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C26 H28 Cl3 N6 O4 Sm -","- C26 Cl3 N6 O4 Sm -","- C104 Cl12 N24 O16 Sm4 -","4","1","TA1110","Jin, H.-Y.; Akiba, M.; Umakoshi, K.; Sasaki, Y.; Kabuto, K.","Dichloro[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis(2-pyridylmethyl)ethylenediamine]samarium(III) Perchlorate","Acta Crystallographica Section C","1997","53","1","60","63","10.1107/S0108270196009924","","","0.71069","MoKα","","","0.049","","","0.043","","","","","2.248","2.248","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005904","7.9656","0.0011","9.7996","0.001","12.036","0.002","86.45","0.02","80.28","0.02","77.45","0.02","903.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,2-diphenyl-3-benzyl-guanidine hydrochloride","","- C20 H20 Cl N3 -","- C20 H20 Cl N3 -","- C40 H40 Cl2 N6 -","2","1","TA1114","Sudha, L.; Subramanian, K.; Senthil Selvan, J.; Steiner, Th.; Koellner, G.; Ramdas, K.; Srinivasan, N.","1,2-Diphenyl-3-benzylguanidine Hydrochloride","Acta Crystallographica Section C","1997","53","1","86","88","10.1107/S010827019601195X","","","1.54176","CuKα","","0.0366","0.0353","","0.0929","0.0922","","","","1.078","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005905","16.331","0.006","29.61","0.01","10.854","0.005","90","","90","","90","","5249","4","296","","","","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C50 H48 Cl4 N2 O7 P2 Re2 -","- C50 H44 Cl4 N2 O7 P2 Re2 -","- C200 H176 Cl16 N8 O28 P8 Re8 -","4","1","AB1373","Gerber, T. I. A.; Perils, J.; Du Preez, J. G. H.; Bandoli, G.","Chelation of 2,6-Bis(hydroxymethyl)pyridine in <i>cis</i>-Dichloro(triphenylphosphine-<i>P</i>)[2-(oxymethylene-<i>O</i>)-6-(hydroxymethyl)pyridine-<i>N</i>]oxorhenium(V)‒Water (2/1)","Acta Crystallographica Section C","1997","53","2","217","219","10.1107/S0108270196013030","","","0.71073","MoKα","","","0.0443","","","0.0597","","","","","0.85","0.85","","","","","has coordinates","191095","2020-10-21","18:00:00",""
"2005906","12.356","0.0011","13.624","0.0012","14.705","0.0015","90","","90","","90","","2475.4","0.4","295","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H12 Mo O4 -","- C12 H14 Mo O4 -","- C96 H112 Mo8 O32 -","8","1","AB1394","Ülkü, D.; Tahir, M. N.; Özkar, S.","Tetracarbonyl(η^2:2^-1,5-cyclooctadiene)molybdenum(0)","Acta Crystallographica Section C","1997","53","2","185","187","10.1107/S0108270196012723","","","0.71073","MoKα","","","0.029","","","0.034","","","","","0.74","0.74","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005907","7.627","0.001","9.054","0.001","14.6","0.001","78.64","0.01","84.91","0.01","63.67","0.01","885.9","0.18","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H42 Co N4 O10 -","- C34 H42 Co N4 O10 -","- C34 H42 Co N4 O10 -","1","0.5","AB1409","Hökelek, T.; Necefouglu, H.","Diaquabis(<i>N</i>,<i>N</i>-diethylnicotinamide-<i>N</i>^1^)bis(2-hydroxybenzoato-<i>O</i>)cobalt(II)","Acta Crystallographica Section C","1997","53","2","187","189","10.1107/S0108270196013170","","","0.71073","MoKα","","","0.05","","","0.056","","","","","1.56","1.56","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005908","11.582","0.002","9.407","0.002","18.429","0.004","90","","108.14","0.02","90","","1908.1","0.7","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","wwanthra","9,10-bis[2-ethynyl(4-N,N-diphenylamino)phenyl]anthracene","","- C54 H36 N2 -","- C54 H36 N2 -","- C108 H72 N4 -","2","0.5","BK1186","Venkataraman, D.; Wang, P.-W.; Moore, J. S.","9,10-Bis{2-[4-(<i>N</i>,<i>N</i>-diphenylamino)phenyl]ethynyl}anthracene","Acta Crystallographica Section C","1997","53","2","241","243","10.1107/S0108270196012620","","","0.71073","MoKα","","0.0747","0.0438","","0.1228","0.1057","","","","1.04","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005909","3.9237","0.0001","11.9223","0.0002","17.7519","0.0003","90","","97.034","0.002","90","","824.18","0.03","173","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-bromo-2,6-dichlorobenzonitrile","","- C7 H2 Br Cl2 N -","- C7 H2 Br Cl2 N -","- C28 H8 Br4 Cl8 N4 -","4","1","BK1210","Britton, D.","4-Bromo-2,6-dichlorobenzonitrile","Acta Crystallographica Section C","1997","53","2","225","227","10.1107/S0108270196012656","","","0.71069","MoKα","","","0.046","","","0.056","","","","","1.74","1.74","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005910","8.76","0.009","7.869","0.005","14.04","0.01","90","","93.12","0.07","90","","966.4","1.4","153","2","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,4-Dinitrocinnamic acid","E-3-(2,4-Dinitrophenyl)-2-propenoic acid","","- C9 H6 N2 O6 -","- C9 H6 N2 O6 -","- C36 H24 N8 O24 -","4","1","BK1250","Thalladi, V. R.; Sharma, C. V. K.; Desiraju, G. R.","2,4-Dinitro-<i>trans</i>-cinnamic Acid","Acta Crystallographica Section C","1997","53","2","227","229","10.1107/S0108270196012310","","","0.71069","MoKα","","0.06","0.04","","0.091","0.084","","","","1.024","1.124","1.124","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005911","13.098","0.003","13.211","0.003","12.578","0.003","90","","90","","90","","2176.5","0.9","150","","150","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Bis[1,2-bis(dimethylamino)ethane]tetrachlorothorium(IV)","","- C12 H32 Cl4 N4 Th -","- C12 H32 Cl4 N4 Th -","- C48 H128 Cl16 N16 Th4 -","4","1","BK1289","Rabinovich, D.; Schimek, G. L.; Pennington, W. T.; Nielsen, J. B.; Abney, K. D.","Tetrachlorobis(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-<i>N</i>,<i>N</i>')thorium(IV)","Acta Crystallographica Section C","1997","53","2","191","193","10.1107/S0108270196012796","","","0.71073","MoKα","","0.036","0.0313","","0.036","0.0356","","","","","1.65","1.65","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005912","8.4511","0.0013","9.8471","0.0016","12.2407","0.0018","111.352","0.012","91.97","0.014","108.781","0.011","884.8","0.3","295","","","","","","","","","","","3","P -1","-P 1","2","","","","- C20 H24 N4 -","- C20 H24 N4 -","- C40 H48 N8 -","2","1","BM1050","Ülkü, D.; Tahir, M. N.; Çetinkaya, B.; Özdemir, I.","<i>cis</i>-1,1'-Dimethyl-3,3'-diphenyl-2,2'-biimidazolidinylidene","Acta Crystallographica Section C","1997","53","2","240","241","10.1107/S0108270196013121","","","0.71073","MoKα","","","0.046","","","0.057","","","","","1.49","1.49","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005913","21.174","0.004","21.174","0.004","15.119","0.002","90","","90","","90","","6778","2","293","2","293","2","","","","","","","","5","I -4 c 2","I -4 -2c","120","","Bis(tetraethylammonium) bis(μ-sulfido)-bis[(1,2,3,4-tetrathiabutan-1,4-diyl-S,S)thiotungstate(V)]","","- C16 H40 N2 S12 W2 -","- C16 H30 N2 S12 W2 -","- C128 H240 N16 S96 W16 -","8","0.5","BM1055","Mukherjee, A. K.; Das, P. K.; Mukherjee, M.; Chakraborty, P. K.; Bhattacharya, R.","Disorder in Bis(tetraethylammonium) Bis(μ-sulfido)bis[(1,2,3,4-tetrathiabutane-1,4-diyl-<i>S</i>,<i>S</i>)thiotungstate(V)]","Acta Crystallographica Section C","1997","53","2","209","212","10.1107/S0108270196011699","","","0.71073","MoKα","","0.0676","0.0484","","0.1244","0.1139","","","","1.044","1.09","1.09","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005914","11.932","0.002","10.032","0.008","15.309","0.003","90","","109.73","0.01","90","","1724.9","1.4","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Trimethyl[9-(dimethylaminomethyl)carbazole]gallium","","- C18 H25 Ga N2 -","- C18 H25 In N2 -","- C72 H100 In4 N8 -","4","1","BM1084","Gu, W.; Pan, Y.; Shen, Y.; Huang, X.; Sun, H.; Sun, X.","[(Carbazolylmethyl)dimethylamine-<i>N</i>]trimethylgallium","Acta Crystallographica Section C","1997","53","2","190","191","10.1107/S0108270196011705","","","0.71073","MoKα","","","0.04","","","0.048","","","","","1.4","1.4","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2005915","9.144","0.001","11.087","0.002","13.241","0.001","91.64","0.02","102.62","0.01","112.09","0.02","1204.6","0.3","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H22 N8 Ni O10 -","- C20 H22 N8 Ni O10 -","- C40 H44 N16 Ni2 O20 -","2","1","BM1107","Tahir, M. N.; Ülkü, D.; Nazir, H.; Atakol, O.","Bis{2-[(3-aminopropyl)iminomethyl]-4,6-dinitrophenolato-<i>O</i>,<i>N</i>,<i>N</i>'}nickel(II)","Acta Crystallographica Section C","1997","53","2","181","183","10.1107/S0108270196012966","","","0.71073","MoKα","","","0.031","","","0.038","","","","","1.22","1.22","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005916","10.73","0.001","27.197","0.004","10.127","0.002","90","","99.44","0.01","90","","2915.3","0.8","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27.7 H36.3 B Cu F4 N4.7 O2.3 -","- C27.7 H35.1 B Cu F4 N4.7 O2.3 -","- C110.8 H140.4 B4 Cu4 F16 N18.8 O9.2 -","4","1","BM1108","Fenton, D. E.; He, Q.-Y.; McKee, V.","[6-(2-Pyridylmethyl)-2,6,10-triazaundecane-1,11-diylbis(2-phenolato)(1 ‒)]copper(II) Tetrafluoroborate Methanol Acetonitrile Solvate (1/1/0.3/0.7)","Acta Crystallographica Section C","1997","53","2","207","209","10.1107/S0108270196012978","","","0.71073","MoKα","","0.0855","0.0524","","0.1273","0.1024","","","","1.179","1.216","1.216","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005917","6.284","0.003","14.415","0.007","25.633","0.013","90","","96.42","0.03","90","","2307","2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C31 H24 O -","- C31 H24 O -","- C124 H96 O4 -","4","1","BM1112","Nastopoulos, V.; Kallitsis, J.; Naarmann, H.; Dideberg, O.; Dupont, L.","2',3'-Diphenyl-Substituted <i>p</i>-Terphenyls","Acta Crystallographica Section C","1997","53","2","248","251","10.1107/S0108270196013467","","","1.5418","CuKα","","0.0679","0.0416","","0.123","0.1151","","","","1.007","1.183","1.183","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005918","10.2274","0.0006","10.6632","0.0009","22.7258","0.0013","90","","102.799","0.01","90","","2416.8","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32 H26 O2 -","- C32 H26 O2 -","- C128 H104 O8 -","4","1","BM1112","Nastopoulos, V.; Kallitsis, J.; Naarmann, H.; Dideberg, O.; Dupont, L.","2',3'-Diphenyl-Substituted <i>p</i>-Terphenyls","Acta Crystallographica Section C","1997","53","2","248","251","10.1107/S0108270196013467","","","1.5418","CuKα","","0.078","0.0523","","0.1637","0.1539","","","","1.101","1.268","1.268","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005919","23.2581","0.0013","13.8504","0.0006","7.5293","0.0005","90","","90","","90","","2425.4","0.2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ba~6~V~4~O~5~S~11~","","- Ba6 O5 S11 V4 -","- Ba6 O5 S11 V4 -","- Ba24 O20 S44 V16 -","4","0.5","BR1155","Litteer, J. B.; Fettinger, J. C.; Eichhorn, B. W.","Ba~6~V~4~O~5~S~11~","Acta Crystallographica Section C","1997","53","2","163","165","10.1107/S0108270196011687","","","0.71073","MoKα","","0.0464","0.0394","","0.1023","0.0979","","","","1.061","1.089","1.089","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005920","8.5613","0.0004","7.11","0.0003","5.1851","0.0001","111.441","0.002","89.986","0.003","103.065","0.004","284.99","0.02","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Tetralithium diphosphate","","","- Li4 O7 P2 -","- Li4 O7 P2 -","- Li8 O14 P4 -","2","1","BR1158","Daidouh, A.; Veiga, M. L.; Pico, C.; Martinez-Ripoll, M.","A New Polymorph of Li~4~P~2~O~7~","Acta Crystallographica Section C","1997","53","2","167","169","10.1107/S0108270196011869","","","0.7107","MoKα","","0.0309","0.0291","","0.0945","0.0934","","","","1.34","1.365","1.365","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005921","9.7337","0.0008","7.2012","0.0006","12.5976","0.0012","90","","90","","90","","883.02","0.13","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Potassium Tungsten Selenide","","","- K2 Se4 W -","- K2 Se4 W -","- K8 Se16 W4 -","4","0.5","BR1161","Röhnert, D.; Näther, C.; Bensch, W.","K~2~WSe~4~","Acta Crystallographica Section C","1997","53","2","165","167","10.1107/S0108270196013765","","","0.71073","MoKα","","0.0605","0.0321","","0.086","0.0788","","","","1.026","1.136","1.136","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005922","13.641","0.003","7.034","0.001","12.403","0.002","90","","94.66","0.03","90","","1186.1","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","η^5^-Cyclopentadienyl Phenylimido Vanadium Dichloride","","- C11 H10 Cl2 N V -","- C11 H10 Cl2 N V -","- C44 H40 Cl8 N4 V4 -","4","1","CF1112","Chan, M. C. W.; Cole, J. M.; Gibson, V. C.; Howard, J. A. K.","Dichloro(η^5^-cyclopentadienyl)(phenylimido)vanadium(V)","Acta Crystallographica Section C","1997","53","2","202","204","10.1107/S0108270196012875","","","0.71073","MoKα","","0.1245","0.0545","","0.0905","0.0795","","","","0.994","1.169","1.169","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005923","8.83","0.002","9.363","0.002","10.134","0.002","90","","90","","90","","837.8","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3-deoxy-Me-α-D-mannopyranoside","3-deoxy Methyl-α-D-arabino hexopyranoside","","- C7 H14 O5 -","- C7 H14 O5 -","- C28 H56 O20 -","4","1","CF1140","Evdokimov, A. G.; Frolow, F.","Methyl 3-Deoxy-α-<small>D</small>-<i>arabino</i>-hexopyranoside","Acta Crystallographica Section C","1997","53","2","264","266","10.1107/S0108270196012863","","","0.71073","MoKα","","0.0788","0.0593","","0.1197","0.1072","","","","1.078","1.114","1.114","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005924","29.3869","0.0014","12.1954","0.0008","13.57","0.0009","90","","103.845","0.005","90","","4722","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H5 F3 Fe4 O11 -","- C20 H5 F3 Fe4 O11 -","- C160 H40 F24 Fe32 O88 -","8","1","CF1141","Muir, K. W.; Manojlovic-Muir, L.; Morrice, F.; Guennou, K.; Pétillon, F.; Rumin, R.","A Tetranuclear Iron Cluster Complex: [{Fe(CO)~3~}~3~{μ~3~-CC[Fe(CO)~2~(η^5^-C~5~H~5~)]C(CF~3~)}]","Acta Crystallographica Section C","1997","53","2","219","222","10.1107/S0108270196012632","","","0.71073","MoKα","","0.1078","0.0406","","0.0941","0.0741","","","","1.023","1.067","1.067","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005925","6.776","0.001","17.928","0.001","21.642","0.001","90","","90","","90","","2629.1","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","9β-hydroxy-28-methoxy-11,28-dioxo-1,2-dinor-10α-18β-olean-12-en-3,10β-olide","","- C29 H42 O6 -","- C29 H42 O6 -","- C116 H168 O24 -","4","1","CF1142","Gzella, A.; Zaprutko, L.; Wrzeciono, U.","Triterpenoide. X. Über neue isomere Triterpenlactone","Acta Crystallographica Section C","1997","53","2","261","264","10.1107/S0108270196012887","","","1.54178","CuKα","","0.0495","0.0404","","0.1224","0.117","","","","1.061","1.078","1.078","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005926","10.303","0.001","6.864","0.001","18.844","0.001","90","","90.88","0.01","90","","1332.5","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","9β-hydroxy-28-methoxy-11,28-dioxo-1,2-dinor-10α-18α-olean-12-en-3,10β-olide","","- C29 H42 O6 -","- C29 H42 O6 -","- C58 H84 O12 -","2","1","CF1142","Gzella, A.; Zaprutko, L.; Wrzeciono, U.","Triterpenoide. X. Über neue isomere Triterpenlactone","Acta Crystallographica Section C","1997","53","2","261","264","10.1107/S0108270196012887","","","1.54178","CuKα","","0.0513","0.0466","","0.1398","0.1356","","","","1.051","1.063","1.063","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005927","10.701","0.001","12.771","0.002","18.751","0.002","90","","90","","90","","2562.6","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","9α-hydroxy-28-methoxy-11,28-dioxo-1,2-dinor-10α-18α-olean-12-en-3,10β-olide","","- C29 H42 O6 -","- C29 H42 O6 -","- C116 H168 O24 -","4","1","CF1142","Gzella, A.; Zaprutko, L.; Wrzeciono, U.","Triterpenoide. X. Über neue isomere Triterpenlactone","Acta Crystallographica Section C","1997","53","2","261","264","10.1107/S0108270196012887","","","1.54178","CuKα","","0.0536","0.0411","","0.1222","0.117","","","","1.086","1.114","1.114","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005928","14.438","0.005","8.697","0.005","11.964","0.007","90","","98.44","0.04","90","","1486","1.3","296","2","23","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(±)Methyl (1α,1aα,3aα,6aα,6bα)-1a-ethenyl-octahydro- 6a-methoxy-2,2- dimethyl-3,6-dioxacyclobut[cd]indene-1-carboxylate","","- C15 H22 O5 -","- C15 H22 O5 -","- C60 H88 O20 -","4","1","CR1168","Britten, J. F.; Kassam, K.; Warkentin, J.","A Novel Tricyclic Cyclobutanone Ketal","Acta Crystallographica Section C","1997","53","2","243","245","10.1107/S0108270196013224","","","1.5418","CuKα","","0.1895","0.0456","","0.1644","0.1077","","","","1.01","1.189","1.189","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005929","7.138","0.003","10.148","0.004","10.686","0.002","105.81","0.03","104.54","0.02","105.3","0.03","673.5","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H14 Cu N2 O6 -","- C13 H14 Cu N2 O6 -","- C26 H28 Cu2 N4 O12 -","2","1","DE1039","Suresh, E.; Bhadbhade, M. M.","Metal‒α,ω-Dicarboxylate Complexes. I. Aqua(2,2'-bipyridyl-<i>N</i>,<i>N</i>')(malonato-<i>O</i>,<i>O</i>')copper(II) Monohydrate","Acta Crystallographica Section C","1997","53","2","193","195","10.1107/S0108270196012395","","","0.7107","MoKα","","0.0411","0.0382","","0.1066","0.1034","","","","1.046","1.068","1.068","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005930","21.421","0.002","21.421","0.002","15.063","0.002","90","","90","","120","","5985.8","1.1","293","2","293","2","","","","","","","","7","R 3 c :H","R 3 -2""c","161","","Tris(1-ethyl-3,5-diaza-1-azonia-7-phosphatricyclodecane iodide)gold(I) Iodide Trihydrate","","- C24 H53 Au I4 N9 O3 P3 -","- C24 H57 Au I4 N9 O3 P3 -","- C144 H342 Au6 I24 N54 O18 P18 -","6","0.333333","FG1092","Forward, J. M.; Staples, R. J.; Liu, C. W.; Fackler, Jnr, J. P.","Luminescent Tris(3-ethyl-1,5-diaza-3-azonia-7-phosphatricyclo[3.3.1.1^3,7^]decane-<i>P</i>)gold(I) Tetraiodide Trihydrate, [(EtTPA)~3~Au]I~4~.3H~2~O","Acta Crystallographica Section C","1997","53","2","195","197","10.1107/S0108270196012486","","","0.71073","MoKα","","0.0348","0.0245","","0.0601","0.0565","","","","1.075","1.086","1.086","","","","","has coordinates","188927","2020-10-21","18:00:00",""
"2005931","8.7563","0.0001","9.0187","0.0002","16.9354","0.0004","90","","90","","90","","1337.4","0.05","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,2-O-isopropylidene-3-acetamido-5-O-acetyl-D-ribofuranose","","- C12 H19 N O6 -","- C12 H19 N O6 -","- C48 H76 N4 O24 -","4","1","FG1209","Abboud, K. A.; Parr, I. B.; Horenstein, B. A.","3-Acetamido-5-<i>O</i>-acetyl-1,2-<i>O</i>-isopropylidene-<small>D</small>-ribofuranose","Acta Crystallographica Section C","1997","53","2","245","247","10.1107/S0108270196012498","","","0.71073","MoKα","","0.0354","0.0305","","0.0932","0.0729","","","","1.092","1.084","1.084","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005932","16.903","0.002","12.158","0.002","12.342","0.002","90","","114.96","0.03","90","","2299.5","0.8","295","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H22 Cu2 N2 O4 -","- C28 H22 Cu2 N2 O4 -","- C112 H88 Cu8 N8 O16 -","4","0.5","FR1008","Ülkü, D.; Ercan, F.; Atakol, O.; Ercan, I.; Gencer, A.","Bis{2-[(2-hydroxybenzyl)iminomethyl]phenolato(2 ‒)-<i>O</i>:<i>O</i>,<i>N</i>,<i>O</i>'}dicopper(II)","Acta Crystallographica Section C","1997","53","2","179","181","10.1107/S0108270196012590","","","0.71073","MoKα","","","0.068","","","0.082","","","","","0.94","0.94","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005933","21.334","0.006","6.985","0.002","17.1","0.006","90","","123.45","0.02","90","","2126.1","1.2","295.2","","295.2","","","","","","","","","6","P 1 2/m 1","-P 2y","12","","","","- C17 H19 Co N6 O2 S2 -","- C10.5 H15 Co0.5 N3 O1.5 S -","- C42 H60 Co2 N12 O6 S4 -","4","1","HA1172","Beddoes, R. L.; Dinsmore, A.; Helliwell, M.; Garner, C. D.; Joule, J. A.","A Pteridin-6-yl Alkene-1,2-dithiolate Complex of Cobalt","Acta Crystallographica Section C","1997","53","2","213","215","10.1107/S0108270196013571","","","0.7107","MoKα","","0.1202","0.0657","","0.0826","0.0787","","","","2.702","3.332","3.332","","","","","has coordinates","198535","2020-10-21","18:00:00",""
"2005934","10.3144","0.0012","10.3144","0.0012","13.177","0.002","90","","90","","120","","1214","0.3","296","2","296","2","","","","","","","","4","P 31","P 31","144","","Bis[(S)-(-)-α-Methylbenzyl]thiourea","","- C17 H20 N2 S -","- C17 H20 N2 S -","- C51 H60 N6 S3 -","3","1","HA1175","Bailey, P. J.; Grant, K. J.; Parsons, S.","Bis[(<i>S</i>)-({-})-α-methylbenzyl]thiourea","Acta Crystallographica Section C","1997","53","2","247","248","10.1107/S010827019601298X","","","0.71073","MoKα","","0.0901","0.0456","","0.0788","0.0667","","","","1.018","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005935","8.781","0.001","15.021","0.002","13.452","0.003","90","","102.18","0.02","90","","1734.4","0.5","298","3","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H24 Cl2 Cu N4 O8 -","- C9 H24 Cl2 Cu N4 O12 -","- C36 H96 Cl8 Cu4 N16 O48 -","4","1","HR1023","Lu, T.-H.; Tahirov, T. H.; Shu, K.; Chung, C.-S.","Copper(II) and Nickel(II) Complexes of 4-Methyl-4,7-diazadecane-1,10-diamine","Acta Crystallographica Section C","1997","53","2","204","206","10.1107/S0108270196006129","","","0.71073","MoKα","","","0.036","","","0.047","","","","","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005936","8.732","0.001","14.8","0.002","13.655","0.003","90","","100.14","0.02","90","","1737.1","0.5","298","3","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H24 Cl2 N4 Ni O8 -","- C9 H24 Cl2 N4 Ni O8 -","- C36 H96 Cl8 N16 Ni4 O32 -","4","1","HR1023","Lu, T.-H.; Tahirov, T. H.; Shu, K.; Chung, C.-S.","Copper(II) and Nickel(II) Complexes of 4-Methyl-4,7-diazadecane-1,10-diamine","Acta Crystallographica Section C","1997","53","2","204","206","10.1107/S0108270196006129","","","0.71073","MoKα","","","0.078","","","0.087","","","","","1.24","1.24","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005937","7.047","0.001","23.973","0.005","12.28","0.002","90","","101","0.03","90","","2036.4","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H28 Cl3 N5 Pt -","- C15 H28 Cl3 N5 Pt -","- C60 H112 Cl12 N20 Pt4 -","4","1","JZ1120","Karentzopoulos, S.; Engelking, H.; Bremer, B.; Paschke, N.; Krebs, B.","The First Example of a <i>cis</i>-Platinum Analogue with Two Directly Bridged Imidazoles: [Pt(mimim)Cl~2~].Et~4~NCl","Acta Crystallographica Section C","1997","53","2","172","174","10.1107/S0108270196011948","","","0.71073","MoKα","","0.0964","0.0489","","0.105","0.0893","","","","1.018","1.073","1.073","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005938","8.4083","0.0007","9.404","0.0013","15.9899","0.0013","90","","90","","90","","1264.3","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","His-Gly dihydrochloride","L-Histidyl-glycine dihydrochloride","","- C8 H14 Cl2 N4 O3 -","- C8 H14 Cl2 N4 O3 -","- C32 H56 Cl8 N16 O12 -","4","1","JZ1143","Steiner, Th.","<small>L</small>-Histidylglycinium Dichloride","Acta Crystallographica Section C","1997","53","2","255","257","10.1107/S0108270196010682","","","1.54176","CuKα","","0.0333","0.0324","","0.0916","0.091","","","","1.094","1.105","1.105","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005939","9.77","0.001","16.018","0.004","7.575","0.002","90","","90","","90","","1185.5","0.4","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","","9,10-dihydro-9-oxo-10-acridineacetic acid","","- C15 H11 N O3 -","- C15 H11 N O3 -","- C60 H44 N4 O12 -","4","1","JZ1150","Dobrzynska, D.; Turowska-Tyrk, I.","9,10-Dihydro-9-oxo-10-acridineacetic Acid","Acta Crystallographica Section C","1997","53","2","238","239","10.1107/S0108270196012802","","","0.71073","MoKα","","0.055","0.039","","0.115","0.103","","","","1.03","1.05","1.05","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005940","13.8538","0.0011","12.0498","0.0008","19.08","0.0012","90","","91.068","0.007","90","","3184.6","0.4","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C37 H43 N4 -","- C37 H43 N4 -","- C148 H172 N16 -","4","1","KA1216","Näther, C.; Bock, H.","Tetrakis(<i>p</i>-dimethylaminophenyl)ethylene Hemibenzene Solvate","Acta Crystallographica Section C","1997","53","2","231","234","10.1107/S0108270196012504","","","0.71073","MoKα","","0.0642","0.0427","","0.12","0.1098","","","","1.044","1.115","1.115","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005941","9.77","0.003","8.575","0.005","10.096","0.002","90","","111.68","0.02","90","","786","0.6","295","","295","","","","","","","","","3","P 1 21 1","P 2yb","4","α,β-trehalose monohydrate","","","- C12 H24 O12 -","- C12 H24 O12 -","- C24 H48 O24 -","2","1","KH1115","Taga, T.; Miwa, Y.; Min, Z.","α,β-Trehalose Monohydrate","Acta Crystallographica Section C","1997","53","2","234","236","10.1107/S0108270196012693","","","0.7107","MoKα","","","0.041","","","0.049","","","","","1","1","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005942","8.641","0.003","13.064","0.002","10.945","0.003","90","","106.861","0.002","90","","1182.4","0.6","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Triphenylphosphonium tetradecahydro-nido-undecaborate(-1)","","- C18 H30 B11 P -","- C18 H30 B11 P -","- C36 H60 B22 P2 -","2","0.5","MU1262","McGrath, T. D.; McGrathand, A. J.","[Ph~3~PH][<i>nido</i>-B~11~H~14~]","Acta Crystallographica Section C","1997","53","2","229","231","10.1107/S0108270196013303","","","0.71073","MoKα","","0.123","0.0594","","0.1653","0.1497","","","","1.028","1.255","1.255","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005943","8.648","0.003","14.383","0.006","15.173","0.006","90","","99.77","0.05","90","","1859.9","1.3","150","0.2","150","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Fac-tris(6-methyl-2-mercaptopyridinate)cobalt(III)","","- C18 H18 Co N3 S3 -","- C18 H18 Co N3 S3 -","- C72 H72 Co4 N12 S12 -","4","1","MU1291","Fielding, C.; Parsons, S.; Winpenny, R. E. P.","<i>fac</i>-Tris(6-methyl-2-mercaptopyridinato)cobalt(III) at 150K","Acta Crystallographica Section C","1997","53","2","174","176","10.1107/S0108270196013200","","","0.71073","MoKα","","0.0374","0.0288","","0.0729","0.0678","","","","1.055","1.076","1.076","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005944","7.72","0.001","9.764","0.001","10.643","0.002","90","","106.79","0.01","90","","768","0.2","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","(6S)-8-C-Chloro-6,7,8-trideoxy-1,1:3,4-di-O-isopropylidene-α-D-galacto- oct-6,7-dienopyranose","","- C14 H19 Cl O5 -","- C14 H19 Cl O5 -","- C28 H38 Cl2 O10 -","2","1","NA1258","Horton, D.; Liu, Q.; Luck, R. L.; Silverton, J. V.","(6<i>S</i>)-8-<i>C</i>-Chloro-6,7,8-trideoxy-1,2:3,4-di-<i>O</i>-isopropylidene-α-<small>D</small>-<i>galacto</i>-octa-6,7-dienopyranose","Acta Crystallographica Section C","1997","53","2","236","238","10.1107/S0108270196012851","","","1.54184","copperKα","","","0.045","","","0.053","","","","","1.9","1.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005945","9.736","0.003","11.021","0.004","11.147","0.006","88.07","0.04","65.79","0.03","66.1","0.04","984.7","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","dimethyl syn-(Z)-2-(4-methylphenyl- methylene)-3-(1,5,5-trimethyl-1,3,4,5- tetrahydro-2H-pyrrolidene)-butanedioate","","- C21 H27 N O4 -","- C21 H27 N O4 -","- C42 H54 N2 O8 -","2","1","NA1259","Zellmer, D.; Niewa, R.; Preut, H.; Kreher, R. P.","A Functionalized Dimethyl 1,3-Butadiene-2,3-dicarboxylate","Acta Crystallographica Section C","1997","53","2","251","253","10.1107/S0108270196011420","","","0.71073","MoKα","","0.0735","0.0446","","0.1355","0.1125","","","","1.051","1.146","1.146","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005946","12.506","0.002","9.778","0.002","14.995","0.003","90","","95.43","0.05","90","","1825.4","0.6","295","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C18 H23 N O2 Sn -","- C18 H23 N O2 Sn -","- C72 H92 N4 O8 Sn4 -","4","1","NA1265","Tahir, M. N.; Ülkü, D.; Danish, M.; Ali, S.; Badshah, A.; Mazhar, M.","{2-[(2,3-Dimethylphenyl)amino]benzoato-<i>O</i>:<i>O</i>'}-trimethyltin(IV)","Acta Crystallographica Section C","1997","53","2","183","185","10.1107/S0108270196013157","","","0.71073","MoKα","","","0.021","","","0.029","","","","","1.16","1.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005947","9.034","0.001","10.228","0.001","12.392","0.002","78.71","0.01","71.05","0.01","69.4","0.01","1009.4","0.2","298","","298","","","","","","","","","4","P -1","-P 1","2","","ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)pyridinium-3,5-dicarboxylate nitrate","","- C18 H19 N3 O9 -","- C20 H25 N3 O12 -","- C40 H50 N6 O24 -","2","1","PA1238","Rowan, K. R.; Holt, E. M.","3-Ethoxycarbonyl-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)pyridinium Nitrate, Dineopentyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate and Dihexyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate","Acta Crystallographica Section C","1997","53","2","257","261","10.1107/S010827019601181X","","","0.71073","MoKα","","","0.0579","","","0.1494","","","","","0.898","0.898","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005948","17.736","0.003","6.139","0.001","24.756","0.004","90","","108.46","0.01","90","","2556.8","0.7","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","dineopentyl 2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate","","- C25 H32 N2 O6 -","- C25 H38 N2 O6 -","- C100 H152 N8 O24 -","4","1","PA1238","Rowan, K. R.; Holt, E. M.","3-Ethoxycarbonyl-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)pyridinium Nitrate, Dineopentyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate and Dihexyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate","Acta Crystallographica Section C","1997","53","2","257","261","10.1107/S010827019601181X","","","0.71073","MoKα","","","0.0578","","","0.0654","","","","","1.26","1.26","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005949","8.089","0.002","11.495","0.002","15.707","0.005","69.29","0.02","88.12","0.02","87.03","0.02","1364.1","0.6","298","","298","","","","","","","","","4","P -1","-P 1","2","","dihexyl 2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate","","- C27 H36 N2 O6 -","- C27 H35 N3 O8 -","- C54 H70 N6 O16 -","2","1","PA1238","Rowan, K. R.; Holt, E. M.","3-Ethoxycarbonyl-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)pyridinium Nitrate, Dineopentyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate and Dihexyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate","Acta Crystallographica Section C","1997","53","2","257","261","10.1107/S010827019601181X","","","0.71073","MoKα","","","0.0583","","","0.1267","","","","","0.853","0.853","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005950","5.14","0.002","14.784","0.003","11.941","0.002","90","","97.54","0.05","90","","899.5","0.4","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 Co N2 O14 -","- C14 H16 Co N2 O14 -","- C28 H32 Co2 N4 O28 -","2","0.5","SK1035","Tahir, M. N.; Ülkü, D.; Movsumov, E. M.; Hökelek, T.","Tetraaquabis(<i>p</i>-nitrosalicylato) Complexes of Zinc(II) and Cobalt(II)","Acta Crystallographica Section C","1997","53","2","176","179","10.1107/S0108270196011572","","","0.71073","MoKα","","","0.027","","","0.038","","","","","1.43","1.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005951","5.145","0.003","14.772","0.002","11.936","0.002","90","","97.56","0.04","90","","899.3","0.6","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 N2 O14 Zn -","- C14 H16 N2 O14 Zn -","- C28 H32 N4 O28 Zn2 -","2","0.5","SK1035","Tahir, M. N.; Ülkü, D.; Movsumov, E. M.; Hökelek, T.","Tetraaquabis(<i>p</i>-nitrosalicylato) Complexes of Zinc(II) and Cobalt(II)","Acta Crystallographica Section C","1997","53","2","176","179","10.1107/S0108270196011572","","","0.71073","MoKα","","","0.026","","","0.033","","","","","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005952","16.7","0.001","17.781","0.001","19.708","0.001","90","","90","","90","","5852.1","0.6","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Tetramethylammonium bis(trifluoroacetato)triphenylstannate","","- C26 H27 F6 N O4 Sn -","- C26 H27 F6 N O4 Sn -","- C208 H216 F48 N8 O32 Sn8 -","8","1","SK1049","Ng, S. W.; Kumar Das, V. G.","The First Example of a Discrete Di(carboxylato)triorganostannate: Tetramethylammonium Triphenylbis(trifluoroacetato)stannate","Acta Crystallographica Section C","1997","53","2","212","213","10.1107/S0108270196012292","","","0.71073","MoKα","","0.0853","0.0509","","0.131","0.1168","","","","0.99","1.139","1.139","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005953","8.35","0.002","12.57","0.002","12.945","0.001","90","","92.21","0.01","90","","1357.7","0.4","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","ent-13-acetoxy-2β,3α-dihydroxy-1α-carboxy-10α-phenyl-20-norgibberell-16- ene-7,19-dioic acid 19,2-lactone 1',3-lactone 7-(methyl ester) acetonitrile solvate","","- C31 H33 N O8 -","- C31 H33 N O8 -","- C62 H66 N2 O16 -","2","1","TA1104","Mander, L. N.; Sherburn, M. S.; Willis, A. C.","The Unusual Structure of a C-Arylated Gibberellin Bis-γ-lactone Formed from a Free Radical-Initiated Cyclization","Acta Crystallographica Section C","1997","53","2","223","225","10.1107/S010827019601147X","","","1.5418","CopperKα","","0.053","0.053","","0.073","0.073","","","","2.017","2.017","2.017","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005954","7.163","0.002","37.56","0.01","5.113","0.003","90","","90","","90","","1375.6","1","296.2","","296.2","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1,13-tridecanediol","","","- C13 H28 O2 -","- C13 H28 O2 -","- C52 H112 O8 -","4","1","TA1115","Nakamura, N.; Tanihara, Y.; Takayama, T.","1,13-Tridecanediol","Acta Crystallographica Section C","1997","53","2","253","255","10.1107/S010827019601390X","","","1.5418","CuKα","","0.0755","0.0474","","0.1079","0.0758","","","","1.397","1.102","1.102","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005955","9.828","0.001","19.741","0.002","10.259","0.001","90","","112.573","0.002","90","","1837.9","0.3","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(2,4-dimethyl-5,8-diazadeca-4-ene-2,10-diamine)copper(II) tetrachlorozincate(II)","","- C10 H24 Cl4 Cu N4 Zn -","- C10 H24 Cl4 Cu N4 Zn -","- C40 H96 Cl16 Cu4 N16 Zn4 -","4","1","TA1120","Gladkikh, O. P.; Curtis, N. F.; Heath, S. L.","μ-Chloro-1:2κ^2^<i>Cl</i>-trichloro-2κ^3^<i>Cl</i>-(2,4-dimethyl-5,8-diazadec-4-ene-2,10-diamine-1κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')copper(II)zinc(II)","Acta Crystallographica Section C","1997","53","2","197","200","10.1107/S0108270196013108","","","0.71073","MoKα","","0.0347","0.0283","","0.065","0.0597","","","","1.129","1.142","1.142","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005956","14.935","0.004","12.158","0.006","17.499","0.009","90","","96.3","0.03","90","","3158","2","298","","298","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C12 H38 Mo5 N4 O23 P2 -","- C12 H38 Mo5 N4 O23 P2 -","- C48 H152 Mo20 N16 O92 P8 -","4","1","TA1123","Harrison, W. T. A.; Dussack, L. L.; Jacobson, A. J.","Bis(piperazinium) Pentakis(trioxomolybdo)bis(ethylphosphonate) Dihydrate","Acta Crystallographica Section C","1997","53","2","200","202","10.1107/S0108270196012024","","","0.71073","MoKα","","","0.024","","","0.022","","","","","2.9","2.9","","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2005957","9.339","0.002","18.136","0.003","7.615","0.002","90","","90","","90","","1289.8","0.5","294","","294","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(+)~589~-Λ-amminebromobis(ethylenediamine-N.N')cobalt(III) dibromide","","- C4 H19 Br3 Co N5 -","- C4 H19 Br3 Co N5 -","- C16 H76 Br12 Co4 N20 -","4","1","TA1130","Nakagawa, H.; Ohba, S.; Asakura, K.; Miura, T.; Tanaka, A.; Osanai, S.","(+)~589~-Λ-Amminebromobis(ethylenediamine-<i>N</i>,<i>N</i>')cobalt(III) Dibromide","Acta Crystallographica Section C","1997","53","2","216","217","10.1107/S0108270196013479","","","0.71073","MoKα","","","0.0448","","","0.0324","","","","","1.48","1.48","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005958","11.187","0.001","11.284","0.001","11.5771","0.0008","103.991","0.007","99.233","0.009","106.523","0.008","1317.6","0.2","293","","293","","","","","","","","","6","P -1","-P 1","2","","bis(lithium) tetris(tetramethylammonium) decavandadate dodecahydrate","","- C16 H72 Li2 N4 O40 V10 -","- C16 H72 Li2 N4 O40 V10 -","- C16 H72 Li2 N4 O40 V10 -","1","0.5","TA1131","Zavalij, P. Y.; Chirayil, T.; Whittingham, M. S.; Pecharsky, V. K.; Jacobson, R. A.","A New Decavanadate with Mixed Cations, [Li(H~2~O)~4~]~2~[N(CH~3~)~4~]~4~[V~10~O~28~].4H~2~O","Acta Crystallographica Section C","1997","53","2","170","171","10.1107/S0108270196013480","","","0.71073","MoKα","","","0.052","","","0.058","","","","","1.24","1.24","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005959","7.57","0.003","13.67","0.006","11.56","0.005","90","","102.9","0.04","90","","1166.1","0.9","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H32 Cl6 N2 O6 Pt -","- C12 H32 Cl6 N2 O6 Pt -","- C24 H64 Cl12 N4 O12 Pt2 -","2","0.5","AB1374","Yilmaz, V. T.; İçbudak, H.; Howie, R. A.","Bis[tris(2-hydroxyethyl)ammonium] Hexachloroplatinate(IV)","Acta Crystallographica Section C","1997","53","3","294","296","10.1107/S0108270196011341","","","0.71073","MoKα","","","0.029","","","0.024","","","","","2.02","2.02","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005960","17.75","0.008","18.382","0.01","20.129","0.01","90","","109.31","","90","","6198","5","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","hexacopper(II) bis(hexaphenylsiloxanolate) dimethylformamide solvate","bis(hexa-μ-oxo-cis-2,4,6,8,10,12-hexaphenylsiloxan-2,4,6,8,10,12-olato)- hexa(dimethylformamido-O)hexacopper(II) dimethylformamide solvate,","","- C102 H130 Cu6 N10 O34 Si12 -","- C102 H130 Cu6 N10 O34 Si12 -","- C204 H260 Cu12 N20 O68 Si24 -","2","0.5","AB1396","Lindeman, S. V.; Shchegolikhina, O. I.; Molodtsova, Y. A.; Zhdanov, A. A.","Hexakis(dimethylformamide)bis(hexaphenylcyclohexasiloxanehexaolato)hexacopper(II) Dimethylformamide Solvate","Acta Crystallographica Section C","1997","53","3","305","309","10.1107/S0108270196010761","","","0.71073","MoKα","","0.1454","0.0545","","0.1195","0.0963","","","","1.042","1.175","1.175","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005961","11.7998","0.0012","10.1564","0.0011","19.5352","0.0018","90","","93.41","0.009","90","","2337","0.4","293","1","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H18 Cl2 N2 S2 -","- C26 H18 Cl2 N2 S2 -","- C104 H72 Cl8 N8 S8 -","4","1","AB1401","İde, S.; Öztaş, G.; Ancin, N.; Tüzün, M.","<i>N</i>,<i>N</i>'-Bis(4-chlorobenzylidene)-2,2'-diaminodiphenyl disulfide","Acta Crystallographica Section C","1997","53","3","376","378","10.1107/S0108270196013832","","","0.71073","MoKα","","","0.046","","","0.045","","","","","0.71","0.71","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005962","8.181","0.003","21.02","0.004","17.402","0.001","90","","90","","90","","2992.5","1.2","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","(1R*,3R*,4S*)-4-Tert-Butyldiphenylsilyloxy-6,7-dimethoxy-1- methyl-3-phenyl-1,2,3,4-tetrahydroisoquinoline.","","- C34 H39 N O3 Si -","- C34 H39 N O3 Si -","- C136 H156 N4 O12 Si4 -","4","1","AB1410","Pizarro, J. L.; Arriortua, M. I.; Tellitu, I.; Badía, D.; Domínguez, E.; Ochando, L.; Amigó, J. M.; Debaerdemaeker, T.","(1<i>R</i>*,3<i>R</i>*,4<i>S</i>*)-4-(<i>tert</i>-Butyldiphenylsilyloxy)-6,7-dimethoxy-1-methyl-3-phenyl-1,2,3,4-tetrahydroisoquinoline","Acta Crystallographica Section C","1997","53","3","355","358","10.1107/S0108270196013376","","","0.71069","MoKα","","0.036","0.0305","","0.0925","0.0829","","","","1.121","1.126","1.126","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005963","10.433","0.004","12.538","0.005","13.27","0.005","84.71","0.03","77.78","0.03","78.42","0.03","1659.7","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Trans-Diiodobis(triphenylarsine)platinum(II): Correlation of structural cis effect","","- C36 H30 As2 I2 Pt -","- C36 H30 As2 I2 Pt -","- C72 H60 As4 I4 Pt2 -","2","1","AB1414","Otto, S.; Roodt, A.","<i>trans</i>-Diiodobis(triphenylarsine-<i>As</i>)platinum(II)","Acta Crystallographica Section C","1997","53","3","280","282","10.1107/S0108270196013844","","","0.71073","MoKα","","0.0397","0.0397","","0.1143","0.1143","","","","1.085","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005964","8.6903","0.0012","10.3999","0.0014","11.9025","0.0013","68.481","0.001","71.813","0.001","64.844","0.001","890.1","0.2","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H27 N O5 -","- C18 H27 N O5 -","- C36 H54 N2 O10 -","2","1","AB1416","Özbey, S.; Tunouǧlu, N.","Diethyl 3-(1-Morpholinyl)-2,8-cyclooctadiene-1,2-dicarboxylate","Acta Crystallographica Section C","1997","53","3","380","381","10.1107/S0108270196013091","","","0.71073","MoKα","","","0.0401","","","0.0419","","","","","1.26","1.26","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005965","7.767","0.001","7.882","0.001","17.431","0.003","90","","100.93","0.02","90","","1047.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-acetylpyridine thiosemicarbazone hydrochloride","","- C8 H11 Cl N4 S -","- C8 H11 Cl N4 S -","- C32 H44 Cl4 N16 S4 -","4","1","AB1422","Abram, S.; Abram, U.","2-[1-(Thiosemicarbazono)ethyl]pyridinium Chloride","Acta Crystallographica Section C","1997","53","3","360","362","10.1107/S0108270196014114","","","0.71073","MoKα","","0.0714","0.0381","","0.1032","0.0892","","","","1.121","1.156","1.156","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005966","14.861","0.003","3.98","0.005","11.926","0.002","90","","93.21","0.02","90","","704.3","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2-amino-6-fluorobenzothiazole","2-Amino-6-fluorobenzothiazole","","- C7 H5 F N2 S -","- C7 H5 F N2 S -","- C28 H20 F4 N8 S4 -","4","1","BK1164","Jai-nhuknan, J.; Karipides, A. G.; Hughes, J. M.; Cantrell, J. S.","2-Amino-6-fluorobenzothiazole","Acta Crystallographica Section C","1997","53","3","381","383","10.1107/S0108270196014369","","","0.71069","MoKα","","0.0414","0.035","","0.111","0.1053","","","","0.93","0.948","0.948","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005967","7.721","0.004","8.695","0.002","11.347","0.009","83.09","0.04","79.79","0.06","81.38","0.02","737.8","0.7","293","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H15 N O4 S -","- C16 H15 N O4 S -","- C32 H30 N2 O8 S2 -","2","1","BK1261","Kumaradhas, P.; Nirmala, K. A.","(±)-<i>trans</i>-3-Hydroxy-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine 1-Oxide","Acta Crystallographica Section C","1997","53","3","315","318","10.1107/S0108270196011845","","","1.5418","CuKα","","","0.058","","","0.14","","","","","1.26","1.26","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005968","12.05","0.006","5.612","0.002","23.795","0.004","90","","102.46","0.02","90","","1571.2","1","294","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 N O4 S -","- C16 H17 N O4 S -","- C64 H68 N4 O16 S4 -","4","1","BK1267","Kumaradhas, P.; Nirmala, K. A.","(±)-2-[Hydroxy(4-methoxyphenyl)methyl]-2<i>H</i>-1,4-benzothiazin-3(4<i>H</i>)-one Hydrate","Acta Crystallographica Section C","1997","53","3","313","315","10.1107/S0108270196011857","","","0.7093","MoKα","","","0.05","","","0.094","","","","","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005969","10.788","0.002","13.754","0.004","19.164","0.005","79.13","0.02","81.39","0.02","69.45","0.02","2604","1.2","298","","","","","","","","","","","6","P -1","-P 1","2","","","","- C58 H46 I O4 Os2 P3 -","- C66 H40 I O4 Os2 P3 -","- C132 H80 I2 O8 Os4 P6 -","2","1","BK1268","Herlinger, A. W.; Rheingold, A. L.","Tetracarbonyl-1κ^2^<i>C</i>,2κ^2^<i>C</i>-μ-diphenylphosphido-<i>P</i>:<i>P</i>-μ-iodo-bis(triphenylphosphine)-1κ<i>P</i>,2κ<i>P</i>-diosmium(<i>Os</i>—<i>Os</i>) Benzene Solvate","Acta Crystallographica Section C","1997","53","3","285","287","10.1107/S0108270196013911","","","0.71073","MoKα","","","0.029","","","0.032","","","","","1","1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005970","14.0117","0.0011","8.0111","0.0005","21.6959","0.0011","90","","99.123","0.005","90","","2404.5","0.3","296","","296","","","","","","","","","4","P 1 2 1","P 2y","3","","N-methyl-3α,7α,12α-Trihydroxy-5β-cholan-24-amide Quarterhydrate","","- C25 H43.5 N O4.25 -","- C25 H43.5 N O4.25 -","- C100 H174 N4 O17 -","4","2","BK1286","Wahle, M. C.; Byrn, S. R.","Hydrated Structures of <i>N</i>-Methylated Cholamide Derivatives","Acta Crystallographica Section C","1997","53","3","334","339","10.1107/S0108270196013145","","","1.54184","CuKα","","0.07","0.044","","0.135","0.11","","","","1.075","1.011","1.011","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005971","16.8089","0.0009","38.7649","0.001","7.887","0.005","90","","90","","90","","5139","3","297","","297","","","","","","","","","4","P 21 21 2","P 2 2ab","18","","N-methyl-3α,7α,12α-Trihydroxy-5β-cholan-24-amide Sesquihydrate","","- C25 H46 N O5.5 -","- C25 H46 N O5.5 -","- C200 H368 N8 O44 -","8","2","BK1286","Wahle, M. C.; Byrn, S. R.","Hydrated Structures of <i>N</i>-Methylated Cholamide Derivatives","Acta Crystallographica Section C","1997","53","3","334","339","10.1107/S0108270196013145","","","1.54184","CuKα","","0.165","0.065","","0.237","0.165","","","","1.2","1.224","1.224","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005972","16.565","0.003","39.504","0.004","7.824","0.008","90","","90","","90","","5120","5","297","","297","","","","","","","","","4","P 21 21 2","P 2 2ab","18","","N,N-dimethyl-3α,7α,12α-Trihydroxy-5β-cholan-24-amide Hemihydrate","","- C26 H49 N O5.5 -","- C26 H46 N O4.5 -","- C208 H368 N8 O36 -","8","2","BK1286","Wahle, M. C.; Byrn, S. R.","Hydrated Structures of <i>N</i>-Methylated Cholamide Derivatives","Acta Crystallographica Section C","1997","53","3","334","339","10.1107/S0108270196013145","","","1.54184","CuKα","","0.233","0.07","","0.256","0.163","","","","1.057","1.236","1.236","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005973","7.371","0.0007","11.1271","0.0016","19.191","0.0016","90","","99.725","0.008","90","","1551.4","0.3","287","","287","","","","","","","","","3","P 1 21 1","P 2yb","4","","succinyl oleanolic acid","","- C34 H52 O6 -","- C34 H52 O6 -","- C68 H104 O12 -","2","1","BK1288","Yang, J.; Quail, J. W.; Jia, Z.","Succinyl Oleanolic Acid","Acta Crystallographica Section C","1997","53","3","349","351","10.1107/S0108270196013923","","","0.7093","MolybdenumKα","","0.06","0.047","","0.053","0.05","","","","","1.71","1.71","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005974","7.908","0.001","7.908","0.001","15.15","0.002","90","","90","","90","","947.4","0.2","296","2","296","2","","","","","","","","3","P 41","P 4w","76","(-)-anti-Isoketopinic acid","(-)-2-oxo-1,7-dimethylbicyclo[2.2.1]heptane-7-anti-carboxylic acid","","- C10 H14 O3 -","- C10 H14 O3 -","- C40 H56 O12 -","4","1","BK1292","Lalancette, R. A.; Coté, M. L.; Thompson, H. W.","Hydrogen-Bonding Pattern of a Bicyclic γ-Keto Acid: ({-})-<i>anti</i>-Isoketopinic Acid","Acta Crystallographica Section C","1997","53","3","370","372","10.1107/S0108270196013959","","","0.71073","MoKα","","0.0718","0.051","","0.122","0.1137","","","","0.94","1.047","1.047","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005975","7.737","0.001","12.249","0.001","12.247","0.001","90","","94.17","0.01","90","","1157.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","1","BM1068","Elerman, Y.; Kabak, M.","2-(3-Methoxy-2-hydroxyphenyl)benzimidazole","Acta Crystallographica Section C","1997","53","3","372","374","10.1107/S0108270196013972","","","0.71073","MoKα","","0.079","0.058","","0.152","0.145","","","","1.099","1.198","1.198","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005976","12.151","0.001","9.846","0.001","10.642","0.001","90","","107.14","0.04","90","","1216.6","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H29 N O10 -","- C23 H29 N O10 -","- C46 H58 N2 O20 -","2","1","BM1091","Jesús Diánez, M.; Estrada, M. D.; López-Castro, A.; Pérez-Garrido, S.","<i>N</i>-Acetyl-2,3,4,6-tetra-<i>O</i>-acetyl-<i>N</i>-benzyl-β-<small>D</small>-glucopyranosylamine","Acta Crystallographica Section C","1997","53","3","378","379","10.1107/S0108270196014230","","","0.7107","MoKα","","0.0646","0.0485","","0.1568","0.1275","","","","1.094","1.035","1.035","","","","","has coordinates,has disorder","201955","2020-10-21","18:00:00",""
"2005977","8.145","0.004","16.375","0.005","17.274","0.004","90","","92.26","0.03","90","","2302.1","1.4","153","","153","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H11 N O3 S -","- C11 H11 N O3 S -","- C88 H88 N8 O24 S8 -","8","2","BM1104","Barkley, J. V.; Cristiano, M. L. S.; Johnstone, R. A. W.; Loureiro, R. M. S.","3-(<i>E</i>)-But-2-enoxy-1,2-benzisothiazole 1,1-Dioxide: Unusual C—O—C Ether Bond Lengths and Reactivity","Acta Crystallographica Section C","1997","53","3","383","386","10.1107/S0108270196014151","","","0.71073","MoKα","","","0.0569","","","0.0623","","","","","1.81","1.81","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005978","6.8753","0.001","6.8753","0.001","9.419","0.002","90","","90","","90","","445.23","0.13","293","2","293","2","","","","","","","","3","P 4/n b m :2","-P 4a 2b","125","Caesium-gadolinium-tetratelluride","","","- Cs Gd Te4 -","- Cs Gd Te4 -","- Cs2 Gd2 Te8 -","2","0.125","BR1154","Bensch, W.; Dürichen, P.","Caesium Gadolinium Tetratelluride","Acta Crystallographica Section C","1997","53","3","267","269","10.1107/S0108270196012309","","","0.71073","MoKα","","0.0372","0.0209","","0.0415","0.038","","","","1.007","1.099","1.099","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005979","11.715","0.004","5.8","0.002","24.694","0.009","90","","102.1","0.03","90","","1640.6","1","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Lead - dodecabismuth - pentamolybdenum - oxide","","- Bi12 Mo5 O34 Pb -","- Bi12 Mo5 O34 Pb -","- Bi24 Mo10 O68 Pb2 -","2","0.5","BR1164","Enjalbert, R.; Hasselmann, G.; Galy, J.","A New Mixed Oxide with (Bi~12~O~14~)~<i>n~</i> Columns: PbBi~12~Mo~5~O~34~","Acta Crystallographica Section C","1997","53","3","269","272","10.1107/S0108270196013698","","","0.71069","MoKα","","0.0673","0.0643","","0.1675","0.164","","","","0.904","0.9","0.9","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005980","8.084","0.004","8.389","0.003","10.216","0.003","96.04","0.03","92.73","0.03","115.9","0.04","616.4","0.5","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H12 N4 O3 S -","- C11 H12 N4 O3 S -","- C22 H24 N8 O6 S2 -","2","1","CF1099","Zhang, Q.; Li, S.; Wang, L.; Liu, J.; Huang, X.","2-Amino-5-methyl-10b<i>H</i>-1,3,4-thiadiazolo[3,2-<i>c</i>]quinazolin-6-ium-10b-carboxylate Hydrate","Acta Crystallographica Section C","1997","53","3","325","327","10.1107/S0108270196013935","","","0.71073","MoKα","","","0.038","","","0.05","","","","","1.44","1.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005981","13.991","0.001","5.748","0.001","21.569","0.002","90","","90.619","0.008","90","","1734.5","0.4","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 N3 S -","- C21 H17 N3 S -","- C84 H68 N12 S4 -","4","1","CF1106","Jing, L.; He-Liang, F.; Jie, S.; Wei-Xing, C.","3-Anilino-<i>N</i>-phenyl-1<i>H</i>-indole-2-carbothioamide","Acta Crystallographica Section C","1997","53","3","320","322","10.1107/S0108270196012668","","","0.71069","MoKα","","","0.034","","","0.04","","","","","1.38","1.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005982","19.186","0.0006","6.4523","0.0004","20.9867","0.0006","90","0.2","118.69","0.02","90","0.2","2279.1","0.5","294","","294","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C112 H104 N8 O16 -","8","1","CF1111","Chatel, F.; Boyer, G.; Galy, J. P.","5-(<i>p</i>-Tolylamino)benzo-1,3-dioxole","Acta Crystallographica Section C","1997","53","3","391","393","10.1107/S010827019601267X","","","0.71073","MoKα","","0.079","0.038","","","0.048","","","","","1.725","1.725","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2005983","9.095","0.003","9.16","0.003","8.189","0.002","101.9","0.02","101.54","0.02","59.34","0.02","570.6","0.3","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H10 N2 O2 -","- C14 H10 N2 O2 -","- C28 H20 N4 O4 -","2","1","CF1120","Kakehi, A.; Kitajima, K.; Ito, S.; Matsubara, K.","A 2<i>H</i>-Pyrano[3,2-<i>a</i>]indolizine Derivative","Acta Crystallographica Section C","1997","53","3","353","355","10.1107/S0108270196012644","","","0.71069","MoKα","","","0.039","","","0.048","","","","","1.84","1.84","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005984","4.683","0.001","10.482","0.002","22.529","0.005","90","","90","","90","","1105.9","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,3-bis(p-fluorophenyl)-triazene","","- C12 H9 F2 N3 -","- C12 H9 F2 N3 -","- C48 H36 F8 N12 -","4","1","CF1138","Anulewicz, R.","1,3-Bis(<i>p</i>-fluorophenyl)triazene","Acta Crystallographica Section C","1997","53","3","345","346","10.1107/S0108270196013881","","","1.54178","CuKα","","0.0667","0.0466","","0.1376","0.1207","","","","1.013","1.1","1.1","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005985","13.735","0.003","16.082","0.006","14.255","0.004","90","","90","","90","","3148.7","1.6","296","","","","","","","","","","","7","P b c a","-P 2ac 2ab","","","","","- C8 H17 Cl Cu N6 O4 S -","- C7 H17 Cl Cu N7 O8 S -","- C56 H136 Cl8 Cu8 N56 O64 S8 -","8","1","CF1139","Hu, H.-M.; Sun, H.-S.; Chen, X.-H.; Zhao, Q.; Pan, Y.; Huang, X.-Y.; You, X.-Z.","(Diethylenetriamine)(imidazole)(thiocyanato)copper(II) Perchlorate","Acta Crystallographica Section C","1997","53","3","276","278","10.1107/S0108270196013893","","","0.71073","MoKα","","","0.041","","","0.056","","","","","1.77","1.77","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005986","8.995","0.006","9.748","0.007","14.655","0.011","97.39","0.05","99.85","0.05","113.16","0.03","1136.5","1.5","150","0.2","150","0.2","","","","","","","","6","P -1","-P 1","2","","4,4'-Dimethylbipyridine-bis(6-chloro-2-pyridonato)zinc hydrate","","- C22 H20 Cl2 N4 O3 Zn -","- C22 H20 Cl2 N4 O3 Zn -","- C44 H40 Cl4 N8 O6 Zn2 -","2","1","CF1147","Mowat, C. G.; Parsons, S.; Solan, G. A.; Winpenny, R. E. P.","Bis(6-chloro-2-pyridonato-<i>N</i>,<i>O</i>)(4,4'-dimethyl-2,2'-bipyridine-<i>N</i>,<i>N</i>')zinc(II) Hydrate at 150 K","Acta Crystallographica Section C","1997","53","3","282","283","10.1107/S0108270196013868","","","0.71073","MoKα","","0.0691","0.0443","","0.1086","0.0962","","","","1.031","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005987","8.557","0.004","9.064","0.002","10.961","0.003","66.83","0.01","75.36","0.03","62.05","0.02","688","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N,N,N',N'-Tetrametylethylendiammonium Cyclotetraphosphate Tetrahydrate","","- C12 H44 N4 O16 P4 -","- C12 H44 N4 O16 P4 -","- C12 H44 N4 O16 P4 -","1","0.5","DU1166","Thabet, H.; Jouini, A.; El Hassane, S.","Bis(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediammonium) Cyclotetraphosphate Tetrahydrate","Acta Crystallographica Section C","1997","53","3","318","320","10.1107/S0108270196012139","","","0.71069","MoKα","","0.0502","0.0413","","0.1165","0.1048","","","","1.189","1.143","1.143","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005988","12.092","0.004","20.54","0.002","7.772","0.002","90","","90","","90","","1930.3","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-(exo-mercapto)-2'-thioxo-(1R, 1R')-3-(exo),3'-(exo)-bibornanyl","","- C20 H32 S2 -","- C20 H32 S2 -","- C80 H128 S8 -","4","1","FG1199","Kwiatkowski, W.; Cameron, T. S.; Salama, P.; Poirier, M.","(1<i>R</i>,1<i>R</i>')-2-<i>exo</i>-Mercapto-2'-thioxo-3-<i>exo</i>,3'-<i>exo</i>-bibornane, 2-Dehydro-2,2'-<i>exo</i>-epidithio-3,3'-bibornane and 2-<i>endo</i>,2'-<i>exo</i>-Epidithio-3,3'-bibornanylidene. Potential Antiviral Agents","Acta Crystallographica Section C","1997","53","3","387","391","10.1107/S0108270196012085","","","1.54178","CuKα","","0.0359","0.0314","","0.084","0.0816","","","","1.026","1.035","1.035","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005989","11.353","0.004","22.289","0.002","7.468","0.001","90","","90","","90","","1889.8","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-dehydro-2,2'-(exo)-epidithio-3,3'-bibornane","","- C20 H30 S2 -","- C20 H30 S2 -","- C80 H120 S8 -","4","1","FG1199","Kwiatkowski, W.; Cameron, T. S.; Salama, P.; Poirier, M.","(1<i>R</i>,1<i>R</i>')-2-<i>exo</i>-Mercapto-2'-thioxo-3-<i>exo</i>,3'-<i>exo</i>-bibornane, 2-Dehydro-2,2'-<i>exo</i>-epidithio-3,3'-bibornane and 2-<i>endo</i>,2'-<i>exo</i>-Epidithio-3,3'-bibornanylidene. Potential Antiviral Agents","Acta Crystallographica Section C","1997","53","3","387","391","10.1107/S0108270196012085","","","1.54178","CuKα","","0.0323","0.0297","","0.0787","0.0773","","","","1.055","1.061","1.061","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005990","12.335","0.001","21.044","0.002","7.293","0.002","90","","90","","90","","1893.1","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-(endo),2'-(exo)-epidithio-3,3'-bibornanylidene","","- C20 H30 S2 -","- C20 H30 S2 -","- C80 H120 S8 -","4","1","FG1199","Kwiatkowski, W.; Cameron, T. S.; Salama, P.; Poirier, M.","(1<i>R</i>,1<i>R</i>')-2-<i>exo</i>-Mercapto-2'-thioxo-3-<i>exo</i>,3'-<i>exo</i>-bibornane, 2-Dehydro-2,2'-<i>exo</i>-epidithio-3,3'-bibornane and 2-<i>endo</i>,2'-<i>exo</i>-Epidithio-3,3'-bibornanylidene. Potential Antiviral Agents","Acta Crystallographica Section C","1997","53","3","387","391","10.1107/S0108270196012085","","","1.54178","CuKα","","0.1127","0.0536","","0.1494","0.1254","","","","1","1.034","1.034","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005991","10.476","0.001","19.543","0.003","20.69","0.003","74.32","0.07","89.44","0.07","81.22","0.06","4028.3","1.8","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","Chlorobis(dimethylphenylphosphine){bis(thiodiphenylphosphino)amido-S,S'}- nitridorhenium(V)","","- C40 H42 Cl N2 P4 Re S2 -","- C40 H42 Cl N2 P4 Re S2 -","- C160 H168 Cl4 N8 P16 Re4 S8 -","4","2","FR1002","Abram, U.; Schulz Lang, E.; Dilworth, J. R.","[Bis(thiodiphenylphosphino-<i>S</i>)amido]chlorobis(dimethylphenylphosphine-<i>P</i>)nitridorhenium(V)","Acta Crystallographica Section C","1997","53","3","289","292","10.1107/S0108270196013790","","","0.71073","MoKα","","0.0812","0.044","","0.1045","0.0846","","","","1.122","1.087","1.087","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005992","10.32","0.004","17.062","0.008","21.803","0.001","90","","90.28","0.02","90","","3839","2","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","acetonitrile(η^5^-cyclopentadienyl)bis(triphenylphosphine) ruthenium(II) tetrafluoroborate","","- C43 H38 B F4 N P2 Ru -","- C43 H38 B F4 N P2 Ru -","- C172 H152 B4 F16 N4 P8 Ru4 -","4","1","FR1009","Carreón, O. Y.; Leyva, M. A.; Fernández-G., J. M.; Pénicaud, A.","(Acetonitrile-<i>N</i>)(η^5^-cyclopentadienyl)bis(triphenylphosphine-<i>P</i>)ruthenium(II) Tetrafluoroborate","Acta Crystallographica Section C","1997","53","3","301","302","10.1107/S0108270196013674","","","0.71069","MoKα","","","0.0399","","","0.0489","","","","","1.065","1.065","","","","","has coordinates","207077","2020-10-21","18:00:00",""
"2005993","15.096","0.003","15.381","0.003","13.373","0.003","90","","116.431","0.015","90","","2780.5","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","imidazole-4-acetic acid picric acid","","- C11 H9 N5 O9 -","- C11 H9 N5 O9 -","- C88 H72 N40 O72 -","8","1","FR1010","In, Y.; Nagata, H.; Doi, M.; Ishida, T.; Wakahara, A.","Imidazole-4-acetic Acid‒Picric Acid (1/1) Complex","Acta Crystallographica Section C","1997","53","3","367","369","10.1107/S0108270196012899","","","1.5418","CuKα","","0.0634","0.0447","","0.1761","0.1375","","","","0.986","1.002","1.002","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005994","8.472","0.002","7.107","0.002","6.533","0.002","90","","99.84","0.02","90","","387.57","0.19","299","","296.2","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C6 H11 N O S -","- C3 H8.5 N0.5 O0.5 S0.5 -","- C6 H17 N O S -","2","0.5","FR1014","Honda, K.; Tsuchiya, T.","3-Hydroxy-<i>N</i>,<i>N</i>-dimethyl-2-butenethioamide","Acta Crystallographica Section C","1997","53","3","374","376","10.1107/S0108270196013686","","","0.7107","MoKα","","0","0.053","","0","0.058","","","","0","1.29","1.29","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2005995","10.154","0.001","10.923","0.001","16.698","0.002","90","","90","","90","","1852","0.3","295.2","","295.2","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H30 O3 -","- C20 H30 O3 -","- C80 H120 O12 -","4","1","HA1168","Rodríguez, A. D.; González, E.; Huang, S. D.","Euniciniatin","Acta Crystallographica Section C","1997","53","3","311","313","10.1107/S010827019601308X","","","0.7107","MoKα","","","0.0585","","","0.0672","","","","","1.584","1.584","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005996","10.952","0.001","19.853","0.002","10.496","0.001","90","","111.45","0.01","90","","2124.1","0.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-Methyl-4-(2-(4-hydroxy-3-methoxy phenyl)vinyl) pyridium 4-tolylsulfonate hydrate","","- C22 H25 N O6 S -","- C22 H25 N O6 S -","- C88 H100 N4 O24 S4 -","4","1","HA1173","Zhang, D.-C.; Zhang, T.-Z.; Zhang, Y.-Q.; Fei, Z.-H.; Yu, K.-B.","4'-Hydroxy-3'-methoxy-<i>N</i>-methyl-4-stilbazolium Tosylate Hydrate, C~15~H~16~NO~2~^+^.C~7~H~7~O~3~S^{-^}.H~2~O","Acta Crystallographica Section C","1997","53","3","364","365","10.1107/S010827019601414X","","","0.71073","MoKα","","0.0673","0.0399","","0.1048","0.0975","","","","0.902","1.081","1.081","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2005997","23.024","0.003","13.343","0.003","23.035","0.003","90","","107","0.03","90","","6767","2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H6 O6 Sr -","- C10 H6 O6 Sr -","- C240 H144 O144 Sr24 -","24","6","JZ1136","Paluchowska, B.; Maurin, J. K.; Leciejewicz, J.","Hetero-Ring Oxygen Coordination to Strontium in Strontium Bis(2-furancarboxylate)","Acta Crystallographica Section C","1997","53","3","287","289","10.1107/S0108270196011018","","","0.71073","MoKα","","0.1599","0.0457","","0.1408","0.1162","","","","0.885","1.5","1.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005998","6.2976","0.0007","10.0596","0.0014","12.8122","0.0011","90","","93.316","0.008","90","","810.31","0.16","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaqua-bis(pyridine-2-carboxamide-N',O)copper(II) Dichloride","","- C12 H16 Cl2 Cu N4 O4 -","- C12 H16 Cl2 Cu N4 O4 -","- C24 H32 Cl4 Cu2 N8 O8 -","2","0.5","JZ1151","Sieroń, L.; Bukowska-Strżyzewska, M.","<i>trans</i>-Diaquabis(pyridine-2-carboxamide-<i>N</i>^1^,<i>O</i>)copper(II) Dichloride and Dibromide","Acta Crystallographica Section C","1997","53","3","296","298","10.1107/S0108270196013364","","","0.71073","MoKα","","0.0255","0.0234","","0.0666","0.0655","","","","1.102","1.129","1.129","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2005999","6.3722","0.0006","10.2962","0.0008","13.1279","0.0014","90","","94.4","0.008","90","","858.78","0.14","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaqua-bis(pyridine-2-carboxamide-N',O)copper(II) Dibromide","","- C12 H16 Br2 Cu N4 O4 -","- C12 H16 Br2 Cu N4 O4 -","- C24 H32 Br4 Cu2 N8 O8 -","2","0.5","JZ1151","Sieroń, L.; Bukowska-Strżyzewska, M.","<i>trans</i>-Diaquabis(pyridine-2-carboxamide-<i>N</i>^1^,<i>O</i>)copper(II) Dichloride and Dibromide","Acta Crystallographica Section C","1997","53","3","296","298","10.1107/S0108270196013364","","","0.71073","MoKα","","0.0334","0.0286","","0.0767","0.0746","","","","1.097","1.138","1.138","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006000","9.543","0.004","10.176","0.002","11.34","0.003","84.56","0.02","113.62","0.03","114.04","0.02","918.4","0.6","296","","296","","","","","","","","","4","P -1","-P 1","2","","1,4-bis(trimethylindium)-1,4-dibenzylpiperazine","","- C36 H52 In2 N2 -","- C36 H52 In2 N2 -","- C36 H52 In2 N2 -","1","0.5","KH1102","Ma, X.; Pan, Y.; Wu, L.; Huang, X.; Sun, H.; Zhu, C.","[μ-(1,4-Dibenzylpiperazine)-<i>N</i>:<i>N</i>']bis(trimethylindium) Dibenzene Solvate","Acta Crystallographica Section C","1997","53","3","278","279","10.1107/S0108270196013169","","","0.71073","MoKα","","","0.052","","","0.063","","","","","1.94","1.94","","","","","has coordinates","190398","2020-10-21","18:00:00",""
"2006001","10.471","0.003","14.347","0.002","13.29","0.003","90","","111.65","0.02","90","","1855.7","0.8","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H17 Cu N3 O5 -","- C20 H17 Cu N3 O5 -","- C80 H68 Cu4 N12 O20 -","4","1","KH1108","Zhang, L.; Xu, D.; Xu, Y.; Gu, J.","(Benzoylacetonato-<i>O</i>,<i>O</i>')(2,2'-bipyridine-<i>N</i>,<i>N</i>')(nitrato-<i>O</i>)copper(II)","Acta Crystallographica Section C","1997","53","3","299","301","10.1107/S0108270196012358","","","0.71073","MoKα","","","0.043","","","0.049","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006002","7.921","0.013","11.786","0.026","14.714","0.01","90","","90","","90","","1374","4","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","1,4 butane diammonium malonate","","- C10 H20 N2 O8 -","- C10 H20 N2 O8 -","- C40 H80 N8 O32 -","4","0.5","KH1123","Babu, A. M.; Weakley, T. J. R.; Murthy, M. R. N.","Extended Conformation of Putrescine Occurring on a Center of Symmetry in its 1:2 Complex with Malonic Acid","Acta Crystallographica Section C","1997","53","3","365","367","10.1107/S010827019601342X","","","0.71073","MoKα","","0.0453","0.0445","","0.1199","0.1185","","","","0.556","0.561","0.561","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006003","10.9126","0.0005","11.5192","0.0006","14.182","0.001","94.715","0.005","97.083","0.005","96.918","0.004","1747.71","0.18","298","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(N,N-dimethyldithiocarbamyl)acetato(quinolinolato)triphenyltin","","- C35 H35 N3 O3 S4 Sn -","- C35 H35 N3 O3 S4 Sn -","- C70 H70 N6 O6 S8 Sn2 -","2","1","KH1133","Ng, S. W.","[Bis(<i>N</i>,<i>N</i>-dimethylthiocarbamoylthio)acetato-<i>O</i>]triphenyl(quinoline <i>N</i>-oxide-<i>O</i>)tin","Acta Crystallographica Section C","1997","53","3","274","276","10.1107/S0108270196013704","","","0.71073","MoKα","","0.06","0.053","","0.154","0.1467","","","","1.031","1.054","1.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006004","10.035","0.004","11.09","0.008","12.325","0.004","65.28","0.09","70.5","0.03","70.37","0.05","1143.2","1.3","163","2","163","2","","","","","","","","4","P -1","-P 1","2","","Tetra-p-chlorophenyltin","","- C24 H16 Cl4 Sn -","- C24 H16 Cl4 Sn -","- C48 H32 Cl8 Sn2 -","2","1","KH1137","Ng, S. W.","Tetra(<i>p</i>-chlorophenyl)tin","Acta Crystallographica Section C","1997","53","3","273","274","10.1107/S0108270196013716","","","0.71073","MoKα","","0.0361","0.0288","","0.0787","0.0708","","","","1.068","1.067","1.067","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006005","10.005","0.003","17.535","0.003","16.509","0.002","90","","90","","90","","2896.3","1.1","293","","293","","","","","","","","","3","P b c a","","","","2,2-dimethyl-2,3-dihydro-1H-2-silacyclopent[l]phenanthrene","","- C18 H18 Si -","- C18 H18 Si -","- C144 H144 Si8 -","8","1","MU1274","Wagner, T.; Marx, H.-W.; Moss, S.","2,2-Dimethyl-2,3-dihydro-1<i>H</i>-2-silacyclopenta[<i>l</i>]phenanthrene","Acta Crystallographica Section C","1997","53","3","344","345","10.1107/S0108270196013315","","","1.54184","CuKα","","","0.04","","","0.059","","","","","2.203","2.203","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006006","6.283","0.001","26.437","0.002","8.1851","0.0009","90","","96.54","0.01","90","","1350.7","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","bis(p-methoxyphenyl)telluride","","- C14 H14 O2 Te -","- C14 H14 O2 Te -","- C56 H56 O8 Te4 -","4","1","MU1290","Farran, J.; Alvarez-Larena, A.; Piniella, J. F.; Capparelli, M. V.; Torres-Castellanos, L.","Bis(<i>p</i>-methoxyphenyl) Telluride","Acta Crystallographica Section C","1997","53","3","342","343","10.1107/S0108270196013194","","","0.71069","MoKα","","0.0359","0.025","","0.0688","0.0659","","","","1.084","1.158","1.158","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006007","9.573","0.004","20.857","0.006","20.467","0.007","90","","95.86","0.03","90","","4065","2","295","","295","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H66 N2 Ni O8 P2 -","- C36 H66 N2 Ni O8 P2 -","- C144 H264 N8 Ni4 O32 P8 -","4","1","MU1297","Kennedy, A. R.; Sloss, S. W.; Spicer, M. D.","<i>cis</i>-Di(nitrato-<i>O</i>,<i>O</i>')bis(tricyclohexylphosphine oxide-<i>O</i>)nickel(II)","Acta Crystallographica Section C","1997","53","3","292","293","10.1107/S0108270196014229","","","0.71069","MoKα","","0.1309","0.0416","","0.0567","0.0463","","","","","1.452","1.452","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006008","17.812","0.002","8.2826","0.0011","19.064","0.004","90","","99.878","0.014","90","","2770.8","0.8","293","2","293","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","meso-1.11-dimethylcyclotrideca-2.9-diyne-1.11-diol","","- C15 H22 O2 -","- C15 H22 O2 -","- C120 H176 O16 -","8","1","NA1269","Boss, C.; Stoeckli-Evans, H.; Keese, R.","<i>meso</i>-1,11-Dimethylcyclotrideca-2,9-diyne-1,11-diol","Acta Crystallographica Section C","1997","53","3","322","325","10.1107/S0108270196013789","","","0.71073","MoKα","","0.1315","0.0739","","0.1908","0.1482","","","","1.109","1.182","1.182","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006009","17.779","0.002","8.238","0.001","18.881","0.003","90","","99.92","0.01","90","","2724","0.6","193","2","193","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","meso-1.11-dimethylcyclotrideca-2.9-diyne-1.11-diol","","- C15 H22 O2 -","- C15 H22 O2 -","- C120 H176 O16 -","8","1","NA1269","Boss, C.; Stoeckli-Evans, H.; Keese, R.","<i>meso</i>-1,11-Dimethylcyclotrideca-2,9-diyne-1,11-diol","Acta Crystallographica Section C","1997","53","3","322","325","10.1107/S0108270196013789","","","0.71073","MoKα","","0.127","0.0723","","0.1997","0.1467","","","","1.159","1.128","1.128","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006010","8.1524","0.0008","9.3328","0.0004","11.4597","0.0006","66.924","0.004","78.185","0.006","83.396","0.005","784.56","0.1","293","","","","","","","","","","","5","P -1","-P 1","2","","N-bezenesulfonyl-3-methylbenz[f]indole","","- C19 H15 N O2 S -","- C19 H15 N O2 S -","- C38 H30 N2 O4 S2 -","2","1","NA1271","Yokum, T. S.; Fronczek, F. R.","<i>N</i>-Phenylsulfonyl-3-methylbenz[<i>f</i>]indole","Acta Crystallographica Section C","1997","53","3","362","363","10.1107/S0108270196014187","","","1.54184","CuKα","","","0.037","","","0.056","","","","","1.572","1.572","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2006011","9.269","0.002","6.459","0.002","13.989","0.002","90","","106.43","0.02","90","","803.3","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3α,4α-epoxy-5α-androstan-17-one","","- C19 H28 O2 -","- C19 H28 O2 -","- C38 H56 O4 -","2","1","NA1273","Paixão, J. A.; Ramos Silva, M.; de Almeida, M. J.; Tavares da Silva, E. J.; Sá e Melo, M. L.; Campos Neves, A. S.","3α,4α-Epoxy-5α-androstan-17-one","Acta Crystallographica Section C","1997","53","3","347","349","10.1107/S0108270196014394","","","0.7093","MoKα","","0.0576","0.0348","","0.1036","0.0891","","","","1.004","1","1","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006012","13.636","0.002","12.597","0.002","13.794","0.001","90","","97.875","0.009","90","","2347.1","0.5","296.2","","296.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","fluorescein sodium","sodium 2-(3-oxo-sodioxy-3H-xanthen-9-yl)benzoate","","- C20 H26 Na2 O13 -","- C20 H26 Na2 O13 -","- C80 H104 Na8 O52 -","4","1","OA1007","Yamaguchi, K.; Tamura, Z.; Maeda, M.","Disodium Fluorescein Octahydrate","Acta Crystallographica Section C","1997","53","3","284","285","10.1107/S0108270196010487","","","1.5418","CuKα","","","0.0637","","","0.0777","","","","","2.114","2.114","","","","","has coordinates","199684","2020-10-21","18:00:00",""
"2006013","8.137","0.002","12.363","0.002","10.537","0.002","90","0.02","98.77","0.02","90","0.02","1047.6","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H23 Cl O6 Si -","- C20 H23 Cl O6 Si -","- C40 H46 Cl2 O12 Si2 -","2","1","OA1012","White, J. M.; Riches, A. G.; Cameron, D. W.; Griffiths, P. G.","(1α,4aβ,9aβ)-4a-Acetoxy-9a-chloro-1-methoxy-3-trimethylsiloxy-1,4,4a,9,9a,10-hexahydroanthracene-9,10-dione","Acta Crystallographica Section C","1997","53","3","386","387","10.1107/S0108270196013595","","","1.5418","CuKα(Nifiltered)","","0.0438","0.0397","","0.1046","0.0977","","","","1.235","1.196","1.196","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006014","11.813","0.002","6.41","0.002","30.552","0.004","90","","91.58","0.01","90","","2312.6","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Substituted βeta\-lactam","N-(1'-thiophenyl)benzyl-3-phenyl-4-phenoxy-azetidine-2-one","","- C28 H23 N O2 S -","- C28 H23 N O2 S -","- C112 H92 N4 O8 S4 -","4","1","PA1239","Srirajan, V.; Bhawal, B. M.; Puranik, V. G.","Novel Protective Group in β-Lactam Chemistry: 3-Phenoxy-4-phenyl-<i>N</i>-[α-(phenylthio)benzyl]azetidin-2-one","Acta Crystallographica Section C","1997","53","3","358","360","10.1107/S0108270196011973","","","0.7093","MoKα","","0.0971","0.0677","","0.2597","0.1983","","","","1.127","1.039","1.039","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006015","11.049","0.006","17.638","0.003","15.894","0.002","90","","91.12","0.02","90","","3096.9","1.8","295","1","295","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H15 O10 Os3 P -","- C29 H15 O10 Os3 P -","- C116 H60 O40 Os12 P4 -","4","1","SK1030","Capparelli, M. V.; De Sanctis, Y.; Arce, A. J.; Spodine, E.","Nonacarbonyl[μ~3~-(1,2-diphenylethyl)phenylphosphinito]triosmium(2 <i>Os</i>—<i>Os</i>)","Acta Crystallographica Section C","1997","53","3","302","305","10.1107/S0108270196008219","","","0.71069","MoKα","","","0.0454","","","0.0552","","","","","3.2","3.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006016","20.7727","0.0002","20.7727","0.0002","36.6751","0.0001","90","","90","","90","","15825.5","0.2","150","","150","","","","","","","","","3","I 41/a :2","-I 4ad","88","","[Bis-(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)]-phenyl-methane","","- C23 H28 O4 -","- C23 H28 O4 -","- C736 H896 O128 -","32","2","SK1062","Bolte, M.; Degen, A.; Rühl, S.","Twinned Crystal Structure of Bis(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)phenylmethane at 150K","Acta Crystallographica Section C","1997","53","3","340","342","10.1107/S0108270196013078","","","0.71073","MoKα","","0.0441","0.0392","","0.0855","0.0825","","","","1.18","1.178","1.178","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006017","15.279","0.004","9.812","0.003","18.178","0.004","90","","111.96","0.02","90","","2527.5","1.2","297","","24","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H34 N4 O5 S -","- C24 H34 N4 O5 S -","- C96 H136 N16 O20 S4 -","4","1","TA1073","Iwata, M.; Nagase, H.; Endo, T.; Ueda, H.","Glimepiride","Acta Crystallographica Section C","1997","53","3","329","331","10.1107/S0108270196002363","","","1.5418","CuKα","","","0.046","","","0.077","","","","","2.43","2.43","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006018","5.352","0.002","15.186","0.002","12.013","0.001","90","","95.87","0.02","90","","971.2","0.4","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-carbamoylmethyl-pyridinium perchlorate","","- C7 H9 Cl N2 O5 -","- C7 H9 Cl N2 O5 -","- C28 H36 Cl4 N8 O20 -","4","1","TA1092","Sakai, K.; Ikuta, Y.; Shiomi, M.; Tamane, T.; Tomita, Y.; Tsubomura, T.; Nemoto, N.","<i>N</i>-(Carbamoylmethyl)pyridinium Perchlorate and <i>N</i>-(Carbamoylmethyl)-<i>N</i>'-methyl-4,4'-bipyridinium Diperchlorate Hydrate","Acta Crystallographica Section C","1997","53","3","331","334","10.1107/S010827019601311X","","","1.54178","CuKα","","","0.0559","","","0.0766","","","","","2.9","2.9","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006019","11.528","0.003","8.643","0.003","19.141","0.002","90","","106.56","0.01","90","","1828","0.8","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-carbamoylmethyl-N'-methyl-4,4'-bipyridinium bis(perchlorate) hydrate","","- C13 H17 Cl2 N3 O10 -","- C13 H17 Cl2 N3 O10 -","- C52 H68 Cl8 N12 O40 -","4","1","TA1092","Sakai, K.; Ikuta, Y.; Shiomi, M.; Tamane, T.; Tomita, Y.; Tsubomura, T.; Nemoto, N.","<i>N</i>-(Carbamoylmethyl)pyridinium Perchlorate and <i>N</i>-(Carbamoylmethyl)-<i>N</i>'-methyl-4,4'-bipyridinium Diperchlorate Hydrate","Acta Crystallographica Section C","1997","53","3","331","334","10.1107/S010827019601311X","","","1.54178","CuKα","","","0.0569","","","0.0624","","","","","2.89","2.89","","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2006020","9.447","0.001","10.037","0.002","17.04","0.002","90","","100.21","0.01","90","","1590.1","0.4","296.2","","296.2","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C37 H42 O6 -","- C37 H42 O6 -","- C74 H84 O12 -","2","1","TA1108","Nishikawa, K.; Matsumoto, A.; Tsukada, H.; Shiro, M.; Toda, F.","Inclusion Complex of (<i>S</i>)-1,3-Butanediol with (<i>S</i>,<i>S</i>)-(+)-<i>trans</i>-2,3-Bis(hydroxydiphenylmethyl)-1,4-dioxaspiro[4.4]nonane","Acta Crystallographica Section C","1997","53","3","351","353","10.1107/S0108270196014175","","","1.5418","CuKα","","","0.0432","","","0.0553","","","","","1.26","1.26","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006021","13.081","0.002","13.473","0.002","17.148","0.003","90","","93.73","0.01","90","","3015.8","0.8","295.2","","295.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H18 Cl4 N4 O5 S2 -","- C30 H18 Cl4 N4 O5 S2 -","- C120 H72 Cl16 N16 O20 S8 -","4","1","TA1116","Cox, O.; Cordero, M.; Piñeiro, S.; Huang, S. D.","Bis[(<i>E</i>)-2-(2,4-dichloro-5-nitrostyryl)-1,3-benzothiazole] Hydrate","Acta Crystallographica Section C","1997","53","3","310","311","10.1107/S0108270196013352","","","0.7107","MoKα","","","0.0706","","","0.0936","","","","","2.161","2.161","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006022","9.977","0.004","5.757","0.004","16.047","0.003","90","","96.26","0.02","90","","916.2","0.8","296","1","296","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H26 N2 O5 -","- C17 H26 N2 O5 -","- C34 H52 N4 O10 -","2","1","TA1117","Burkett, B. A.; Chai, C. L. L.; Hockless, D. C. R.","1-Acetyl-4-[(1<i>R</i>,2<i>S</i>,5<i>R</i>)-3-menthyloxycarbonyl]piperazine-2,5-dione","Acta Crystallographica Section C","1997","53","3","327","329","10.1107/S0108270196013753","","","1.5418","CuKα","","0.0983","0.0983","","0.0448","0.0448","","","","1.989","1.989","1.989","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006023","13.683","0.003","5.317","0.001","13.717","0.003","90","","119.67","0.03","90","","867.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","sodium manganese fluoride phosphate","","- F Mn Na2 O4 P -","- F Mn Na2 O4 P -","- F8 Mn8 Na16 O32 P8 -","8","2","AB1400","Yakubovich, O. V.; Karimova, O. V.; Mel'nikov, O. K.","The Mixed Anionic Framework in the Structure of Na~2~{MnF[PO~4~]}","Acta Crystallographica Section C","1997","53","4","395","397","10.1107/S0108270196014102","","","0.71069","MoKα","","0.037","0.0367","","0.0974","0.0972","","","","1.292","1.293","1.293","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006024","23.986","0.003","14.076","0.002","10.493","0.002","90","","90","","90","","3542.7","1","295","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C20 H25 N3 O2 -","- C20 H25 N3 O2 -","- C160 H200 N24 O16 -","8","1","AB1419","Tahir, M. N.; Ülkü, D.; Demir, A. S.; Mohammadi, M.; Özgül, E.","13-Phenyl-11,13,15-triazatricyclo[8.5.2.0^11,15^]heptadec-16-ene-12,14-dione","Acta Crystallographica Section C","1997","53","4","496","498","10.1107/S0108270196015284","","","0.71069","MoKα","","","0.052","","","0.056","","","","","0.86","0.86","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006025","7.435","0.002","18.709","0.003","7.5618","0.0013","90","","113.078","0.014","90","","967.7","0.4","294","","294","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","bis(3-methyladenine)dichlorodimethyltin(IV)","","- C14 H20 Cl2 N10 Sn -","- C14 H20 Cl2 N10 Sn -","- C28 H40 Cl4 N20 Sn2 -","2","0.5","AB1424","Hazell, A.; Ouyang, J.; Khoo, L. E.","Dichlorodimethylbis(3-methyladenine-<i>N</i>^7^)tin(IV)","Acta Crystallographica Section C","1997","53","4","406","408","10.1107/S0108270196015132","","","0.71073","MoKα","","","0.043","","","0.054","","","","","1.81","1.81","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2006026","10.3121","0.0012","13.9765","0.0012","14.973","0.002","101.622","0.008","104.206","0.01","99.248","0.008","1998.3","0.4","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","11,17-Di-tert-butyl-25,26,27,28-tetrahydroxy-2,5,23-trimethyl-14-(4-nitro- phenyl)calix[4]arene Hemichloroform Solvate","","- C45.5 H49.5 Cl1.5 N O6 -","- C45.5 H49.5 Cl1.5 N O6 -","- C91 H99 Cl3 N2 O12 -","2","1","AB1430","Böhmer, V.; Ferguson, G.; Grüttner, C.; Vogt, W.","Intra- and Intermolecular Hydrogen Bonding in a Tetrahydroxycalix[4]arene","Acta Crystallographica Section C","1997","53","4","469","472","10.1107/S0108270196015508","","","0.7107","MolybdenumKα","","0.2328","0.0536","","0.1803","0.1323","","","","0.847","1.256","1.256","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2006027","6.641","0.001","10.005","0.002","10.114","0.003","84.42","0.02","73.52","0.01","78.45","0.01","630.8","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H10 Cl3 Mn N2 O -","- C10 H10 Cl3 Mn N2 O -","- C20 H20 Cl6 Mn2 N4 O2 -","2","1","AV1000","Tesouro, A.; Corbella, M.; Stoeckli-Evans, H.","Aqua(2,2'-bipyridyl-<i>N</i>,<i>N</i>')trichloromanganese(III)","Acta Crystallographica Section C","1997","53","4","430","432","10.1107/S0108270196014333","","","0.71073","MoKα","","0.1022","0.0691","","0.2508","0.192","","","","1.027","1.145","1.145","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006028","11.799","0.002","25.195","0.004","9.009","0.002","90","0.01","90","0.02","90","0.01","2678.2","0.9","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","N,N'-bispentafluorophenylurea","N,N'-bispentafluorophenylurea","","- C13 H2 F10 N2 O -","- C13 H2 F10 N2 O -","- C104 H16 F80 N16 O8 -","8","1","BK1165","Jai-nhuknan, J.; Karipides, A. G.; Hughes, J. M.; Cantrell, J. S.","<i>N</i>,<i>N</i>'-Bis(pentafluorophenyl)urea","Acta Crystallographica Section C","1997","53","4","455","457","10.1107/S010827019601428X","","","0.71069","MoKα","","0.087","0.049","","0.107","0.0951","","","","1.021","1.149","1.149","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006029","7.279","0.001","8.455","0.002","11.408","0.002","67.73","0.01","85.15","0.01","84.51","0.02","645.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","adeninium-2-fluorobenzoatemonohydrate","2-aminopurinium-2-fluorobenzoatemonohydrate","","- C12 H12 F N5 O3 -","- C12 H12 F N5 O3 -","- C24 H24 F2 N10 O6 -","2","1","BK1179","Jai-nhuknan, J.; Karipides, A. G.; Cantrell, J. S.","1-Adeninium 2-Fluorobenzoate Monohydrate","Acta Crystallographica Section C","1997","53","4","454","455","10.1107/S0108270196014825","","","0.71069","MoKα","","0.0554","0.045","","0.124","0.1161","","","","1.05","1.089","1.089","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006030","9.639","0.002","16.346","0.002","24.1086","0.0014","90","","90.563","0.009","90","","3798.3","0.9","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H28 B8 Cl Ir P2 -","- C8 H18 B8 Cl Ir P2 -","- C64 H144 B64 Cl8 Ir8 P16 -","8","2","BK1240","Bould, J.; Rath, N. P.; Barton, L.","The <i>isonido</i>-Metalladicarbaborane [1,1,1-H{P(CH~3~)~3~}~2~-6-Cl-1,2,4-IrC~2~B~8~H~9~]","Acta Crystallographica Section C","1997","53","4","416","419","10.1107/S0108270196014199","","","0.71073","MoKα","","0.1329","0.062","","0.137","0.1102","","","","1.024","1.112","1.112","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006031","9.3531","0.0001","11.264","0.0002","14.1166","0.0002","96.705","0.001","93.814","0.001","111.296","0.001","1366.63","0.04","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H38 Cl N3 Si2 W -","- C23 H38 Cl N3 Si2 W -","- C46 H76 Cl2 N6 Si4 W2 -","2","1","BK1269","Wang, S.-Y. S.; Boncella, J. M.; Abboud, K. A.","A Chelate-Stabilized Tungsten‒Imido‒Monoalkyl Complex, [WCl(PhN)(CH~2~CMe~3~){<i>o</i>-C~6~H~4~(NSiMe~3~)~2~}]","Acta Crystallographica Section C","1997","53","4","436","438","10.1107/S0108270196014370","","","0.71073","MoKα","","0.0376","0.034","","0.091","0.085","","","","1.08","1.068","1.068","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006032","12.0128","0.001","12.0128","0.001","35.16","0.003","90","","90","","120","","4394.1","0.6","163","2","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","Tetraethylammonium Bromide","EthanaminiumN,N,N-triethyl Bromide","","- C8 H20 Br N -","- C8 H20 Br N -","- C144 H360 Br18 N18 -","18","0.5","BK1293","Ralle, M.; Bryan, J. C.; Habenschuss, A.; Wunderlich, B.","Low-Temperature Phase of Tetraethylammonium Bromide","Acta Crystallographica Section C","1997","53","4","488","490","10.1107/S0108270196015399","","","0.71073","MoKα","","0.054","0.026","","0.071","0.061","","","","1.06","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006033","12.995","0.001","12.995","","7.143","0.001","90","","90","","90","","1206.24","0.19","170","","170","","","","","","","","","5","I -4","I -4","82","","","","- C24 H21 P S4 W -","- C24 H24 P S4 W -","- C48 H48 P2 S8 W2 -","2","0.25","BK1296","Parvez, M.; Boorman, P. M.; Wang, M.","Tetraphenylphosphonium (Hydrogensulfido-<i>S</i>)trisulfidotungstate(VI)","Acta Crystallographica Section C","1997","53","4","413","414","10.1107/S0108270196015405","","","0.71069","MoKα","","","0.024","","","0.023","","","","","1.4","1.4","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006034","14.0082","0.0008","10.803","0.001","14.581","0.001","90","","116.625","0.008","90","","1972.6","0.3","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[1-methyl-3-(2-propenyl)-2(3H)-imidazolethione]dichlorozinc(II)","","- C14 H20 Cl2 N4 S2 Zn -","- C14 H20 Cl2 N4 S2 Zn -","- C56 H80 Cl8 N16 S8 Zn4 -","4","1","BK1301","Williams, D. J.; Ly, T. A.; Mudge, J. W.; Pennington, W. T.; Schimek, G. L.","Dichlorobis[1-methyl-3-(prop-2-enyl)imidazole-2(3<i>H</i>)-thione-<i>S</i>]zinc(II)","Acta Crystallographica Section C","1997","53","4","415","416","10.1107/S0108270196013984","","","0.71073","MoKα","","0.0626","0.043","","0.0431","0.044","","","","","1.85","1.85","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006035","10.3344","0.0007","10.8162","0.0007","11.362","0.0007","90","","108.73","0.006","90","","1202.77","0.14","296","","296","","","","","","","","","4","P 1 21 1","","","","3α,7α,12α-Trihydroxy-5β-cholan-24-amide Dihydrate","","- C24 H45 N O6 -","- C24 H45 N O6 -","- C48 H90 N2 O12 -","2","1","BK1304","Wahle, M. C.; Fanwick, P. E.; Byrn, S. R.","Cholamide Dihydrate","Acta Crystallographica Section C","1997","53","4","480","482","10.1107/S0108270196014382","","","1.54184","CuKα","","0.054","0.042","","0.13","0.114","","","","1.062","1.02","1.02","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006036","20.52","0.004","10.835","0.002","12.333","0.002","90","","123.73","0.03","90","","2280.5","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorobis(4-methylpiperidine)(4-methylpyridine)nickel(II)","","- C18 H33 Cl2 N3 Ni -","- C18 H33 Cl2 N3 Ni -","- C72 H132 Cl8 N12 Ni4 -","4","0.5","BM1072","Koman, M.; Jóna, E.; Kopál, I.","Structural Investigation of Ni^II^ Complexes. XI. Dichlorobis(4-methylpiperidine-<i>N</i>)(4-methylpyridine-<i>N</i>)nickel(II)","Acta Crystallographica Section C","1997","53","4","443","445","10.1107/S010827019601284X","","","0.71073","MoKα","","0.0389","0.0373","","0.1022","0.0916","","","","1.106","1.106","1.106","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006037","8.814","0.006","9.992","0.009","19.774","0.018","90","","91.6","0.07","90","","1741","3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","meso-1,1'-diphenyl-2,2,2',2'-tetrachlorobicyclopropyl","","- C18 H14 Cl4 -","- C18 H14 Cl4 -","- C72 H56 Cl16 -","4","1","BM1102","Lam, Y.-L.; Koh, L.-L.; Huang, H.-H.","<i>meso</i>-2,2,2',2'-Tetrachloro-1,1'-diphenyl-1,1'-bicyclopropyl and <i>meso</i>-2,2,2',2'-Tetrabromo-1,1'-diphenyl-1,1'-bicyclopropyl","Acta Crystallographica Section C","1997","53","4","499","504","10.1107/S0108270196015090","","","0.71073","MoKα","","0.0635","0.0489","","0.0711","0.0653","","","","1.09","1.12","1.12","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006038","14.119","0.005","11.617","0.004","41.81","0.03","90","","90","","90","","6858","6","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Meso-1,1'-diphenyl-2,2,2',2'-tetrachlorobicyclopropyl","","- C18 H14 Cl4 -","- C18 H14 Cl4 -","- C288 H224 Cl64 -","16","2","BM1102","Lam, Y.-L.; Koh, L.-L.; Huang, H.-H.","<i>meso</i>-2,2,2',2'-Tetrachloro-1,1'-diphenyl-1,1'-bicyclopropyl and <i>meso</i>-2,2,2',2'-Tetrabromo-1,1'-diphenyl-1,1'-bicyclopropyl","Acta Crystallographica Section C","1997","53","4","499","504","10.1107/S0108270196015090","","","0.71073","MoKα","","0.0849","0.0464","","0.0421","0.0361","","","","1.06","1.65","1.65","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006039","8.432","0.002","9.586","0.002","11.187","0.002","87.19","0.02","85.51","0.02","78.87","0.02","884","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Meso-1,1'-diphenyl-2,2,2',2'-tetrabromobicyclopropyl","","- C18 H14 Br4 -","- C18 H14 Br4 -","- C36 H28 Br8 -","2","1","BM1102","Lam, Y.-L.; Koh, L.-L.; Huang, H.-H.","<i>meso</i>-2,2,2',2'-Tetrachloro-1,1'-diphenyl-1,1'-bicyclopropyl and <i>meso</i>-2,2,2',2'-Tetrabromo-1,1'-diphenyl-1,1'-bicyclopropyl","Acta Crystallographica Section C","1997","53","4","499","504","10.1107/S0108270196015090","","","0.71073","MoKα","","0.0581","0.0421","","0.0645","0.0547","","","","0.92","0.77","0.77","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006040","7.4918","0.0007","11.3118","0.0013","24.245","0.003","90","","90","","90","","2054.7","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3aS,6R,7R,7aR)-Menthyl 1,6,7,7a-tetrahydro-3,3-dimethyl-1-oxo-3a,6- epoxyisobenzofuran-7-carboxylate","","- C21 H30 O5 -","- C21 H30 O5 -","- C84 H120 O20 -","4","1","BM1116","Breu, J.; Butz, T.; Range, K.-J.; Sauer, J.","Configurations of Cycloadducts Formed in Asymmetric Intramolecular Diels‒Alder Reactions","Acta Crystallographica Section C","1997","53","4","515","517","10.1107/S010827019601579X","","","0.71069","MoKα","","0.0504","0.0367","","0.0875","0.0821","","","","1.016","1.075","1.075","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006041","7.73","0.001","9.4267","0.001","9.9854","0.001","79.235","0.008","88.902","0.01","75.125","0.009","690.54","0.14","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","(3S,3aS,6R,7R,7aR)-Menthyl-1,6,7,7a-tetrahydro-3-(1,1-dimethylethyl)-1-oxo- 3H-3a,6-epoxyisobenzofuran-7-carboxylate","","- C14 H18 O5 -","- C14 H18 O5 -","- C28 H36 O10 -","2","1","BM1116","Breu, J.; Butz, T.; Range, K.-J.; Sauer, J.","Configurations of Cycloadducts Formed in Asymmetric Intramolecular Diels‒Alder Reactions","Acta Crystallographica Section C","1997","53","4","515","517","10.1107/S010827019601579X","","","0.71069","MoKα","","0.0478","0.0402","","0.1175","0.113","","","","1.055","1.123","1.123","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006042","12.928","0.005","5.546","0.005","16.445","0.005","90","","92.392","0.005","90","","1178.1","1.2","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","2-Methylamino-5-chlorobenzophenone","","- C14 H12 Cl N O -","- C14 H12 Cl N O -","- C56 H48 Cl4 N4 O4 -","4","1","BM1125","Cox, P. J.; Anisuzzaman, A. T. Md.; Skellern, G. G.; Pryce-Jones, R. H.; Florence, A. J.; Shankland, N.","2-Methylamino-5-chlorobenzophenone","Acta Crystallographica Section C","1997","53","4","476","477","10.1107/S0108270196014928","","","0.71069","MoKα","","0.0569","0.033","","0.0708","0.064","","","","0.736","0.881","0.881","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006043","12.533","0.003","7.262","0.001","11.259","0.003","90","","111.3","0.02","90","","954.7","0.4","293","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Ge O3 Sr -","- Ge O3 Sr -","- Ge12 O36 Sr12 -","12","1.5","BR1159","Nishi, F.","Strontium Metagermanate, SrGeO~3~","Acta Crystallographica Section C","1997","53","4","399","401","10.1107/S0108270196013960","","","0.71073","MoKα","","","0.048","","","0.033","","","","","1.37","1.37","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006044","7.238","0.001","22.149","0.003","11.244","0.001","90","","90","","90","","1802.6","0.4","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","trans-bisaquabis(1,1,1,5,5,5-hexafluoroacetylacetonato)manganese(II) monohydrate","","- C10 H8 F12 Mn O7 -","- C10 H8 F12 Mn O7 -","- C40 H32 F48 Mn4 O28 -","4","0.5","BS1010","Dickman, M. H.","<i>trans</i>-Diaquabis(hexafluoroacetylacetonato-<i>O</i>,<i>O</i>')manganese(II) Monohydrate","Acta Crystallographica Section C","1997","53","4","402","404","10.1107/S010827019601459X","","","0.71073","MoKα","","0.0707","0.0455","","0.1165","0.104","","","","1.075","1.141","1.141","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006045","12.815","0.009","14.798","0.012","15.584","0.014","82.648","0.01","77.869","0.01","67.661","0.01","2669","4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5,11,17,23-Tetra-tert-butyl-25,27-bis((diethylthiocarbamoyl)- methoxy)-26,28-dihydroxycalix[4]arene","","- C56 H78 N2 O4 S2 -","- C56 H76 N2 O4 S2 -","- C112 H152 N4 O8 S4 -","2","1","CF1144","Drew, M. G. B.; Beer, P. D.; Ogden, M. I.","A Calix[4]arene with Diethylthiocarbamoylmethyloxy Substituents in the 1,3 Positions","Acta Crystallographica Section C","1997","53","4","472","474","10.1107/S0108270196015521","","","0.71073","MoKα","","0.1193","0.0831","","0.2928","0.244","","","","0.615","0.602","0.602","","","","","has coordinates,has disorder","201201","2020-10-21","18:00:00",""
"2006046","10.613","0.002","15.402","0.003","12.928","0.004","90","","93.35","0.03","90","","2109.6","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H26 Cu N4 O8 -","- C18 H26 Cu N4 O8 -","- C72 H104 Cu4 N16 O32 -","4","0.5","DE1043","Suresh, E.; Bhadbhade, M. M.","Metal‒α,ω-Dicarboxylate Complexes. II. <i>catena</i>-Poly[bis(imidazole-<i>N</i>^3^)copper(II)-di-μ-adipato(1 ‒)-<i>O</i>^1^:<i>O</i>^6^;<i>O</i>^6^:<i>O</i>^1^]","Acta Crystallographica Section C","1997","53","4","422","425","10.1107/S0108270196014138","","","0.7107","MoKα","","0.0354","0.0291","","0.0768","0.0747","","","","1.081","1.136","1.136","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006047","13.613","0.001","21.448","0.003","9.1157","0.0008","90","","103.561","0.007","90","","2587.3","0.5","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-[2,4-(3H,10H)-dioxo-10-(4-tert-butylphenyl)pyrimido[4,5-b]quinolin-3-yl]- benzoic acid","","- C29 H27 N3 O5 -","- C29 H27 N3 O5 -","- C116 H108 N12 O20 -","4","1","DE1045","Kawai, Y.; Kunitomo, J.; Ohno, A.","A Novel Function of an Atropisomeric Flavin Model as a Host Compound","Acta Crystallographica Section C","1997","53","4","513","515","10.1107/S0108270197000255","","","1.5418","CuKα","","0.0516","0.0414","","0.0817","0.0682","","","","1.389","1.786","1.786","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006048","10.825","0.003","10.825","0.003","10.184","0.006","90","","90","","90","","1193.4","0.8","293","2","293","2","","","","","","","","4","P 4/n c c :2","-P 4a 2ac","130","","Cerium Sodium Diarsenate","","- As4 Ce Na4 O14 -","- As4 Ce Na4 O14 -","- As16 Ce4 Na16 O56 -","4","0.25","DU1161","Belam, W.; Boughzala, H.; Jouini, T.","Na~4~Ce(As~2~O~7~)~2~","Acta Crystallographica Section C","1997","53","4","397","399","10.1107/S0108270196007226","","","0.71069","MoKα","","0.0398","0.0262","","0.0579","0.0548","","","","1.277","1.362","1.362","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006049","8.61","0.003","16.01","0.005","12.878","0.003","90","","104.45","0.01","90","","1719","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(propan-1,3-diammonium) diphosphate tetrahydrate","","- C6 H32 N4 O11 P2 -","- C6 H32 N4 O11 P2 -","- C24 H128 N16 O44 P8 -","4","0.5","DU1165","Charfi, M.; Jouini, A.","Bis(propane-1,3-diammonium) Diphosphate Tetrahydrate","Acta Crystallographica Section C","1997","53","4","463","465","10.1107/S0108270196012127","","","1.5418","CuKα","","0.0424","0.0424","","0.1113","0.1113","","","","1.189","1.189","1.189","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006050","8.058","0.001","14.546","0.003","12.247","0.002","90","","95.57","0.01","90","","1428.7","0.4","293","","293","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","(3-(η^5^-cyclopentadienylamido)propionic acid)(tricarbonyl)rhenium","","- C12 H10 N O6 Re -","- C12 H10 N O6 Re -","- C48 H40 N4 O24 Re4 -","4","1","DU1167","Bennouna, A.; Mousser, A.; Gorfti, A.; Salmain, M.; Cabestaing, C.; Jaouen, G.","Tricarbonyl[3-(η^5^-cyclopentadienylcarbonylamino)propionic acid]rhenium","Acta Crystallographica Section C","1997","53","4","447","449","10.1107/S0108270196014643","","","0.71073","MoKα","","","0.03","","","0.033","","","","","0.972","0.972","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006051","10.154","0.002","8.968","0.002","6.749","0.002","90","","104","0.2","90","","596.3","0.6","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","pGlu-Pro-NH~2~","(author's name) cis-3-(2-pyrrolidone-5(S)-carbonyl)-L-prolinamide","","- C10 H17 N3 O4 -","- C10 H17 N3 O4 -","- C20 H34 N6 O8 -","2","1","DU1169","Wouters, J.; Norberg, B.; Evrard, G.","The Dipeptide pGlu‒Pro-NH~2~","Acta Crystallographica Section C","1997","53","4","477","480","10.1107/S0108270196014655","","","1.54178","CuKα","","0.0266","0.0256","","0.0764","0.0749","","","","1.084","1.086","1.086","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006052","13.576","0.004","17.947","0.003","12.262","0.003","105.11","0.02","114.19","0.02","83.55","0.02","2631","1.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","[(μ-Acetato)(μ-oxo)(bis(tris-(2-pyridylmethyl)amine)diiron(III)](triflate) dihydrate","","- C41 H43 F9 Fe2 N8 O14 S3 -","- C40 H39 F6 Fe2 N8 O9 S2 -","- C80 H78 F12 Fe4 N16 O18 S4 -","2","1","FG1185","Norman, R. E.; Peterson, N. L.; Chang, S.-C.","μ-Acetato-<i>O</i>:<i>O</i>'-μ-oxo-bis{[tris(2-pyridylmethyl)amine-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']iron(III)} Tris(trifluoromethanesulfonate) Dihydrate","Acta Crystallographica Section C","1997","53","4","452","453","10.1107/S0108270196015016","","","0.71069","MoKα","","0.1098","0.0545","","0.1653","0.1445","","","","1.048","1.22","1.22","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006053","8.814","0.002","9.742","0.002","16.516","0.003","90","","99.65","0.03","90","","1398.1","0.5","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tran-Bis(4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole-N^1^, N')copper(II) tetrafluoroborate","","- C24 H20 B2 Cu F8 N12 -","- C24 H20 B2 Cu F8 N12 -","- C48 H40 B4 Cu2 F16 N24 -","2","0.5","FG1212","Jircitano, A. J.; Sommerer, S. O.; Abboud, K. A.","<i>trans</i>-Bis[4-amino-3,5-bis(2-pyridyl)-1,2,4-triazole-<i>N</i>^1^,<i>N</i>']copper(II) Bis(tetrafluoroborate)","Acta Crystallographica Section C","1997","53","4","434","436","10.1107/S0108270196015028","","","0.71073","MoKα","","0.0895","0.0578","","0.169","0.1467","","","","1.043","1.14","1.14","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006054","9.988","0.002","15.154","0.005","23.193","0.007","90","","90.31","0.02","90","","3510.4","1.7","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Mer,trans-(acetonitrile)trichlorobis(triphenylphosphine)rhenium(III)","(OC-6-13)-(Acetonitrile)trichlorobis(triphenylphosphine)rhenium(III)","","- C38 H33 Cl3 N P2 Re -","- C38 H33 Cl3 N P2 Re -","- C152 H132 Cl12 N4 P8 Re4 -","4","1","FG1219","Davis, M.; Bélanger-Gariépy, F.; Zargarian, D.; Beauchamp, A. L.","Reinvestigation of <i>mer</i>,<i>trans</i>-(Acetonitrile)trichlorobis(triphenylphosphine)rhenium(III)","Acta Crystallographica Section C","1997","53","4","428","430","10.1107/S0108270196014680","","","1.5418","CuKα","","0.0588","0.0367","","0.0839","0.0791","","","","0.865","0.982","0.982","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006055","11.48","0.002","15.846","0.003","15.14","0.003","90","","91.5","0.03","90","","2753.2","0.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(Me~4~N)[Hg(SCOPh)~3~]","Tetramethylammonium Tris(thiobenzoato)mercury(II)","","- C25 H27 Hg N O3 S3 -","- C25 H27 Hg N O3 S3 -","- C100 H108 Hg4 N4 O12 S12 -","4","1","FG1233","Vittal, J. J.; Dean, P. A. W.","Tetramethylammonium Tris(thiobenzoato-<i>O</i>,<i>S</i>)mercury(II)","Acta Crystallographica Section C","1997","53","4","409","410","10.1107/S0108270196014692","","","0.71073","MoKα","","0.0922","0.0485","","0.1222","0.1037","","","","1.037","1.124","1.124","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006056","10.4082","0.0017","19.453","0.004","7.3882","0.0019","90","","90","","90","","1495.9","0.5","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(SR,1R,2S)-1-(t-Butylsulfinyl)-2-(hydroxymethyl)ferrocene","","- C15 H20 Fe O2 S -","- C15 H20 Fe O2 S -","- C60 H80 Fe4 O8 S4 -","4","1","FG1237","Robinson, P. D.; Hua, D. H.; Lagneau, N. M.; Robben, P. M.; Meyers, C. Y.","(S<i>R</i>,1<i>R</i>,2<i>S</i>)-1-(<i>tert</i>-Butylsulfinyl)2-(hydroxymethyl)ferrocene","Acta Crystallographica Section C","1997","53","4","445","447","10.1107/S0108270196014916","","","0.71069","MoKα","","","0.039","","","0.036","","","","","1.17","1.17","","","","","has coordinates","191858","2020-10-21","18:00:00",""
"2006057","6.906","0.004","12.009","0.007","14.643","0.008","90","","95.88","0.04","90","","1208","1.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-phenylenebis(diphenylphosphine oxide)","","- C30 H24 O2 P2 -","- C30 H24 O2 P2 -","- C60 H48 O4 P4 -","2","0.5","FG1247","Alexander, N. C.; Robinson, B. H.; Simpson, J.","1,4-Phenylenebis(diphenylphosphine oxide)","Acta Crystallographica Section C","1997","53","4","465","467","10.1107/S0108270196014709","","","0.71073","MoKα","","0.0947","0.0516","","0.0451","0.0405","","","","","1.3996","1.3996","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006058","9.324","0.003","17.688","0.004","17.81","0.006","90","","95.77","0.03","90","","2922.4","1.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","μ-1,4-Bis(diphenylphosphino)phenylene-P,P'-bis[μ~3~-benzylidene-octacarbonyl- triangulo-tricobalt(3 Co—Co)]","","- C60 H34 Co6 O16 P2 -","- C60 H34 Co6 O16 P2 -","- C120 H68 Co12 O32 P4 -","2","0.5","FG1249","Alexander, N. C.; Robinson, B. H.; Simpson, J.","μ-1,4-Bis(diphenylphosphino)phenylene-<i>P</i>:<i>P</i>'-bis[μ~3~-benzylidyne-octacarbonyl-<i>triangulo</i>-tricobalt(3 <i>Co</i>—<i>Co</i>)]","Acta Crystallographica Section C","1997","53","4","425","428","10.1107/S010827019601503X","","","0.71073","MoKα","","","0.0487","","","0.0434","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006059","10.1662","0.0016","12.404","0.003","9.0923","0.0014","100.677","0.015","102.334","0.012","111.728","0.014","995.4","0.4","296","","296","","","","","","","","","4","P -1","-P 1","2","","2-Phenyl-4-(9'-fluorenoxy)-1(2H)-phthalazinone","","- C27 H18 N2 O2 -","- C27 H18 N2 O2 -","- C54 H36 N4 O4 -","2","1","FG1251","Bausch, M. J.; Robinson, P. D.; Gong, Y.","4-(9-Fluorenoxy)-2-phenylphthalazin-1(2<i>H</i>)-one","Acta Crystallographica Section C","1997","53","4","517","519","10.1107/S0108270196015156","","","0.71069","MoKα","","0.0898","0.035","","0.1097","0.0863","","","","1.022","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006060","19.67","0.006","15.904","0.003","9.485","0.006","90","","90","","90","","2967","2","295","1","295","1","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C17 H19 N3 -","- C17 H19 N3 -","- C136 H152 N24 -","8","1","FG1252","Parvez, M.","Antazoline","Acta Crystallographica Section C","1997","53","4","506","508","10.1107/S0108270196015934","","","0.71069","MoKα","","0.198","0.0493","","0.2972","0.1289","","","","1.012","1.136","1.136","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006061","7.3045","0.0002","9.8633","0.0003","10.7436","0.0004","90","","98.608","0.001","90","","765.32","0.04","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Nitroacetophenone","","- C8 H7 N O3 -","- C8 H7 N O3 -","- C32 H28 N4 O12 -","4","1","HA1182","Bolte, M.; Scholtyssik, M.","<i>meta</i>-Nitroacetophenone at 173K","Acta Crystallographica Section C","1997","53","4","474","476","10.1107/S0108270196015545","","","0.71073","MoKα","","0.0406","0.0354","","0.1027","0.0998","","","","1.044","1.095","1.095","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006062","13.853","0.001","10.988","0.002","16.678","0.002","90","","98.703","0.007","90","","2509.4","0.6","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis{S-(1-lithio-2,2-diphenylethenyl)-N-methyl-S-phenylsulfoximine- tetrahydrofuran} tetrahydrofuran solvate","","- C54 H60 Li2 N2 O5 S2 -","- C54 H60 Li2 N2 O5 S2 -","- C108 H120 Li4 N4 O10 S4 -","2","0.5","JZ1153","Zehnder, M.; Müller, J. F. K.; Neuburger, M.","Bis{μ-[1-(<i>N</i>-Methylsulfonimidoyl)-2,2-diphenylethene]}-1κ^2^<i>C</i>^1^,<i>N</i>:2κ<i>O</i>;1κ<i>O</i>:2κ^2^<i>C</i>^1^,<i>N</i>-bis[(tetrahydrofuran-<i>O</i>)lithium] Tetrahydrofuran Solvate and 1-(<i>N</i>-Methylphenylsulfonimidoyl)-2,2-diphenylethene","Acta Crystallographica Section C","1997","53","4","419","422","10.1107/S0108270196014412","","","1.5418","CuKα","","","0.0623","","","0.0702","","","","","0.97","0.97","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006063","6.0861","0.0004","11.9803","0.0007","12.4121","0.0007","97.17","0.004","90.662","0.005","99.241","0.005","885.82","0.09","293","","293","","","","","","","","","5","P -1","-P 1","2","","2,2-Diphenylethenyl-N-methyl-S-phenylsulfoximine","","- C21 H19 N O S -","- C21 H19 N O S -","- C42 H38 N2 O2 S2 -","2","1","JZ1153","Zehnder, M.; Müller, J. F. K.; Neuburger, M.","Bis{μ-[1-(<i>N</i>-Methylsulfonimidoyl)-2,2-diphenylethene]}-1κ^2^<i>C</i>^1^,<i>N</i>:2κ<i>O</i>;1κ<i>O</i>:2κ^2^<i>C</i>^1^,<i>N</i>-bis[(tetrahydrofuran-<i>O</i>)lithium] Tetrahydrofuran Solvate and 1-(<i>N</i>-Methylphenylsulfonimidoyl)-2,2-diphenylethene","Acta Crystallographica Section C","1997","53","4","419","422","10.1107/S0108270196014412","","","1.5418","CuKα","","","0.0394","","","0.0473","","","","","1.03","1.03","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006064","17.582","0.012","9.451","0.008","24.558","0.017","90","","98.88","0.08","90","","4032","5","150","0.2","150","0.2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C8 H24 F12 N4 Ni P2 S2 -","- C8 H24 F12 N4 Ni P2 S2 -","- C64 H192 F96 N32 Ni8 P16 S16 -","8","1","JZ1164","Blake, A. J.; Danks, J. P.; Parsons, S.; Schröder, M.","Bis[bis(2-aminoethyl-<i>N</i>)sulfide-<i>S</i>]nickel(II) Bis(hexafluorophosphate)","Acta Crystallographica Section C","1997","53","4","411","413","10.1107/S0108270196013297","","","0.71073","MoKα","","0.0907","0.0647","","0.302","0.2062","","","","1.044","0.856","0.856","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006065","9.0191","0.0009","10.715","0.002","15.374","0.002","90","","94.382","0.01","90","","1481.4","0.4","293","2","293","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Diphenylphosphinoyl-1,3-dioxane ?","","- C16 H17 O3 P -","- C16 H17 O3 P -","- C64 H68 O12 P4 -","4","1","KA1181","Majzner, W. R.; Wieczorek, M. W.; Mikołajczyk, M.; Graczyk, P. P.","2-(Diphenylphosphinoyl)-1,3-dioxane","Acta Crystallographica Section C","1997","53","4","467","469","10.1107/S0108270196005604","","","1.54178","CuKα","","0.0859","0.0564","","0.156","0.1362","","","","1.067","1.135","1.135","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006066","9.363","0.001","9.363","0.001","11.015","0.002","90","","90","","120","","836.3","0.2","293","2","293","2","","","","","","","","4","P 32","P 32","145","","N'-Ethoxiyarbonyl-1-Methylpyrrole-2-carbohydrazide.","","- C9 H13 N3 O3 -","- C9 H13 N3 O3 -","- C27 H39 N9 O9 -","3","1","KA1194","Liu-Gonzalez, M.; Sanz-Ruiz, F.; Gonzalez-Rosende, M. E.; Lozano-Lucía, O.; Zaballos-García, E.; Sepulveda-Arqués, J.","Ethyl <i>N</i>-Methyl-2-pyrrolylcarbonylhydrazinocarboxylate","Acta Crystallographica Section C","1997","53","4","490","491","10.1107/S0108270196013583","","","0.71073","MoKα","","","0.036","","","0.046","","","","","1.734","1.734","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006067","8.192","0.003","19.278","0.005","16.952","0.002","90","","100.2","0.2","90","","2635","2","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 F3 N3 O3 -","- C12 H12 F3 N3 O3 -","- C96 H96 F24 N24 O24 -","8","2","KA1209","Yanes, C.; Torres, M.; López-Rodríguez, M.; Núñez, P.; Brito, I.","<i>N</i>-(5-Nitro-2-pyrrolidinylphenyl)trifluoroacetamide","Acta Crystallographica Section C","1997","53","4","492","493","10.1107/S0108270196014679","","","1.54055","CuKα","","","0.0446","","","0.137","","","","","0.635","0.635","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006068","11.72","0.01","9.57","0.01","10.69","0.01","100.42","0.1","110.81","0.1","103.55","0.1","1043","2","288","","288","","","","","","","","","6","P -1","-P 1","2","","(2,2'-bipyridyl)-sesqui(trifluoroacetato-mercury(II))","","- C16 H8 F9 Hg1.5 N2 O6 -","- C16 H8 F9 Hg1.5 N2 O6 -","- C32 H16 F18 Hg3 N4 O12 -","2","1","LI1151","Halfpenny, J.; Small, R. W. H.","The Mercury(II) Trifluoroacetate‒Bipyridyl System","Acta Crystallographica Section C","1997","53","4","438","443","10.1107/S0108270196012772","","","0.7107","MoKα","","","0.046","","","0.05","","","","","2.375","2.375","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006069","12.78","0.01","16.06","0.02","10.58","0.01","86.46","0.09","90.18","0.09","80.29","0.08","2136","4","288","","288","","","","","","","","","6","P -1","-P 1","2","","tris(2,2'-bipyridyl)-bis(trifluoroacetato_mercury(II))","","- C38 H24 F12 Hg2 N6 O8 -","- C38 H24 F12 Hg2 N6 O8 -","- C76 H48 F24 Hg4 N12 O16 -","2","1","LI1151","Halfpenny, J.; Small, R. W. H.","The Mercury(II) Trifluoroacetate‒Bipyridyl System","Acta Crystallographica Section C","1997","53","4","438","443","10.1107/S0108270196012772","","","0.7107","MoKα","","","0.049","","","0.053","","","","","2.227","2.227","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006070","16.54","0.02","11.06","0.01","7.59","0.01","98.6","1","87.7","0.9","67.2","0.7","1258","9","288","","288","","","","","","","","","6","P -1","-P 1","2","","bis(2,2'-bipyridyl)-trifluoroacetato-mercury(II)","","- C24 H16 F6 Hg N4 O4 -","- C24 H16 F6 Hg N4 O4 -","- C48 H32 F12 Hg2 N8 O8 -","2","1","LI1151","Halfpenny, J.; Small, R. W. H.","The Mercury(II) Trifluoroacetate‒Bipyridyl System","Acta Crystallographica Section C","1997","53","4","438","443","10.1107/S0108270196012772","","","0.7107","MoKα","","","0.052","","","0.057","","","","","2.267","2.267","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006071","16.848","0.002","6.261","0.001","17.034","0.001","90","","132.49","0.03","90","","1325","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Sodium trans-Bis(methyliminodiacetato)chromate(III)","","- C10 H14 Cr N2 Na O8 -","- C10 H14 Cr N2 Na O8 -","- C40 H56 Cr4 N8 Na4 O32 -","4","0.5","MU1280","Suh, J.-S.; Park, S.-J.; Lee, K.-W.; Suh, I.-H.; Lee, J.-H.; Song, J.-H.; Oh, M.-R.","Sodium <i>trans</i>-Bis(methyliminodiacetato-<i>O</i>,<i>N</i>,<i>O</i>)chromate(III), Na[Cr(C~5~H~7~NO~4~)~2~]","Acta Crystallographica Section C","1997","53","4","432","434","10.1107/S0108270196013327","","","0.71069","MoKα","","0.0318","0.0284","","0.0797","0.0741","","","","0.168","0.166","0.166","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006072","10.268","0.001","13.845","0.002","11.742","0.002","90","","101.73","0.01","90","","1634.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","toluenesulfonamide 2(-)-limonene","","- C17 H23 N O2 S -","- C17 H23 N O2 S -","- C68 H92 N4 O8 S4 -","4","1","NA1220","","(±)-N-[1,8(10)-menthadien-3-yl]toluenesulfonamide","Acta Crystallographica C","1997","53","","519","521","10.1107/S0108270196013777","","","1.54178","CuKα","","0.055","0.0484","","0.1401","0.133","","","","1.059","1.076","1.076","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2006073","9.484","0.005","10.949","0.007","35.744","0.02","90","0","93.87","0.04","90","0","3703","4","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C34 H32 As Cl3 N3 O6 S Tc -","- C34 H31 As Cl9 N3 O6 S Tc -","- C136 H124 As4 Cl36 N12 O24 S4 Tc4 -","4","1","NA1260","Blaton, N. M.; Bormans, G.; Peeters, O. M.; Verbruggen, A.","Epimer B of Tetraphenylarsonium (Mercaptoacetylalanylglycylglycinato-<i>N</i>,<i>N</i>',<i>N</i>'',<i>S</i>)oxotechnetate(V) (^99^Tc) Chloroform Solvate","Acta Crystallographica Section C","1997","53","4","449","451","10.1107/S0108270196014874","","","0.71073","MoKα","","0.1437","0.0489","","0.1935","0.1317","","","","1.006","1.053","1.053","","","","","has coordinates","211412","2020-10-21","18:00:00",""
"2006074","10.152","0.003","9.407","0.003","19.448","0.008","90","","90.12","0.03","90","","1857.3","1.1","293","2","298","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Tris(2-hydroxymethyl)methylammonium (2,6-dichlorophenyl)amino-phenylacetate (HTRIS.D)","","- C18 H22 Cl2 N2 O5 -","- C18 H22 Cl2 N2 O5 -","- C72 H88 Cl8 N8 O20 -","4","1","NA1262","Castellari, C.; Ottani, S.","Anti-Inflammatory Drugs. V. [Tris-(2-hydroxymethyl)methyl]ammonium 2-[(2,6-Dichlorophenyl)amino]phenylacetate (TRISH. D)","Acta Crystallographica Section C","1997","53","4","482","486","10.1107/S0108270196013649","","","0.71069","MoKα","","0.1153","0.0403","","0.0866","0.067","","","","0.996","1.086","1.086","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006075","8.8435","0.001","8.7911","0.001","7.7906","0.001","90","","90","","90","","605.67","0.12","293","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","TRIS","Tris(2-hydroxymethyl)aminomethane","","- C4 H11 N O3 -","- C4 H11 N O3 -","- C16 H44 N4 O12 -","4","1","NA1262","Castellari, C.; Ottani, S.","Anti-Inflammatory Drugs. V. [Tris-(2-hydroxymethyl)methyl]ammonium 2-[(2,6-Dichlorophenyl)amino]phenylacetate (TRISH. D)","Acta Crystallographica Section C","1997","53","4","482","486","10.1107/S0108270196013649","","","0.71069","MoKα","","0.0352","0.032","","0.0883","0.0837","","","","1.042","1.045","1.045","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006076","7.17","0.001","30.766","0.001","16.91","0.001","90","","90","","90","","3730.2","0.6","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","isotretinoin","13-cis-retinoic acid","","- C20 H28 O2 -","- C20 H27.8 O2 -","- C160 H222.4 O16 -","8","","NA1267","Malpezzi, L.; Fuganti, C.; Grasselli, P.","Disorder in 13-<i>cis</i>-Retinoic Acid","Acta Crystallographica Section C","1997","53","4","508","511","10.1107/S0108270196014588","","","1.54178","CuKα","","0.0555","0.0449","","0.133","0.1216","","","","1.043","1.072","1.072","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006077","8.766","0.002","10.759","0.002","13.158","0.002","105.084","0.011","104.568","0.012","97.278","0.01","1134.9","0.4","298","","298","","","","","","","","","5","P -1","-P 1","2","","4-(1,7,8,9,10,10-Hexachloro-3,5-dioxo-4-aza-tricyclo-[5.2.1.0^2,6^]dec-8- en-4-yl-butyracid","","- C20 H17 Cl6 N O4 -","- C20 H17 Cl6 N O4 -","- C40 H34 Cl12 N2 O8 -","2","1","NA1268","Bartkowska, B.; Bohnen, F. M.; Krüger, C.; Maier, W. F.","4-(1,7,8,9,10,10-Hexachloro-3,5-dioxo-4-azatricyclo[5.2.1.0^2,6^]dec-8-en-4-yl)butyric Acid Toluene Solvate","Acta Crystallographica Section C","1997","53","4","521","522","10.1107/S0108270196015569","","","0.71069","MoKα","","0.0359","0.0337","","0.1104","0.109","","","","1.134","1.159","1.159","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006078","3.9851","0.0005","16.547","0.003","11.841","0.002","90","","93.2","0.01","90","","779.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4-dibromo-5-hydroxybenzaldehyde","","- C7 H4 Br2 O2 -","- C7 H4 Br2 O2 -","- C28 H16 Br8 O8 -","4","1","NA1276","Matos Beja, A.; Paixão, J. A.; Ramos Silva, M.; Alte da Veiga, L.; d Rocha Gonsalves, A. M.; Pereira, M. M.; Serra, A. C.","2,4-Dibromo-5-hydroxybenzaldehyde","Acta Crystallographica Section C","1997","53","4","494","496","10.1107/S0108270196015296","","","0.71073","MoKα","","0.1112","0.0279","","0.0681","0.0507","","","","1.013","1.018","1.018","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006079","12.268","0.002","7.52","0.002","12.338","0.002","90","","91.86","0.01","90","","1137.6","0.4","295","1","296","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C10 H11 Br2 N -","- C10 H11 Br2 N -","- C40 H44 Br8 N4 -","4","1","OA1016","Banwell, M. G.; Hockless, D. C. R.; Wu, A. W.","(<i>E</i>)-3-(2,2-Dibromospiro[2.4]heptan-1-yl)propenenitrile","Acta Crystallographica Section C","1997","53","4","504","506","10.1107/S0108270196014886","","","1.5418","CuKα","","0.1363","0.0774","","0.0605","0.0563","","","","1.743","2.107","2.107","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006080","11.232","0.004","9.175","0.003","10.444","0.004","90","0","107.09","0.03","90","0","1028.8","0.7","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C48 H48 N8 O8 -","4","0.5","OH1103","Kanno, H.; Iijima, K.","4,4'-Dimethyl-2,2'-bipyridine 1,1'-Dioxide","Acta Crystallographica Section C","1997","53","4","498","499","10.1107/S010827019601548X","","","0.71073","MoKα","","","0.0572","","","0.0585","","","","","1.59","1.59","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006081","8.468","0.002","9.778","0.003","15.193","0.001","90","","90","","90","","1258","0.5","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[N-hydroxy-2-méthylpyrrolidin-2-yl] phosphonate de diéthyle","","- C9 H20 N O4 P -","- C9 H20 N O4 P -","- C36 H80 N4 O16 P4 -","4","1","PA1234","Barbati, S.; Siri, D.; Tordo, P.; Reboul, J.-P.","(<i>N</i>-Hydroxy-2-méthylpyrrolidin-2-yl)phosphonate de Diéthyle","Acta Crystallographica Section C","1997","53","4","461","463","10.1107/S0108270196014448","","","0.71069","MoKα","","0.033","0.033","","0.032","0.032","","","","0.21","0.21","0.21","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006082","6.6446","0.0005","9.4721","0.0008","35.046","0.002","90","","90","","90","","2205.7","0.3","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(thian-5-one-1,1-dioxide)-3-spiro-3'-(5'-O-tert-butyldimethylsilyl-3'- deoxy-1',2'-O-isopropylidene-alpha-D-xylo-pentofuranose)","","- C18 H32 O7 S Si -","- C18 H32 O7 S Si -","- C72 H128 O28 S4 Si4 -","4","1","PA1244","Bernardinelli, G.; Tronchet, J. M. J.; Kovacs, I.","Absolute Structure of (Thian-5-one 1,1-dioxide)-3-spiro-3'-(5'-<i>O</i>-<i>tert</i>-butyldimethylsilyl-3'-deoxy-1',2'-<i>O</i>-isopropylidene-α-<small>D</small>-<i>xylo</i>-pentofuranose), a Novel Type of Spirosugar","Acta Crystallographica Section C","1997","53","4","511","513","10.1107/S010827019601445X","","","1.54184","CuKα","","0.068","0.059","","0.048","0.041","","","","3.432","3.101","3.101","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006083","32.156","0.013","7.114","0.002","12.118","0.006","90","","101.47","0.06","90","","2717","2","293","","293","","","","","","","","","4","C 1 2 1","C 2y","5","","(3R),(2'S)-2'-N-Dibenzylamino-1,2:5,6-diisopropylidène-α-D-allofuranos-3- spiro-β-propiolactone","","- C28 H33 N O7 -","- C28 H33 N O7 -","- C112 H132 N4 O28 -","4","1","PA1245","Chiaroni, A.; Riche, C.; Bouifraden, S.; Lavergne, J.-P.; Viallefont, P.","(3<i>R</i>,2'<i>S</i>)-2'-<i>N</i>-Dibenzylamino-1,2:5,6-di-<i>O</i>-isopropylidène-α-<small>D</small>-allofuranose-3-spiro-3'-β-propiolactone","Acta Crystallographica Section C","1997","53","4","457","459","10.1107/S0108270196014461","","","1.5418","CuKα","","","0.054","","","0.072","","","","","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006084","7.473","0.002","13.971","0.006","21.769","0.011","90","","90","","90","","2272.8","1.6","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","méthyl (2R,5S)-1-N-benzyl-5-méthoxycarbonylprolyl-(2S)-phénylalaninate","","- C24 H28 N2 O5 -","- C24 H28 N2 O5 -","- C96 H112 N8 O20 -","4","1","PA1246","Chiaroni, A.; Riche, C.; Zair, T.; Guenoun, F.; Lazaro, R.; Viallefont, P.","Méthyl <i>N</i>-[(2<i>R</i>,5<i>S</i>)-1-<i>N</i>-Benzyl-5-méthoxycarbonylprolyl]-(<i>S</i>)-phénylalaninate","Acta Crystallographica Section C","1997","53","4","459","461","10.1107/S0108270196014606","","","1.5418","CuKα","","","0.075","","","0.107","","","","","1.09","1.09","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2006085","5.131","0.005","13.261","0.008","12.718","0.005","90","","94.95","0.08","90","","862.1","1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[(1,2-ethanediyl)bis(nitrilopropylidyne)]bisphenol","","- C20 H24 N2 O2 -","- C20 H24 N2 O2 -","- C40 H48 N4 O4 -","2","0.5","PA1247","Corden, J. P.; Errington, W.; Moore, P.; Wallbridge, M. G. H.","Two Schiff Base Ligands Derived from 1,2-Diaminoethane","Acta Crystallographica Section C","1997","53","4","486","488","10.1107/S0108270196014473","","","0.71073","MoKα","","0.0952","0.0423","","0.0927","0.0809","","","","0.723","1.002","1.002","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006086","18.53","0.008","13.443","0.01","17.737","0.008","90","","90","","90","","4418","4","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2,2'-[(1,2-ethanediyl)bis(nitrilobenzylidyne)]bisphenol","","- C28 H24 N2 O2 -","- C28 H24 N2 O2 -","- C224 H192 N16 O16 -","8","2","PA1247","Corden, J. P.; Errington, W.; Moore, P.; Wallbridge, M. G. H.","Two Schiff Base Ligands Derived from 1,2-Diaminoethane","Acta Crystallographica Section C","1997","53","4","486","488","10.1107/S0108270196014473","","","0.71073","MoKα","","0.1121","0.0394","","0.0854","0.0674","","","","0.546","0.796","0.796","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006087","17.491","0.004","14.236","0.003","18.656","0.004","90","","100.24","0.02","90","","4571.4","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","μ-hydrido-μ-dicyclohexylphosphido-bis(dicyclohexylphosphine-tricarbonyl- rhenium)","","- C42 H69 O6 P3 Re2 -","- C42 H69 O6 P3 Re2 -","- C168 H276 O24 P12 Re8 -","4","0.5","SK1060","Flörke, U.; Haupt, H.-J.","μ-Hydrido-μ-dicyclohexylphosphido-bis[dicyclohexylphosphine(tricarbonyl)rhenium]","Acta Crystallographica Section C","1997","53","4","404","406","10.1107/S0108270196014291","","","0.71073","MoKα","","0.0784","0.0424","","0.0635","0.0575","","","","0.944","1.063","1.063","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006088","19.818","0.004","6.676","0.002","20.035","0.004","90","","109.044","0.011","90","","2505.7","1","294","","294","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(2'-Dimethylaminoethyl)-2-hydroxy-5-nitrobenzylamine","","- C11 H17 N3 O3 -","- C11 H17 N3 O3 -","- C88 H136 N24 O24 -","8","1","AB1425","Hazell, Alan; Overgaard, Jacob; Lausen, Søren Konstmann; Hu, Hongjuan; Khoo, Lian Ee","2-[2-(Dimethylamino)ethylammoniomethyl]-4-nitrophenolate","Acta Crystallographica Section C","1997","53","5","640","641","10.1107/S0108270196015491","","","0.71073","MoKα","","","0.065","","","0.069","","","","","1.28","1.28","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2006089","10.4657","0.0006","10.8221","0.0005","11.416","0.0005","76.542","0.004","65.033","0.004","73.103","0.004","1112.49","0.1","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","Bis(2,2,6,6,10,10-hexamethyl-4,8-dioxaundecanedioate)bis(pyridine)dirhodium(II)","","- C40 H62 N2 O12 Rh2 -","- C40 H62 N2 O12 Rh2 -","- C40 H62 N2 O12 Rh2 -","1","0.5","AB1452","Gallagher, John F.; Ferguson, George; McAlees, Alan J.","Bis(μ-2,2,6,6,10,10-hexamethyl-4,8-dioxaundecanedioato-<i>O</i>^1^,<i>O</i>^11^:<i>O</i>^1'^,<i>O</i>^11'^)bis(pyridine-<i>N</i>)dirhodium(II)(<i>Rh</i>—<i>Rh</i>)","Acta Crystallographica Section C","1997","53","5","576","579","10.1107/S010827019700142X","","","0.7107","MolybdenumKα","","0.027","0.0195","","0.0462","0.0447","","","","1.028","1.07","1.07","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006090","11.2525","0.0011","7.095","0.0012","18.612","0.002","90","","90","","90","","1485.9","0.3","294","1","294","1","","","","","","","","4","P n m a","-P 2ac 2n","62","","1,4-Diazabicyclo[2.2.2]octane‒1,3,5-benzenetricarboxylic acid (1/1). .","","- C15 H18 N2 O6 -","- C15 H18 N2 O6 -","- C60 H72 N8 O24 -","4","0.5","AB1456","Meehan, Paul R.; Ferguson, George; Glidewell, Christopher; Patterson, Iain L.J.","Molecular Tiling in the 1:1 Adduct of 1,4-Diazabicyclo[2.2.2]octane and 1,3,5-Benzenetricarboxylic Acid","Acta Crystallographica Section C","1997","53","5","628","631","10.1107/S0108270197001200","","","0.7107","MolybdenumKα","","0.0912","0.0489","","0.1531","0.1407","","","","1.06","1.288","1.288","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006091","10.358","0.002","13.627","0.003","13.872","0.003","90.16","0.01","98.47","0.01","103.23","0.01","1883.9","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Sodium (μ-hydroxo)-bis(1,10-phenanthroline-N,N')- bis(thiosulfate-S)-di-Zinc(II), 4.35 hydrate, 0.85 methanol solvate","","- C28.85 H37.1 N4 Na O12.2 S4 Zn2 -","- C28.85 H37.1 N4 Na O12.2 S4 Zn2 -","- C57.7 H74.2 N8 Na2 O24.4 S8 Zn4 -","2","1","BK1290","Baggio, Sergio; Pardo, Maria I.; Baggio, Ricardo; Garland, Maria Teresa","Sodium Bis(2,9-dimethyl-1,10-phenanthroline)-μ-hydroxo-di(thiosulfato)dizinc(II) Pentahydrate Methanol Solvate","Acta Crystallographica Section C","1997","53","5","551","554","10.1107/S0108270196015375","","","0.71073","MoKα","","0.064","0.039","","0.112","0.095","","","","0.96","0.975","0.975","","","","","has coordinates","199684","2020-10-21","18:00:00",""
"2006092","21.329","0.005","9.268","0.005","8.262","0.005","90","0.005","106.16","0.005","90","0.005","1568.7","1.3","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","(1S,2R,3S,4R)-3-Benzamido-3-methoxycarbonylbicyclo[2.2.1]heptane-2- carboxylic acid.","","- C17 H19 N O5 -","- C17 H19 N O5 -","- C68 H76 N4 O20 -","4","1","BM1118","Buñuel, Elena; Cativiela, Carlos; Díaz-de-Villegas, María D.; Gálvez, José A.","A Conformationally Restricted Aspartic Acid Analogue with a Norbornane Skeleton. II","Acta Crystallographica Section C","1997","53","5","626","628","10.1107/S0108270196015727","","","0.71073","MoKα","","0.0862","0.0688","","0.2488","0.1894","","","","1.117","1.152","1.152","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006093","9.8797","0.0007","12.2119","0.0008","7.6464","0.0006","90","","104.394","0.006","90","","893.58","0.11","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","Trisodium trimetaphosphimate monohydrate","Trisodium-tri-μ-imido-cyclotriphosphate monohydrate","","- H5 N3 Na3 O7 P3 -","- H5 N3 Na3 O7 P3 -","- H20 N12 Na12 O28 P12 -","4","1","BM1119","Stock, Norbert; Schnick, Wolfgang","Trisodium Trimetaphosphimate Monohydrate","Acta Crystallographica Section C","1997","53","5","532","534","10.1107/S010827019601520X","","","0.71073","MoKα","","0.0435","0.0311","","0.0663","0.0619","","","","1.031","1.04","1.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006094","12.761","0.002","12.1276","0.0013","7.9969","0.0009","90","","102.907","0.01","90","","1206.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-9-(Carboxymethyl)-2,6-diazidopurine methyl ester","","- C8 H6 N10 O2 -","- C8 H6 N10 O2 -","- C32 H24 N40 O8 -","4","1","BM1122","Sood, Geeta; Schwalbe, Carl H.; Fraser, William","2,6-Diazido-9-(carboxymethyl)purine Methyl Ester","Acta Crystallographica Section C","1997","53","5","608","610","10.1107/S0108270196015764","","","1.54178","CuKα","","0.0916","0.0629","","0.1961","0.1646","","","","1.036","1.119","1.119","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006095","20.86","0.004","9.09","0.002","17.202","0.003","90","","92.23","0.03","90","","3259.3","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Bis(1,1-bis(dimethylphosphonate)-1-hydroxyethane) praseodymium trinitrate","Bis(1,1-bis(dimethylphosphonato)-1-hydroxyethane) praseodymium (III) nitrate","","- C12 H32 N3 O23 P4 Pr -","- C12 H32 N2.5 O22.5 P4 Pr0.5 -","- C48 H128 N10 O90 P16 Pr2 -","4","0.5","BM1127","Lees, Anthony M. J.; Platt, Andrew W. G.; Kresinski, Roman A.","Bis[1-hydroxyethane-1,1-diylbis(dimethyl phosphonate-<i>O</i>)]tris(nitrato-<i>O</i>,<i>O</i>')praseodymium","Acta Crystallographica Section C","1997","53","5","581","583","10.1107/S0108270197000437","","","0.71069","MoKα","","0.0359","0.0348","","0.0881","0.0868","","","","0.825","0.836","0.836","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006096","7.761","0.001","11.513","0.003","5.5234","0.0009","90","","90","","90","","493.53","0.16","293","","","","","","","","","","","3","C m m a","-C 2a 2","67","","","","- Ba F6 Tb -","- Ba F6 Tb -","- Ba4 F24 Tb4 -","4","0.25","BR1157","Largeau, Eric; El-Ghozzi, Malika; Métin, Jacques; Avignant, Daniel","β-BaTbF~6~","Acta Crystallographica Section C","1997","53","5","530","532","10.1107/S0108270196014527","","","0.71073","MoKα","","","0.026","","","0.03","","","","","1.615","1.615","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006097","13.843","0.002","10.683","0.002","8.155","0.002","90","","99.13","0.02","90","","1190.7","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis[N-(4-bromophenyl)salicylaldimine]copper(II)","","- C26 H18 Br2 Cu N2 O2 -","- C26 H18 Br2 Cu N2 O2 -","- C52 H36 Br4 Cu2 N4 O4 -","2","0.5","CF1096","Elerman, Yalçin; Geselle, Marcus","Bis[<i>N</i>-(4-bromophenyl)salicylaldimine]copper(II)","Acta Crystallographica Section C","1997","53","5","549","551","10.1107/S010827019601387X","","","0.71073","MoKα","","","0.0434","","","0.1208","","","","","1.117","1.117","","","","","has coordinates,has Fobs","191978","2020-10-21","18:00:00",""
"2006098","14.224","0.002","8.882","0.002","22.885","0.005","90","","101.47","0.01","90","","2833.5","1","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 N2 O12 Pb -","- C26 H28 N2 O12 Pb -","- C104 H112 N8 O48 Pb4 -","4","1","CF1121","Lin, Ching-Shan; Liu, Lilian Kao; Ueng, Chuen-Her","(Benzyl <i>sym</i>-dibenzo-16-crown-5 ether)lead(II) Dinitrate","Acta Crystallographica Section C","1997","53","5","574","576","10.1107/S0108270196015739","","","0.7107","MoKα","","","0.035","","","0.026","","","","","2.05","2.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006099","3.725","0.001","4.773","0.001","4.936","0.001","107.03","0.02","107.23","0.02","101.57","0.02","76.08","0.04","293","","293","","","","","","","","","3","P 1","P 1","1","tetrazole","α-1H-1,2,3,4-tetrazole","","- C H2 N4 -","- C H2 N4 -","- C H2 N4 -","1","1","CF1151","Goddard, Richard; Heinemann, Oliver; Krüger, Carl","α-1<i>H</i>-1,2,3,4-Tetrazole","Acta Crystallographica Section C","1997","53","5","590","592","10.1107/S0108270197000772","","","0.71069","MoKα","","0.0436","0.042","","0.101","0.099","","","","1.111","1.12","1.12","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006100","18.52","0.002","5.7602","0.0007","16.788","0.002","90","","114.78","0.02","90","","1626","0.4","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(N-propionamido-β-alaninatocopper(II) hydrate","","- C12 H24 Cu N4 O7 -","- C12 H24 Cu N4 O7 -","- C48 H96 Cu4 N16 O28 -","4","0.5","DE1046","Chen, Wei; Lim, Meng-chay","Two Isomeric Bis(<i>n</i>-propionamidoalaninato)copper(II) Hydrate Complexes, [Cu(C~6~H~11~N~2~O~3~)~2~].H~2~O","Acta Crystallographica Section C","1997","53","5","539","543","10.1107/S0108270196015417","","","0.71073","MoKα","","0.0542","0.0339","","0.1054","0.0882","","","","0.756","0.732","0.732","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006101","18.357","0.003","5.7887","0.0004","17.728","0.003","90","","119.52","0.02","90","","1639.3","0.5","300","2","300","2","","","","","","","","5","C 1 2 1","C 2y","5","","bis(N-propionamido-α-alaninato)copper(II) hydrate","","- C12 H24 Cu N4 O7 -","- C12 H24 Cu N4 O7 -","- C48 H96 Cu4 N16 O28 -","4","1","DE1046","Chen, Wei; Lim, Meng-chay","Two Isomeric Bis(<i>n</i>-propionamidoalaninato)copper(II) Hydrate Complexes, [Cu(C~6~H~11~N~2~O~3~)~2~].H~2~O","Acta Crystallographica Section C","1997","53","5","539","543","10.1107/S0108270196015417","","","0.71073","MoKα","","0.0395","0.0338","","0.0776","0.073","","","","1.113","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006102","6.8175","0.0008","10.762","0.002","13.71","0.002","90","","90","","90","","1006","0.3","300","2","300","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H11 Br Cu N2 O3 -","- C6 H11 Br Cu N2 O3 -","- C24 H44 Br4 Cu4 N8 O12 -","4","1","","Chen, Wei; Lim, Meng-chay","Two Isomeric Bis(n-propionamidoalaninato)copper(II) Hydrate Complexes, [Cu(C~6~H~11~N~2~O~3~)~2~].H~2~O","Acta Crystallographica Section C","1997","53","","539","543","","","","","","","","0.0292","","","0.0516","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2006103","7.6203","0.0004","10.2094","0.0009","14.045","0.002","90","","90","","90","","1092.7","0.2","300","2","300","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H13 Br Cu N2 O4 -","- C6 H11 Br Cu N2 O4 -","- C24 H44 Br4 Cu4 N8 O16 -","4","1","DE1046","Chen, Wei; Lim, Meng-chay","Two Isomeric Bis(n-propionamidoalaninato)copper(II) Hydrate Complexes, [Cu(C~6~H~11~N~2~O~3~)~2~].H~2~O","Acta Crystallographica Section C","1997","53","5","539","543","10.1107/S0108270196015417","","","","","","","0.0478","","","0.1148","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2006104","12.03","0.001","19.854","0.002","17.091","0.002","90","","97.21","0.01","90","","4049.8","0.7","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","chloro(tri-n-butylphosphine)cobaloxime","trans-chlorobis(diphenylglyoximato)(tri-n-butylphosphine)cobalt(III)","","- C40 H49 Cl Co N4 O4 P -","- C40 H22 Cl Co N4 O4 P -","- C160 H88 Cl4 Co4 N16 O16 P4 -","4","1","FG1214","Barton, Richard J.; Major, Quinn; Mihichuk, Lynn M.; Robertson, Beverly E.; Seip, Candace","<i>trans</i>-Chlorobis(diphenylglyoximato)(tri-<i>n</i>-butylphosphine)cobalt(III)","Acta Crystallographica Section C","1997","53","5","568","570","10.1107/S010827019601565X","","","0.713543","MoKα","","0.101","0.085","","0.044","0.043","","","","1.322","1.352","1.352","","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2006105","11.115","0.002","15.077","0.003","17.182","0.003","65.191","0.012","87.299","0.01","79.709","0.012","2570.3","0.9","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","meso-dimethyl-bis([2.2]paracyclophan-4-yl)silane","","- C34 H36 Si -","- C34 H36 Si -","- C136 H144 Si4 -","4","2","FG1229","Jones, Peter G.; Ernst, Ludger; Dix, Ina; Wittkowski, Lars","A Diastereomeric Pair of Cyclophane Derivatives: Planar‒Chiral and <i>meso</i>-Dimethylbis([2.2]paracyclophan-4-yl)silane","Acta Crystallographica Section C","1997","53","5","612","615","10.1107/S0108270197000085","","","0.71073","MoKα","","0.1511","0.0531","","0.1106","0.0876","","","","0.788","1.007","1.007","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006106","13.941","0.002","17.694","0.002","10.4379","0.0014","90","","93.089","0.01","90","","2571","0.6","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","chiral dimethyl-bis([2.2]paracyclophan-4-yl)silane","","- C34 H36 Si -","- C34 H36 Si -","- C136 H144 Si4 -","4","1","FG1229","Jones, Peter G.; Ernst, Ludger; Dix, Ina; Wittkowski, Lars","A Diastereomeric Pair of Cyclophane Derivatives: Planar‒Chiral and <i>meso</i>-Dimethylbis([2.2]paracyclophan-4-yl)silane","Acta Crystallographica Section C","1997","53","5","612","615","10.1107/S0108270197000085","","","0.71073","MoKα","","0.078","0.0457","","0.1144","0.1034","","","","0.92","1.059","1.059","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006107","11.872","0.002","8.477","0.002","34.557","0.005","90","","93.36","0.006","90","","3471.8","1.1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H31 Au B9 Cl5 P2 -","- C27 H31 Au B9 Cl5 P2 -","- C108 H124 Au4 B36 Cl20 P8 -","4","1","FG1231","Jones, Peter G.; Villacampa, M. Dolores; Crespo, Olga; Gimeno, M. Concepcíon; Laguna, Antonio","<i>cis</i>-[7,8-Bis(diphenylphosphino)-7,8-dicarba-<i>nido</i>-undecaborato-<i>P</i>,<i>P</i>']dichlorogold(III) Chloroform Solvate","Acta Crystallographica Section C","1997","53","5","570","572","10.1107/S0108270197002059","","","0.71073","MoKα","","0.0834","0.0412","","0.07","0.0624","","","","0.82","0.942","0.942","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006108","9.142","0.004","9.687","0.004","10.449","0.005","113.07","0.03","94.14","0.03","115.15","0.03","738.3","0.7","178","2","178","2","","","","","","","","5","P -1","-P 1","2","","trans-3,5-Dioxo-3,5-diphenyl-4-oxa-1,3,5-thia-diphosphorinane","","- C14 H14 O3 P2 S -","- C14 H14 O3 P2 S -","- C28 H28 O6 P4 S2 -","2","1","FG1232","Jones, Peter G.; Weinkauf, Andreas","<i>trans</i>-3,5-Diphenyl-1,4,2,6-oxathiadiphosphorinane-3,5-dione","Acta Crystallographica Section C","1997","53","5","615","616","10.1107/S0108270197000073","","","0.71073","MoKα","","0.0339","0.0301","","0.0811","0.0776","","","","1.038","1.047","1.047","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006109","6.78","0.001","10.229","0.003","15.991","0.002","90","","98.83","0.02","90","","1095.9","0.4","293","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(+/-)-4,5-Dihydro-1-oxo-2a(3H)-acenaphthylenecarboxylic acid","","- C13 H12 O3 -","- C13 H12 O3 -","- C52 H48 O12 -","4","1","FG1238","Brunskill, Andrew P. J.; Thompson, Hugh W.; Lalancette, Roger A.","Catemeric Hydrogen Bonding in a γ-Keto Acid: (±)-2a,3,4,5-Tetrahydro-1(2<i>H</i>)-oxoacenaphthylene-2a-carboxylic Acid","Acta Crystallographica Section C","1997","53","5","599","601","10.1107/S0108270196015144","","","0.71073","MoKα","","0.1109","0.0565","","0.1481","0.1209","","","","1.037","1.133","1.133","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006110","14.4649","0.0009","18.015","0.002","8.0881","0.0008","90","","90","","90","","2107.6","0.3","20","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[1aS]-6-amino-8{[(aminocarbonyl)oxy]methyl}-1,1a,2,8,8a,8b- hexahydro-8a-methoxy-5-phenylthiomethylazirino[2',3':3,4]- pyrrolo[1,2-a]indole-4,7-dione","","- C21 H22 N4 O5 S -","- C21 H22 N4 O5 S -","- C84 H88 N16 O20 S4 -","4","1","FR1007","Sugaya, Nobutaka; Fujii, Isao; Hirayama, Noriaki; Arai, Hitoshi; Kasai, Masaji","Structural Studies of Mitomycins. IX. 6-Demethyl-6-(phenylthiomethyl)mitomycin C","Acta Crystallographica Section C","1997","53","5","610","612","10.1107/S0108270196015612","","","1.5418","CuKα","","","0.052","","","0.08","","","","","2.38","2.38","","","","","has coordinates,has disorder","194531","2020-10-21","18:00:00",""
"2006111","14.637","0.003","16.46","0.002","6.629","0.002","90","","90","","90","","1597.1","0.6","296","","296","","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C7 H9 N O3 S -","- C7 H9 N O3 S -","- C56 H72 N8 O24 S8 -","8","1","","Sugaya, Nobutaka; Fujii, Isao; Hirayama, Noriaki; Arai, Hitoshi; Kasai, Masaji","Structural Studies of Mitomycins. IX. Structure of 6-Demethyl-6-(phenylthiomethyl)mitomycin C","Acta Crystallographica Section C","1997","53","","610","612","","","","","","","","0.058","","","0.038","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2006112","15.908","0.002","7.337","0.005","16.798","0.002","90","","117.145","0.006","90","","1744.7","1.2","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-aminotoluene-3-sulfonic acid hemihydrate","","- C7 H10 N O3.5 S -","- C7 H10 N O3.5 S -","- C56 H80 N8 O28 S8 -","8","2","FR1011","Leonard, Melvin A.; Squattrito, Philip J.","Anhydrous and Hydrated 4-Aminotoluene-3-sulfonic Acid","Acta Crystallographica Section C","1997","53","5","648","651","10.1107/S0108270196015600","","","0.7107","MoKα","","","0.087","","","0.045","","","","","1.95","1.95","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006113","10.246","0.002","5.524","0.002","19.973","0.001","90","","90.463","0.009","90","","1130.4","0.5","173","2","173.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 N2 O2 -","- C13 H12 N2 O2 -","- C52 H48 N8 O8 -","4","1","FR1017","William H. Ojala; Ramaswamy A. Iyer; Patrick E. Hanna; William B. Gleason","Heterocyclic <i>N</i>-Acetoxyarylamines, Models for the Putative Ultimate Carcinogens of Aromatic Amines: 2-Acetoxyamino-5-phenylpyridine and 2-Acetoxyaminopyridine","Acta Crystallographica Section C","1997","53","5","634","637","10.1107/S0108270196015168","","","1.5418","CuKα","","","0.0369","","","0.0464","","","","","2.165","2.165","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006114","9.432","0.001","5.472","0.002","14.9983","0.0009","90","","101.657","0.007","90","","758.1","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 N2 O2 -","- C7 H8 N2 O2 -","- C28 H32 N8 O8 -","4","1","FR1017","William H. Ojala; Ramaswamy A. Iyer; Patrick E. Hanna; William B. Gleason","Heterocyclic <i>N</i>-Acetoxyarylamines, Models for the Putative Ultimate Carcinogens of Aromatic Amines: 2-Acetoxyamino-5-phenylpyridine and 2-Acetoxyaminopyridine","Acta Crystallographica Section C","1997","53","5","634","637","10.1107/S0108270196015168","","","1.5418","CuKα","","","0.0359","","","0.0362","","","","","2.602","2.602","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006115","9.823","0.002","19.6","0.002","11.384","0.002","90","","93.26","0.02","90","","2188.2","0.6","292","","292","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Trifluoromethyl(cobalt) tricarbonyl triphenylphosphine","","- C22 H15 Co F3 O3 P -","- C22 H15 Co F3 O3 P -","- C88 H60 Co4 F12 O12 P4 -","4","1","FR1018","Mullica, Donald F.; Sappenfield, Eric L.; Gipson, Stephen L.; Wilkinson, Chad C.","Tricarbonyl(trifluoromethyl)(triphenylphosphine)cobalt","Acta Crystallographica Section C","1997","53","5","572","574","10.1107/S0108270196015910","","","0.71073","MoKα","","0.098","0.051","","0.729","0.065","","","","","1.59","1.59","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006116","7.602","0.001","8.662","0.001","7.505","0.001","94.64","0.01","96.48","0.01","67.2","0.01","452.3","0.11","296","","296","","","","","","","","","4","P -1","-P 1","2","4-aminoquinoline-2-carboxylic acid monohydrate","4-aminoquinoline-2-carboxylic acid monohydrate","","- C10 H10 N2 O3 -","- C10 H10 N2 O3 -","- C20 H20 N4 O6 -","2","1","FR1021","Burd, Craig J.; Dobson, Allison J.; Gerkin, Roger E.","α and β Phases of 4-Aminoquinoline-2-carboxylic Acid Monohydrate","Acta Crystallographica Section C","1997","53","5","602","605","10.1107/S0108270197000565","","","0.71073","MoKα","","","0.04","","","0.055","","","","","2.3","2.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006117","7.378","0.001","7.306","0.001","16.833","0.001","90","","95.544","0.007","90","","903.12","0.18","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-aminoquinoline-2-carboxylic acid monohydrate","4-aminoquinoline-2-carboxylic acid monohydrate","","- C10 H10 N2 O3 -","- C10 H10 N2 O3 -","- C40 H40 N8 O12 -","4","1","FR1021","Burd, Craig J.; Dobson, Allison J.; Gerkin, Roger E.","α and β Phases of 4-Aminoquinoline-2-carboxylic Acid Monohydrate","Acta Crystallographica Section C","1997","53","5","602","605","10.1107/S0108270197000565","","","0.71073","MoKα","","","0.045","","","0.054","","","","","1.67","1.67","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006118","10.839","0.002","13.519","0.003","18.939","0.004","90","","90","","90","","2775.2","1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1-Styrylsilatrane","E-1-(2-phenylethenyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane","","- C14 H19 N O3 Si -","- C14 H19 N O3 Si -","- C112 H152 N8 O24 Si8 -","8","1","FR1023","Stradiotto, Mark; Crowe, Grant; Ruffolo, Ralph; Brook, Michael A.","1-Styrylsilatrane","Acta Crystallographica Section C","1997","53","5","637","639","10.1107/S0108270197000310","","","0.56086","AgKα","","0.2333","0.0554","","0.1305","0.0879","","","","0.761","1.089","1.089","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006119","12.148","0.002","20.749","0.003","13.026","0.002","90","","113.68","0.01","90","","3006.9","0.8","294","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis-nitrilotriacet-N-amide : lead (II) nitrate","","- C18 H36 N10 O12 Pb -","- C18 H36 N10 O12 Pb -","- C72 H144 N40 O48 Pb4 -","4","1","FR1025","Skrzypczak-Jankun, Ewa","2:1 Complex of <i>N</i>,<i>N</i>',<i>N</i>''-Trimethylnitrilotriacetamide and Pb(NO~3~)~2~","Acta Crystallographica Section C","1997","53","5","579","581","10.1107/S0108270197000693","","","0.71073","MoKα","","","0.028","","","0.035","","","","","1.114","1.114","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2006120","16.353","0.009","30.264","0.009","8.461","0.008","90","","90","","90","","4187","5","193","2","193","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2-(7,9-Diphenylcyclopenta[a]acenaphtadien-6b-yl)ethylbromide","","- C29 H21 Br -","- C29 H21 Br -","- C232 H168 Br8 -","8","1","HA1185","Gerhard Jany; Marina Gustafsson; Timo Repo; Martti Klinga; Markku Leskelä","2-(7,9-Diphenylcyclopenta[<i>a</i>]acenaphthadien-6b-yl)ethylbromide","Acta Crystallographica Section C","1997","53","5","644","646","10.1107/S0108270197000632","","","0.71073","MoKα","","0.129","0.0712","","0.2757","0.1871","","","","1.119","1.188","1.188","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006121","14.133","0.002","8.642","0.002","8.7698","0.0011","90","","93.89","0.03","90","","1068.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","5-(Dimethylamino)-8-methyl-2-quinolone","5-(Dimethylamino)-8-methyl-2-quinolone","","- C12 H14 N2 O -","- C12 H14 N2 O -","- C48 H56 N8 O4 -","4","1","JZ1147","Sudha, L.; Subramanian, K.; Steiner, Thomas; Koellner, Gertraud; Ramakrishnan, V. T. R.; Sriraghavan, K.","5-Dimethylamino-8-methyl-2-quinolone","Acta Crystallographica Section C","1997","53","5","606","607","10.1107/S0108270196010621","","","1.54176","CuKα","","0.0572","0.0446","","0.127","0.1222","","","","1.095","1.197","1.197","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006122","9.556","0.003","18.257","0.003","18.629","0.003","90","","90","","90","","3250.1","1.3","293","2","293","2","","","","","","","","4","P c 21 b","P -2bc -2c","29","","3-Acetamido-4-N-cyclooctylaminonitrobenzene","","- C16 H23 N3 O3 -","- C16 H23 N3 O3 -","- C128 H184 N24 O24 -","8","2","KA1198","González-Platas, J.; Ruiz-Pérez, C.; Torres, M.; Yanes, C.","3-Acetamido-4-(cyclooctylamino)nitrobenzene","Acta Crystallographica Section C","1997","53","5","651","654","10.1107/S0108270196007202","","","0.71069","MoKα","","0.1577","0.0639","","0.2117","0.157","","","","1.034","1.157","1.157","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006123","9.32","0.002","9.9726","0.0014","17.203","0.004","90","","104.831","0.015","90","","1545.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2-thienylpyridin)platin(II)","","- C18 H12 N2 Pt S2 -","- C18 H12 N2 Pt S2 -","- C72 H48 N8 Pt4 S8 -","4","1","KA1218","Breu, Josef; Range, Klaus-Jürgen; von Zelewsky, Alex; Yersin, Hartmut","Arene‒Arene Stacking in <i>cis</i>-Bis[2-(2-thienyl-<i>C</i>^3^)pyridine-<i>N</i>]platinum(II)","Acta Crystallographica Section C","1997","53","5","562","565","10.1107/S0108270196015053","","","0.71069","MoKα","","0.0298","0.0265","","0.0728","0.0714","","","","1.072","1.118","1.118","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006124","9.276","0.006","9.879","0.006","22.499","0.013","92.54","0.04","95.08","0.04","102.67","0.04","1999","2","291","1","291","1","","","","","","","","4","P -1","-P 1","2","","Bis[2-(triphenylsilyl)phenyl] Disulphide","","- C48 H38 S2 Si2 -","- C48 H38 S2 Si2 -","- C96 H76 S4 Si4 -","2","1","KA1224","Miller, John R.; Lu, Canzhong; Zheng, Yifan","Bis[2-(triphenylsilyl)phenyl] Disulfide","Acta Crystallographica Section C","1997","53","5","654","655","10.1107/S0108270197001662","","","0.71073","MoKα","","0.0677","0.0375","","0.1172","0.1018","","","","1.01","1.041","1.041","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006125","11.198","0.002","8.836","0.006","25.795","0.007","90","","98.34","0.02","90","","2525.3","1.9","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H40 Cl2 N4 O9 -","- C16 H40 Cl2 N4 O9 -","- C64 H160 Cl8 N16 O36 -","4","1","KH1117","Hu, Huai-Ming; Sun, Hong-Sui; Huang, Xiao-Ying; Chen, Xiao-Hua; Liu, Yonyjiang; You, Xiao-Zeng","<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane Dihydroperchlorate Monohydrate","Acta Crystallographica Section C","1997","53","5","588","590","10.1107/S0108270196014667","","","0.71073","MoKα","","","0.061","","","0.07","","","","","1.76","1.76","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2006126","11.792","0.001","15.799","0.001","20.925","0.002","105.31","0.01","96.27","0.001","106.17","0.01","3540.3","0.6","289","2","289","2","","","","","","","","6","P -1","-P 1","2","","","","- C65 H82 N4 Na2 O20 S4 -","- C65 H82 N4 Na2 O20 S4 -","- C130 H164 N8 Na4 O40 S8 -","2","1","KH1122","Long, De-Liang; Jin, Qun-Hua; Xin, Xin-Quan; Yu, Kai-bei","Bis(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-pentaoxabenzo[<i>b</i>]cyclopentadecene-<i>O</i>^1^,<i>O</i>^4^,<i>O</i>^7^,<i>O</i>^10^,<i>O</i>^13^)sodium(1+) 1,1,7,7-Tetracyano-3,5-dithiahepta-1,6-diene-2,6-dithiolate(2 ‒) (2/1)","Acta Crystallographica Section C","1997","53","5","554","556","10.1107/S010827019601517X","","","0.71073","MoKα","","0.0914","0.0521","","0.1494","0.1368","","","","0.954","1.193","1.193","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006127","10.085","0.002","19.66","0.002","13.096","0.002","90","","96.683","0.008","90","","2578.9","0.7","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aqua(p-chlorophenyl)diphenyl-N-phthaloylglycinatotin","","- C28 H22 Cl N O5 Sn -","- C28 H22.01 Cl1.01 N O5 Sn -","- C112 H88.04 Cl4.04 N4 O20 Sn4 -","4","1","KH1124","Lo, Kong Mun; Ng, Seik Weng; Kumar Das, V. G.","Aqua(<i>p</i>-chlorophenyl)diphenyl(<i>N</i>-phthaloylglycinato)tin(IV)","Acta Crystallographica Section C","1997","53","5","545","546","10.1107/S0108270196014837","","","0.71073","MoKα","","0.0501","0.0342","","0.0878","0.083","","","","1.031","1.114","1.114","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006128","11.003","0.001","13.3701","0.0009","18.408","0.002","90","","96.734","0.005","90","","2689.3","0.4","298","2","2980","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tricyclohexyl-N-phthaloylglycinatotin","","- C28 H39 N O4 Sn -","- C28 H39 N O4 Sn -","- C112 H156 N4 O16 Sn4 -","4","1","KH1125","Ng, Seik Weng; Kumar Das, V. G.","Tricyclohexyl(<i>N</i>-phthaloylglycinato)tin(IV)","Acta Crystallographica Section C","1997","53","5","546","548","10.1107/S0108270196014849","","","0.71073","MoKα","","0.0706","0.0446","","0.0942","0.0862","","","","0.98","1.081","1.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006129","9.3375","0.0008","10.0667","0.0009","17.456","0.002","79.866","0.009","81.874","0.009","62.776","0.007","1432.8","0.3","300","","300","","","","","","","","","6","P -1","-P 1","2","","Tricyclohexyltin N,N-diethyldithiocarbamoylacetate","","- C25 H45 N O2 S2 Sn -","- C25 H45 N O2 S2 Sn -","- C50 H90 N2 O4 S4 Sn2 -","2","1","KH1130","Ng, Seik Weng; Kumar Das, V. G.","Tricyclohexyl[(<i>N</i>,<i>N</i>-diethylthiocarbamoylthio)acetato-<i>O</i>]tin(IV)","Acta Crystallographica Section C","1997","53","5","548","549","10.1107/S010827019601493X","","","0.71073","MoKα","","0.0444","0.0375","","0.1115","0.1058","","","","1.166","1.182","1.182","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006130","10.5774","0.0004","7.0688","0.0003","25.62","0.001","90","","90","","90","","1915.6","0.13","300","","300","","","","","","","","","4","P b c a","-P 2ac 2ab","61","2-Sulfobenzoic acid hydrate","Hydronium hydrogen 2-sulfobenzoate","","- C7 H8 O6 S -","- C7 H8 O6 S -","- C56 H64 O48 S8 -","8","1","KH1131","Ng, Seik Weng","Hydronium 2-Carboxybenzenesulfonate","Acta Crystallographica Section C","1997","53","5","633","634","10.1107/S0108270196015326","","","0.71073","MoKα","","0.0488","0.0393","","0.1121","0.1057","","","","1.032","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006131","5.795","0.004","9.059","0.004","16.081","0.007","84.24","0.04","84.2","0.04","77.85","0.05","818.3","0.8","150","0.2","150","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H15 O2 S4 Sb -","- C12 H15 O2 S4 Sb -","- C24 H30 O4 S8 Sb2 -","2","1","MU1305","Blake, Alexander J.; Pearson, Matthew; Sowerby, D. Bryan; Woodhead, Peter P.","Bis(ethylxanthato)phenylantimony(III)","Acta Crystallographica Section C","1997","53","5","583","585","10.1107/S0108270197000620","","","0.71073","MoKα","","0.0225","0.019","","0.0417","0.0392","","","","1.144","1.118","1.118","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006132","8.7641","0.0004","26.785","0.002","12.5316","0.0007","90","","104.412","0.004","90","","2849.2","0.3","293","","293","","","","","","","","","6","P 1 21 1","P 2yb","4","","cis-4-Amino-5-chloro-N-{1-[3-(4-fluorophenoxy)propyl]- 3-methoxy-4-piperidylium}-2-methoxybenzamide tartrate","","- C27 H35 Cl F N3 O10 -","- C27 H35 Cl F N3 O10 -","- C108 H140 Cl4 F4 N12 O40 -","4","2","NA1275","Oswald M. Peeters; Norbert M. Blaton; Camiel J. De Ranter","Absolute Configuration of the Double Salt of <i>cis</i>-4-Amino-5-chloro-<i>N</i>-{1-[3-(4-fluorophenoxy)propyl]-3-methoxypiperidin-1-ium-4-yl}-2-methoxybenzamide Tartrate (Cisapride Tartrate)","Acta Crystallographica Section C","1997","53","5","597","599","10.1107/S0108270196015181","","","1.54184","CuKα","","0.0511","0.0415","","0.1092","0.1092","","","","1.032","1.032","1.032","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006133","9.405","0.002","10.195","0.003","20.783","0.006","89.05","0.02","78.86","0.02","79.87","0.02","1924.4","0.9","294","","294","","","","","","","","","6","P -1","-P 1","2","","","","- C33 H25 Cl3 Cu2 N8 O12 -","- C33 H25 Cl3 Cu2 N8 O12 -","- C66 H50 Cl6 Cu4 N16 O24 -","2","1","NA1277","Bulach, Véronique; Duval, Hugues; Fischer, Jean; Weiss, Raymond","μ-Cyano-bis(2,2':6',2''-terpyridine-<i>N</i>,<i>N</i>',<i>N</i>'')dicopper(II) Perchlorate Acetonitrile, [Cu~2~(CN)(C~15~H~11~N~3~)~2~](ClO~4~)~3~.CH~3~CN","Acta Crystallographica Section C","1997","53","5","543","545","10.1107/S0108270196015570","","","0.71073","MoKα","","0.143","0.049","","0.116","0.07","","","","2.29","1.361","1.361","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006134","10.267","0.001","8.505","0.001","14.996","0.001","90","","96.85","0.01","90","","1300.1","0.2","298","","299","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","3-acetonylbicyclo[6.3.0]undecane-2,6-dione","","- C14 H20 O3 -","- C14 H20 O3 -","- C56 H80 O12 -","4","1","OA1017","Ohba, Shigeru; Umehara, Misao","3-Acetonylbicyclo[6.3.0]undecane-2,6-dione, (I), 7-Acetonyl-4,4-dimethylbicyclo[6.3.0]undecane-2,6-dione, (II), 7,12-Dihydroxy-12-methyltetracyclo[8.2.1.0^1,5^.0^7,11^]tridecan-13-one Monohydrate, (III), and 8,8-Dimethyltricyclo[9.3.0.0^2,6^]tetradec-5-ene-4,10-dione, (IV)","Acta Crystallographica Section C","1997","53","5","616","620","10.1107/S0108270196015661","","","0.71073","MoKα","","","0.0605","","","0.0529","","","","","1.16","1.16","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2006135","9.966","0.002","10.794","0.002","8.171","0.002","98.03","0.02","111.46","0.02","106.98","0.02","751.8","0.3","297","","299","","","","","","","","","3","P -1","-P 1","2","","7-acetonyl-4,4-dimethylbicyclo[6.3.0]undecane-2,6-dione","","- C16 H24 O3 -","- C16 H24 O3 -","- C32 H48 O6 -","2","1","OA1017","Ohba, Shigeru; Umehara, Misao","3-Acetonylbicyclo[6.3.0]undecane-2,6-dione, (I), 7-Acetonyl-4,4-dimethylbicyclo[6.3.0]undecane-2,6-dione, (II), 7,12-Dihydroxy-12-methyltetracyclo[8.2.1.0^1,5^.0^7,11^]tridecan-13-one Monohydrate, (III), and 8,8-Dimethyltricyclo[9.3.0.0^2,6^]tetradec-5-ene-4,10-dione, (IV)","Acta Crystallographica Section C","1997","53","5","616","620","10.1107/S0108270196015661","","","0.71073","MoKα","","","0.0537","","","0.047","","","","","1","1","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2006136","8.115","0.002","17.959","0.002","9.034","0.002","90","","94.71","0.02","90","","1312.1","0.5","298","","299","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,13-dihydroxy-13-methyltetracyclo[9.3.0.0^2,6^]tetradec-2-ene-4,9-dione","","- C14 H22 O4 -","- C14 H22 O4 -","- C56 H88 O16 -","4","1","OA1017","Ohba, Shigeru; Umehara, Misao","3-Acetonylbicyclo[6.3.0]undecane-2,6-dione, (I), 7-Acetonyl-4,4-dimethylbicyclo[6.3.0]undecane-2,6-dione, (II), 7,12-Dihydroxy-12-methyltetracyclo[8.2.1.0^1,5^.0^7,11^]tridecan-13-one Monohydrate, (III), and 8,8-Dimethyltricyclo[9.3.0.0^2,6^]tetradec-5-ene-4,10-dione, (IV)","Acta Crystallographica Section C","1997","53","5","616","620","10.1107/S0108270196015661","","","0.71073","MoKα","","","0.0564","","","0.0538","","","","","1.24","1.24","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006137","8.689","0.002","13.862","0.002","5.96","0.001","94.12","0.01","100.47","0.01","107.7","0.01","666.3","0.2","296","","296","","","","","","","","","3","P -1","-P 1","2","","","","- C16 H22 O2 -","- C16 H22 O2 -","- C32 H44 O4 -","2","1","OA1017","Ohba, Shigeru; Umehara, Misao","3-Acetonylbicyclo[6.3.0]undecane-2,6-dione, (I), 7-Acetonyl-4,4-dimethylbicyclo[6.3.0]undecane-2,6-dione, (II), 7,12-Dihydroxy-12-methyltetracyclo[8.2.1.0^1,5^.0^7,11^]tridecan-13-one Monohydrate, (III), and 8,8-Dimethyltricyclo[9.3.0.0^2,6^]tetradec-5-ene-4,10-dione, (IV)","Acta Crystallographica Section C","1997","53","5","616","620","10.1107/S0108270196015661","","","0.71073","MoKα","","","0.0439","","","0.0406","","","","","0.969","0.969","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2006138","6.159","0.002","8.332","0.003","23.306","0.002","90","","90.93","0.02","90","","1195.8","0.6","300","","300","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-o-stilbenecarboxylic acid","","- C15 H12 O2 -","- C15 H12 O2 -","- C60 H48 O8 -","4","1","OA1018","Hamazaki, Hiroshi; Ohba, Shigeru; Toda, Fumio; Takumi, Hideaki","(<i>E</i>)-<i>o</i>-Stilbenecarboxylic Acid and its <i>p</i>-Methyl, Chloro and Methoxy Derivatives","Acta Crystallographica Section C","1997","53","5","620","624","10.1107/S0108270196015673","","","0.71073","MoKα","","","0.0468","","","0.0422","","","","","1.24","1.24","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006139","7.138","0.002","12.036","0.002","14.874","0.002","90","","91.74","0.02","90","","1277.3","0.5","300","","300","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","p-methyl-(E)-o-stilbenecarboxylic acid","","- C16 H14 O2 -","- C16 H14 O2 -","- C64 H56 O8 -","4","1","OA1018","Hamazaki, Hiroshi; Ohba, Shigeru; Toda, Fumio; Takumi, Hideaki","(<i>E</i>)-<i>o</i>-Stilbenecarboxylic Acid and its <i>p</i>-Methyl, Chloro and Methoxy Derivatives","Acta Crystallographica Section C","1997","53","5","620","624","10.1107/S0108270196015673","","","0.71073","MoKα","","","0.0456","","","0.051","","","","","1.2","1.2","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006140","12.977","0.005","8.023","0.004","25.171","0.003","90","","103.56","0.02","90","","2547.6","1.6","300","","300","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","p-chloro-(E)-o-stilbenecarboxylic acid","","- C15 H11 Cl O2 -","- C15 H11 Cl O2 -","- C120 H88 Cl8 O16 -","8","2","OA1018","Hamazaki, Hiroshi; Ohba, Shigeru; Toda, Fumio; Takumi, Hideaki","(<i>E</i>)-<i>o</i>-Stilbenecarboxylic Acid and its <i>p</i>-Methyl, Chloro and Methoxy Derivatives","Acta Crystallographica Section C","1997","53","5","620","624","10.1107/S0108270196015673","","","0.71073","MoKα","","","0.0505","","","0.0452","","","","","1.23","1.23","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006141","11.361","0.002","5.066","0.003","22.71","0.002","90","","98.45","0.01","90","","1292.9","0.8","300","","300","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","p-chloro-(E)-o-stilbenecarboxylic acid","","- C15 H11 Cl O2 -","- C15 H11 Cl O2 -","- C60 H44 Cl4 O8 -","4","1","OA1018","Hamazaki, Hiroshi; Ohba, Shigeru; Toda, Fumio; Takumi, Hideaki","(<i>E</i>)-<i>o</i>-Stilbenecarboxylic Acid and its <i>p</i>-Methyl, Chloro and Methoxy Derivatives","Acta Crystallographica Section C","1997","53","5","620","624","10.1107/S0108270196015673","","","0.71073","MoKα","","","0.0699","","","0.0531","","","","","1.25","1.25","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006142","11.28","0.002","5.273","0.002","22.462","0.002","90","","103","0.01","90","","1301.8","0.6","300","","300","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","p-methoxy-(E)-o-stilbenecarboxylic acid","","- C16 H14 O3 -","- C16 H14 O3 -","- C64 H56 O12 -","4","1","OA1018","Hamazaki, Hiroshi; Ohba, Shigeru; Toda, Fumio; Takumi, Hideaki","(<i>E</i>)-<i>o</i>-Stilbenecarboxylic Acid and its <i>p</i>-Methyl, Chloro and Methoxy Derivatives","Acta Crystallographica Section C","1997","53","5","620","624","10.1107/S0108270196015673","","","0.71073","MoKα","","","0.0512","","","0.0463","","","","","1.14","1.14","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006143","6.0178","0.0006","28.449","0.003","8.0272","0.0009","90","","90","","90","","1374.3","0.3","294","1","294","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","5-Phenyldibenzophosphole","","- C18 H13 P -","- C18 H13 P -","- C72 H52 P4 -","4","1","QA0001","Meehan, Paul R.; Alyea, Elmer C.; Ferguson, George","5-Phenyldibenzophosphole, Polymorph 2","Acta Crystallographica Section C","1997","53","5","IUC9700001","","10.1107/S0108270197099526","","","0.7107","MolybdenumKα","","0.0909","0.0495","","0.1473","","0.1297","","","0.971","","","1.09","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006144","6.1276","0.0007","12.1791","0.0012","8.9973","0.0012","90","","105.07","0.01","90","","648.36","0.13","294","1","294","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Potassium Hexaaquanickel(II)/Hexaaquairon(II)(0.93/0.07) Sulfate","","- Fe0.07 H12 K2 Ni0.93 O14 S2 -","- Fe0.07 H12 K2 Ni0.93 O14 S2 -","- Fe0.14 H24 K4 Ni1.86 O28 S4 -","2","0.5","QA0002","Ferguson, George; Spalding, Trevor R.; Herlihy, Emmet A.","Dipotassium Hexaaquairon(II) Bis(sulfate)‒Dipotassium Hexaaquanickel(II) Bis(sulfate) (0.07/0.93)","Acta Crystallographica Section C","1997","53","5","IUC9700002","","10.1107/S010827019709954X","","","0.7107","MolybdenumKα","","0.022","0.0204","","0.0572","","0.0567","","","1.176","","","1.197","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006145","8.54","0.0011","5.2249","0.0014","10.2686","0.0008","90","","97.191","0.008","90","","454.59","0.14","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","1-(2-deoxy-α-L-erythro-pentopyranosyl) 1-(S),2-(S), 4-triazolidine-3,5-dione","","- C7 H11 N3 O5 -","- C7 H11 N3 O5 -","- C14 H22 N6 O10 -","2","1","QB0001","Robinson, Paul D.; Kolb, Vera M.; Colloton, Patricia A.; Meyers, Cal Y.","First Example of a Crystalline Urazole Nucleoside with an <small>L</small>-Configured Sugar. (1<i>S</i>,2<i>S</i>)-Urazole α-<small>L</small>-Pyranosyl-2-deoxyriboside","Acta Crystallographica Section C","1997","53","5","IUC9700003","","10.1107/S0108270197099514","","","0.71069","MoKα","","0.0526","0.0341","","0.1019","","0.0914","","","1.042","1.078","1.078","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006146","8.804","0.002","14.208","0.001","13.931","0.001","90","","103.57","0.01","90","","1693.9","0.4","298","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(2-(2-pyridyl)-4,4,5,5-tetramethyl-4,5-dihydro-[H-imidazolyl-1-oxy 3-oxide)dichlorocopper(II) Bis(methylene chloride) Solvate","","- C26 H36 Cl6 Cu N6 O4 -","- C26 H36 Cl6 Cu N6 O4 -","- C52 H72 Cl12 Cu2 N12 O8 -","2","0.5","QB0002","Ohba, Shigeru; Kato, Takanari; Yoshioka, Naoki; Inoue, Hidenari","Dichlorobis[4,4,5,5-tetramethyl-2-(2-pyridyl)-4,5-dihydro-1<i>H</i>-imidazol-1-yloxy 3-oxide]copper(II) Bis(dichloromethane) Solvate","Acta Crystallographica Section C","1997","53","5","IUC9700004","","10.1107/S0108270197099538","","","0.71073","MoKα","","","0.0417","","","0.0374","","","","","1.18","1.18","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006147","8.94","0.003","14.259","0.004","25.929","0.007","90","","90","","90","","3305.3","1.7","158","2","158","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3,3-Dimethyl-1,8,11-triaza-5-azoniumcyclotridecane Perchlorate Water.","","- C11 H29 Cl N4 O5 -","- C11 H29 Cl N4 O5 -","- C88 H232 Cl8 N32 O40 -","8","1","SK1026","Gladkikh, Olga P.; Curtis, Neil F.; Turnbull, Mark M.","A 13-Membered Cyclic Tetraamine Salt: 12,12-Dimethyl-4,7,10-triaza-1-azoniacyclotridecane Perchlorate Hydrate","Acta Crystallographica Section C","1997","53","5","586","587","10.1107/S0108270196015193","","","0.71073","MoKα","","0.0777","0.0468","","0.1115","0.1039","","","","0.878","1.067","1.067","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006148","13.798","0.005","20.533","0.009","13.85","0.006","90","","104.5","0.03","90","","3799","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(triphenylphospine)1,1,2,3,3-pentacyanpropenide copper(I)","","- C88 H60 Cu2 N10 P4 -","- C88 H60 Cu2 N10 P4 -","- C176 H120 Cu4 N20 P8 -","2","0.5","SK1037","Dvorský, Andrej; Kožíšek, Jozef; Jäger, Lothar; Tretner, Carola","Bis[(1,1,2,3,3-pentacyanopropenido-<i>N</i>^1^:<i>N</i>^2^)bis(triphenylphosphine-<i>P</i>)copper(I)]","Acta Crystallographica Section C","1997","53","5","556","559","10.1107/S0108270196015211","","","0.71073","MoKα","","0.1307","0.0436","","0.1034","0.0815","","","","0.907","1.074","1.074","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006149","6.811","0.002","11.079","0.002","14.907","0.002","91.82","0.03","96.53","0.03","105.41","0.03","1075.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H22 N2 O4 S -","- C23 H22 N2 O4 S -","- C46 H44 N4 O8 S2 -","2","1","SK1039","Işık, Şamil; Aygün, Muhittin; Şaşmaz, Selami; Kendi, Engin; Büyükgüngör, Orhan; Erdönmez, Ahmet","5-Allyl-3-methoxy-2-(<i>p</i>-tolylsulfonyloxy)azobenzene","Acta Crystallographica Section C","1997","53","5","593","594","10.1107/S0108270196011596","","","0.71069","MoKα","","0.0534","0.044","","0.1234","0.117","","","","1.063","1.092","1.092","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006150","7.812","0.001","12","0.001","17.161","0.001","78.92","0.02","84.32","0.02","72.23","0.02","1502","0.3","293","3","293","3","","","","","","","","5","P -1","-P 1","2","","1:1:1 methanol . [2,4-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidine] . [4-amino-N-(4,6-dimethyl-2-pyrimidinyl)benzene-sulfonamide]","","- C27 H36 N8 O6 S -","- C27 H36 N8 O6 S -","- C54 H72 N16 O12 S2 -","2","1","SK1047","Bettinetti, Giampiero; Sardone, Nicola","Methanol Solvate of the 1:1 Molecular Complex of Trimethoprim and Sulfadimidine","Acta Crystallographica Section C","1997","53","5","594","597","10.1107/S0108270196014783","","","1.54184","CuKα","","0.044","0.042","","","0.041","","","","","0.632","0.632","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006151","15.543","0.002","14.025","0.001","14.676","0.005","90","","112.42","0.02","90","","2957.4","1.2","292","","292","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Hexakis(Thiourea)cadmium perrhenate monohydrate","","- C6 H26 Cd N12 O9 Re2 S6 -","- C6 H26 Cd N12 O9 Re2 S6 -","- C24 H104 Cd4 N48 O36 Re8 S24 -","4","0.5","SK1053","Rosica Petrova; Olyana Angelova; Josef Macíček","Molecular Adducts of Inorganic Salts. VII. Cadmium Tetraoxorhenium Hexakis(thiourea) Hydrate","Acta Crystallographica Section C","1997","53","5","565","568","10.1107/S0108270196015107","","","0.71073","MoKα","","0.068","0.032","","0.035","0.035","","","","1.264","1.286","1.286","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006152","10.338","0.002","8.687","0.002","10.756","0.002","90","","95.05","0.01","90","","962.2","0.3","290","","290","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nitropentaammine Co(III) chloride","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H15 N6 O2 -","- Cl8 Co4 H60 N24 O8 -","4","0.5","SK1068","Boldyreva, Elena V.; Kivikoski, Jussi; Howard, J. A. K.","Pentaamminenitrocobalt(III) Dichloride and Dibromide at 290K and 150K","Acta Crystallographica Section C","1997","53","5","523","526","10.1107/S0108270196014205","","","0.71073","MoKα","","0.0208","0.0175","","0.0479","0.0464","","","","0.984","0.994","0.994","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006153","10.215","0.003","8.697","0.004","10.748","0.003","90","","95.41","0.02","90","","950.6","0.6","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nitropentaammine Co(III) chloride","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H15 N6 O2 -","- Cl8 Co4 H60 N24 O8 -","4","0.5","SK1068","Boldyreva, Elena V.; Kivikoski, Jussi; Howard, J. A. K.","Pentaamminenitrocobalt(III) Dichloride and Dibromide at 290K and 150K","Acta Crystallographica Section C","1997","53","5","523","526","10.1107/S0108270196014205","","","0.71073","MoKα","","0.0174","0.0152","","0.0379","0.0372","","","","1.106","1.124","1.124","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006154","10.68","0.003","8.838","0.004","10.99","0.003","90","","94.7","0.02","90","","1033.9","0.6","290","","290","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nitropentaammine Co(III) bromide","","- Br2 Co H15 N6 O2 -","- Br2 Co H15 N6 O2 -","- Br8 Co4 H60 N24 O8 -","4","0.5","SK1068","Boldyreva, Elena V.; Kivikoski, Jussi; Howard, J. A. K.","Pentaamminenitrocobalt(III) Dichloride and Dibromide at 290K and 150K","Acta Crystallographica Section C","1997","53","5","523","526","10.1107/S0108270196014205","","","0.71073","MoKα","","0.0395","0.0214","","0.0522","0.049","","","","1.036","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006155","10.575","0.002","8.815","0.005","10.97","0.002","90","","94.97","0.02","90","","1018.8","0.6","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nitropentaammine Co(III) bromide","","- Br2 Co H15 N6 O2 -","- Br2 Co H15 N6 O2 -","- Br8 Co4 H60 N24 O8 -","4","0.5","SK1068","Boldyreva, Elena V.; Kivikoski, Jussi; Howard, J. A. K.","Pentaamminenitrocobalt(III) Dichloride and Dibromide at 290K and 150K","Acta Crystallographica Section C","1997","53","5","523","526","10.1107/S0108270196014205","","","0.71073","MoKα","","0.0294","0.0188","","0.0485","0.0465","","","","1.1","1.156","1.156","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006156","12.736","0.005","12.911","0.002","9.805","0.002","102.62","0.01","100.02","0.02","71.58","0.02","1483.1","0.7","294","","294","","","","","","","","","7","P -1","-P 1","2","","","","- C23 H28 Cu F6 N4 O8 S2 -","- C23 H28 Cu F6 N4 O8 S2 -","- C46 H56 Cu2 F12 N8 O16 S4 -","2","1","SK1069","Alilou, El Houssine; El Hallaoui, Abdelilah; El Ghadraoui, El Houssine; Giorgi, Michel; Pierrot, Marcel; Réglier, Marius","Two TEPA‒Copper(II) Complexes {TEPA is Tris[2-(2-pyridyl)ethyl]amine}","Acta Crystallographica Section C","1997","53","5","559","562","10.1107/S0108270196015223","","","0.71073","MoKα","","0.137","0.05","","","0.05","","","","","1.319","1.319","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006157","18.168","0.002","7.867","0.002","21.908","0.003","90","","125.58","0.04","90","","2546.7","1.5","294","","294","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H27 Cu F6 N4 O2 P -","- C23 H27 Cu F6 N4 O2 P -","- C92 H108 Cu4 F24 N16 O8 P4 -","4","1","SK1069","Alilou, El Houssine; El Hallaoui, Abdelilah; El Ghadraoui, El Houssine; Giorgi, Michel; Pierrot, Marcel; Réglier, Marius","Two TEPA‒Copper(II) Complexes {TEPA is Tris[2-(2-pyridyl)ethyl]amine}","Acta Crystallographica Section C","1997","53","5","559","562","10.1107/S0108270196015223","","","0.71073","MoKα","","0.081","0.075","","","0.098","","","","","3.208","3.208","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2006158","14.814","0.003","9.623","0.002","7.309","0.002","90","","90","","90","","1041.9","0.4","290","","290","","","","","","","","","5","P n a m","-P 2c 2n","62","","nitro-pentaammine-Co(III)-chloride-nitrate","","- Cl Co H15 N7 O5 -","- Cl Co H15 N7 O5 -","- Cl4 Co4 H60 N28 O20 -","4","0.5","SK1070","Boldyreva, Elena V.; Kivikoski, Jussi; Howard, J. A. K.","Pentaamminenitrocobalt(III) Chloride Nitrate at 290K and 150K","Acta Crystallographica Section C","1997","53","5","526","528","10.1107/S0108270196014217","","","0.71073","MoKα","","0.0407","0.024","","0.0674","0.0623","","","","0.993","1.051","1.051","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006159","14.726","0.005","9.646","0.007","7.219","0.003","90","","90","","90","","1025.4","0.9","150","","150","","","","","","","","","5","P n a m","-P 2c 2n","62","","nitro-pentaammine-Co(III)-chloride-nitrate","","- Cl Co H15 N7 O5 -","- Cl Co H15 N7 O5 -","- Cl4 Co4 H60 N28 O20 -","4","0.5","SK1070","Boldyreva, Elena V.; Kivikoski, Jussi; Howard, J. A. K.","Pentaamminenitrocobalt(III) Chloride Nitrate at 290K and 150K","Acta Crystallographica Section C","1997","53","5","526","528","10.1107/S0108270196014217","","","0.71073","MoKα","","0.0374","0.0233","","0.0619","0.057","","","","1.042","1.089","1.089","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006160","9.7232","0.0011","9.2506","0.0013","10.6178","0.0013","90","","90","","90","","955","0.2","130","1","130","1","","","","","","","","5","P n a 21","P 2c -2n","33","","N-butylthiophen-3-carboxamide","","- C9 H13 N O S -","- C9 H13 N O S -","- C36 H52 N4 O4 S4 -","4","1","SK1076","Gable, Robert W.; Laws, Melissa J.; Schiesser, Carl H.","<i>N</i>-Butylthiophene-3-carboxamide and 2-Benzylseleno-<i>N</i>-butylthiophene-3-carboxamide at 130K","Acta Crystallographica Section C","1997","53","5","641","644","10.1107/S0108270196015788","","","1.5418","CuKα(nickelfiltered)","","0.0363","0.036","","0.1045","0.1042","","","","1.072","1.077","1.077","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006161","8.4701","0.0009","21.624","0.002","9.34","0.0009","90","","114.497","0.008","90","","1556.7","0.3","130","1","130","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-benzylseleno-N-butylthiophen-3-carboxamide","","- C16 H19 N O S Se -","- C16 H19 N O S Se -","- C64 H76 N4 O4 S4 Se4 -","4","1","SK1076","Gable, Robert W.; Laws, Melissa J.; Schiesser, Carl H.","<i>N</i>-Butylthiophene-3-carboxamide and 2-Benzylseleno-<i>N</i>-butylthiophene-3-carboxamide at 130K","Acta Crystallographica Section C","1997","53","5","641","644","10.1107/S0108270196015788","","","1.5418","CuKα(nickelfiltered)","","0.0303","0.0293","","0.0777","0.0771","","","","1.169","1.176","1.176","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006162","8.467","0.002","11.154","0.002","9.654","0.002","90","","92.24","0.02","90","","911","0.3","295","","295","","","","","","","","","3","P 1 21 1","P 2yb","4","","1α,5α-Dihydroxymanoyl oxide","","- C20 H34 O3 -","- C20 H34 O3 -","- C40 H68 O6 -","2","1","SX1001","Manríquez, V.; Labbé, C.; Castillo, M.; Wittke, O.","1α,5α-Dihydroxymanoyl Oxide, a Novel Diterpene from <i>Satureja gilliesii</i>","Acta Crystallographica Section C","1997","53","5","624","626","10.1107/S0108270197000048","","","0.71073","MoKα","","0.0487","0.038","","0.0441","0.0423","","","","","1.24","1.24","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006163","10.356","0.002","15.35","0.003","13.394","0.003","90","","96.38","0.04","90","","2116","0.8","293","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C20 H17 N5 O11 -","- C20 H17 N5 O11 -","- C80 H68 N20 O44 -","4","1","TA1106","In, Yasuko; Nagata, Hiroomi; Doi, Mitsunobu; Ishida, Toshimasa; Wakahara, Akio","Anthranilic Acid‒Picric Acid (2/1) Complex","Acta Crystallographica Section C","1997","53","5","646","648","10.1107/S0108270196011262","","","1.5418","CuKα","","","0.059","","","0.067","","","","","1.7187","1.7187","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006164","7.405","0.002","18.481","0.002","8.1246","0.0009","90","","111.14","0.01","90","","1037","0.3","300","2","300","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(n-butyl)-3,4-dibromomaleimide","","- C8 H9 Br2 N O2 -","- C8 H9 Br2 N O2 -","- C32 H36 Br8 N4 O8 -","4","1","TA1129","Chen, Wei; Yang, Jia-xiang; Bai, Zhi-ping; Wang Zou-xiang; You Xiao-zeng","<i>N</i>-(<i>n</i>-Butyl)-3,4-dibromomaleimide","Acta Crystallographica Section C","1997","53","5","631","633","10.1107/S0108270197000024","","","0.71073","MoKα","","0.0713","0.0456","","0.1095","0.0983","","","","1.092","1.15","1.15","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006165","11.857","0.006","3.66","0.002","10.909","0.006","90","","100.43","0.04","90","","465.6","0.4","293","","293","","","","","","","","","3","C 1 2/m 1","-C 2y","","","","","- Li2 O13 V6 -","- Li2 O13 V6 -","- Li4 O26 V12 -","2","0.25","TA1132","Bergström, Örjan; Gustafsson, Torbjörn; Thomas, John O.","Electrochemically Lithiated Vanadium Oxide, Li~2~V~6~O~13~","Acta Crystallographica Section C","1997","53","5","528","530","10.1107/S0108270196015235","","","0.7107","MolybdenumKα","","0.04","0.04","","0.055","0.055","","","","2.69","2.69","2.69","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006166","12.333","0.002","7.146","0.001","10.885","0.001","90","","111.57","0.01","90","","892.1","0.2","293","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- O3 Si Sr -","- O3 Si Sr -","- O36 Si12 Sr12 -","12","1.5","TA1133","Nishi, Fumito","Strontium Metasilicate, SrSiO~3~","Acta Crystallographica Section C","1997","53","5","534","536","10.1107/S0108270196015338","","","0.71073","MoKα","","","0.056","","","0.067","","","","","1.34","1.34","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006167","9.844","0.007","3.901","0.003","17.245","0.015","90","","93.17","0.06","90","","661.2","0.9","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","MTNPH","5-methylthiophenecarboxaldehyde-4-nitrophenylhydrazone monohydrate","","- C12 H13 N3 O3 S -","- C12 H13 N3 O3 S -","- C24 H26 N6 O6 S2 -","2","1","AB1423","Wong, Man Shing; Gramlich, Volker; Pan, Feng; Bosshard, Christian; Günter, Peter","5-Methylthiophene-2-carboxaldehyde 4-Nitrophenylhydrazone‒Water (1/1)","Acta Crystallographica Section C","1997","53","6","757","759","10.1107/S0108270197002552","","","0.71073","MoKα","","0.0943","0.0385","","0.0815","0.0748","","","","0.674","0.996","0.996","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006168","12.231","0.002","13.643","0.003","7.733","0.003","90","","90","","90","","1290.4","0.6","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H14 N2 O4 -","- C12 H14 N2 O4 -","- C48 H56 N8 O16 -","4","1","AB1426","Kennedy, Alan R.; Khalaf, Abedawn I.","<i>N</i>,<i>N</i>-Diacetyl-2,5-dimethyl-6-nitroaniline","Acta Crystallographica Section C","1997","53","6","744","746","10.1107/S0108270197002564","","","0.71069","MoKα","","0.1372","0.0682","","0.0537","0.0456","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006169","7.473","0.0011","8.286","0.0011","17.527","0.002","90","","90","","90","","1085.3","0.2","294","1","294","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-Benzo[b]thien-2-yl-5,6-dihydro-1,4,2-oxathiazine, 4-oxide","","- C11 H9 N O2 S2 -","- C11 H9 N O2 S2 -","- C44 H36 N4 O8 S8 -","4","1","AB1427","Gallagher, John F.; Ferguson, George; Brouwer, Walter G.","3-(Benzo[<i>b</i>]thien-2-yl)-5,6-dihydro-1,4,2-oxathiazine 4-Oxide","Acta Crystallographica Section C","1997","53","6","823","825","10.1107/S0108270196014539","","","0.7107","MolybdenumKα","","0.0307","0.0257","","0.0732","0.0714","","","","1.06","1.086","1.086","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006170","11.065","0.001","5.614","0.002","24.225","0.002","90","","90.728","0.006","90","","1504.7","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-(4-chlorobenzyl)-2-(1H-imidazol-1-ylmethyl)aniline","","- C17 H16 Cl N3 -","- C17 H16 Cl N3 -","- C68 H64 Cl4 N12 -","4","1","AB1428","Ettorre, Alessandro; Biava, Mariangela; Fioravanti, Rossella; Porretta, Giulio Cesare","The Antifungal Agent 1-[2-(4-Chlorobenzylamino)benzyl]-1<i>H</i>-imidazole","Acta Crystallographica Section C","1997","53","6","761","762","10.1107/S0108270197000784","","","1.54178","CuKα","","","0.0441","","0.1531","0.1531","","","","0.657","0.657","0.657","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006171","8.111","0.002","6.146","0.001","10.242","0.001","90","","103.19","0.01","90","","497.1","0.16","293","","293.2","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","meso-3,3'-bi(1,2,4-trithiacyclohex-5-enyl)","","","- C6 H6 S6 -","- C6 H6 S6 -","- C12 H12 S12 -","2","0.5","AB1429","Shimizu, Toshio; Iwata, Kazuko; Kondo, Mitsuru; Kitagawa, Susumu; Kamigata, Nobumasa","<i>meso</i>-3,3'-Bi(1,2,4-trithiacyclohex-5-enyl)","Acta Crystallographica Section C","1997","53","6","748","749","10.1107/S0108270197002230","","","0.7107","MoKα","","","0.0286","","","0.0345","","","","","3.901","3.901","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006172","6.1863","0.0002","12.5481","0.0004","19.8831","0.0006","90","","90","","90","","1543.45","0.08","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-leucyl-L-alanine tetrahydrate","","- C9 H26 N2 O7 -","- C9 H26 N2 O7 -","- C36 H104 N8 O28 -","4","1","AB1443","Görbitz, Carl Henrik","Cyclic Water Pentamers in <small>L</small>-Leucyl-<small>L</small>-alanine Tetrahydrate","Acta Crystallographica Section C","1997","53","6","736","739","10.1107/S0108270196015946","","","0.71073","MoKα","","0.0455","0.038","","0.0905","0.0857","","","","1.142","1.137","1.137","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006173","11.959","0.003","14.696","0.004","20.203","0.004","90","","91.54","0.02","90","","3549.4","1.5","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","{7,8-μ-thiobenzate}-{7,11-μ-thiobenzate}-10-(triphenylphosphine)- nido-7-nickelaundecaborane","","- C32 H33 B10 Ni O2 P S2 -","- C32 H33 B10 Ni O2 P S2 -","- C128 H132 B40 Ni4 O8 P4 S8 -","4","1","AB1444","Dou, Jian-Min; Hu, Chun-Hua; Yao, Hai-Jun; Li, Wen; Jin, Ruo-Shui; Zheng, Pei-Ju","A Cycloboronated Nickelaundecaborane: [(PhCOS)~2~NiB~10~H~8~(PPh~3~)]","Acta Crystallographica Section C","1997","53","6","693","695","10.1107/S0108270197002242","","","0.71073","MoKα","","0.0639","0.0321","","0.106","0.0857","","","","1.065","1.042","1.042","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006174","11.043","0.005","15.524","0.003","23.016","0.003","90","0.02","91.28","0.02","90","0.03","3945","2","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","{2,7-μ-thiobenzoate}-{3,7-μ-thiobenzoate}-7-(triphenyl-phosphine)-nido- 7-nickelaundecaborane","","- C36 H42 B10 Ni O2 P S2 -","- C35 H35 B10 Ni O2 P S2 -","- C140 H140 B40 Ni4 O8 P4 S8 -","4","1","AB1447","Chun-Hua Hu; Jian-Min Dou; Hai-Jun Yao; Wen Li; Ruo-Shui Jin; Pei-Ju Zheng","<i>ortho</i>-Cycloboronation of a Thiobenzoate Cluster: [(PPh~3~)(PhCṟidge{OS)_{2}NiB}{12.5mm}~10~H~10~].0.5C~6~H~14~","Acta Crystallographica Section C","1997","53","6","695","697","10.1107/S0108270197002254","","","0.71073","MoKα","","0.074","0.0428","","0.1578","0.1253","","","","0.986","0.936","0.936","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006175","9.054","0.005","11.467","0.004","8.512","0.003","110.66","0.03","109.01","0.04","76.51","0.04","774.8","0.6","173","1","173","1","","","","","","","","4","P -1","-P 1","2","","N-acridinium-9-yl-N'-propylidenehydrazine thiocyanate","","- C17 H16 N4 S -","- C17 H16 N4 S -","- C34 H32 N8 S2 -","2","1","AB1449","Linden, Anthony; Guspanová, Jana; Bernát, Juraj; Kristian, Pavol","9-Propylidenehydrazino-10-acridinium Thiocyanate at 173K","Acta Crystallographica Section C","1997","53","6","732","734","10.1107/S010827019700108X","","","0.71069","MoKα","","0.0923","0.0524","","0.0556","0.0526","","","","","2.145","2.145","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006176","16.178","0.002","16.178","0.002","12.462","0.003","90","","90","","90","","3261.7","1","160","2","160","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","benzyltrimethylammonium tetramethoxyborate","","- C14 H28 B N O4 -","- C14 H28 B N O4 -","- C112 H224 B8 N8 O32 -","8","1","AB1461","Clegg, William; Errington, R. John; Carmalt, Claire J.","Benzyltrimethylammonium Tetramethoxoborate","Acta Crystallographica Section C","1997","53","6","751","753","10.1107/S0108270197003508","","","0.71073","MoKα","","0.0898","0.0496","","0.1423","0.1125","","","","1.033","1.009","1.009","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006177","10.969","0.002","20.492","0.004","11.637","0.002","90","","99.13","0.01","90","","2582.6","0.8","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichlorobis(1,10-phenanthroline-N1,N10)cobalt(II) Acetonitrile sesquisolvate","","- C27 H20.5 Cl2 Co N5.5 -","- C27 H16 Cl2 Co N5.5 -","- C108 H64 Cl8 Co4 N22 -","4","1","AB1462","Alan Hazell; John McGinley; Christine J. McKenzie","Dichlorobis(1,10-phenanthroline-<i>N</i>,<i>N</i>')cobalt(II)‒Acetonitrile (1/1.5)","Acta Crystallographica Section C","1997","53","6","723","725","10.1107/S0108270197004150","","","0.71073","MoKα","","","0.045","","","0.056","","","","","1.176","1.176","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006178","13.811","0.002","14.0419","0.0015","22.409","0.003","90","","97.391","0.011","90","","4309.7","1","294","1","294","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","9,12-dibromo-3,3-bis(triphenylphosphine-P)-1,2-dicarba-3-hydrido-3-rhoda- closo-dodecaborane‒dichloromethane(1/1)","","- C39 H42 B9 Br2 Cl2 P2 Rh -","- C39 H42 B9 Br2 Cl2 P2 Rh -","- C156 H168 B36 Br8 Cl8 P8 Rh4 -","4","1","AB1472","McEneaney, Patricia A.; Spalding, Trevor R.; Meehan, Paul R.; Ferguson, George","9,12-Dibromo-3,3-bis(triphenylphosphine-<i>P</i>)-1,2-dicarba-3-hydrido-3-rhoda-<i>closo</i>-dodecaborane‒Dichloromethane (1/1)","Acta Crystallographica Section C","1997","53","6","685","687","10.1107/S0108270197003715","","","0.7107","MolybdenumKα","","0.1302","0.0656","","0.1346","","0.1152","","","0.919","","","1.099","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006179","11.437","0.002","7.579","0.001","17.335","0.002","90","","95.09","0.03","90","","1496.7","0.4","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H8 Cl4 N2 O -","- C14 H8 Cl4 N2 O -","- C56 H32 Cl16 N8 O4 -","4","1","AB1474","Clegg, William; Elsegood, Mark R. J.; Jackson, Richard F. W.; Fraser, Joanne L.; Emsden, Lee J.","<i>N</i>-(2,3,5,6-Tetrachloropyrid-4-yl)cinnamide","Acta Crystallographica Section C","1997","53","6","797","799","10.1107/S0108270197004162","","","0.71073","MoKα","","0.057","0.0464","","0.1267","0.1177","","","","1.061","1.074","1.074","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006180","32.403","0.006","7.668","0.002","14.127","0.003","90","","109.2","0.03","90","","3314.8","1.4","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-Methylbenzothiazole-2(3H)-selone","","- C8 H7 N S Se -","- C8 H7 N S Se -","- C128 H112 N16 S16 Se16 -","16","2","AV1002","Husebye, Steinar; Lindeman, Sergey V.; Rudd, Martin D.","<i>N</i>-Methylbenzothiazole-2(3<i>H</i>)-selone, C~8~H~7~NSSe","Acta Crystallographica Section C","1997","53","6","809","811","10.1107/S0108270197000309","","","0.71069","MoKα","","0.0895","0.0529","","0.1648","0.1244","","","","1.091","1.085","1.085","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006181","25.372","0.001","25.372","0.001","12.726","0.002","90","","90","","90","","8192.2","1.4","183","2","183","2","","","","","","","","7","P 43","P 4cw","78","","","","- C40 H32 F12 N7 O0.5 P2 Ru -","- C40 H32 F12 N7 O0.5 P2 Ru -","- C320 H256 F96 N56 O4 P16 Ru8 -","8","2","BK1256","Maloney, David J.; MacDonnell, Frederick M.","Λ-Tris(1,10-phenanthroline-<i>N</i>,<i>N</i>')ruthenium(II) Bis(hexafluorophosphate)‒Acetonitrile‒Diethyl Ether (1/1/0.5)","Acta Crystallographica Section C","1997","53","6","705","707","10.1107/S0108270197001091","","","0.71073","MoKα","","0.01","0.063","","0.16","0.139","","","","1.04","1.07","1.07","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006182","24.612","0.002","3.8302","0.0004","8.501","0.0005","90","","90","","90","","801.38","0.12","293","","293","","","","","","","","","4","P n a 21","P 2c -2n","33","Theophylline","3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione","","- C7 H8 N4 O2 -","- C7 H8 N4 O2 -","- C28 H32 N16 O8 -","4","1","BK1284","Ebisuzaki, Yukiko; Boyle, Paul D.; Smith, Jennifer A.","Methylxanthines. I. Anhydrous Theophylline","Acta Crystallographica Section C","1997","53","6","777","779","10.1107/S0108270197001960","","","0.71073","MolybdenumKα","","0.053","0.053","","0.056","0.056","","","","","1.65","1.65","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006183","10.199","0.002","6.543","0.001","18.145","0.003","90","","104.77","0.01","90","","1170.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H8 Cd N2 O3 S2 -","- C10 H8 Cd N2 O3 S2 -","- C40 H32 Cd4 N8 O12 S8 -","4","1","BK1303","Baggio, Sergio; Pardo, Maria I.; Baggio, Ricardo; Garland, Maria Teresa","(2,2'-Bipyridine-<i>N</i>,<i>N</i>')(μ-thiosulfato)cadmium(II)","Acta Crystallographica Section C","1997","53","6","727","729","10.1107/S0108270197001972","","","0.71073","MoKα","","0.0286","0.022","","0.0534","0.0506","","","","1.067","1.084","1.084","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006184","11.049","0.001","4.7982","0.0009","22.682","0.001","90","","90.108","0.006","90","","1202.5","0.3","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","1,8-bis(hydroxymethyl)anthracene","1,8-bis(hydroxymethyl)anthracene","","- C16 H14 O2 -","- C16 H14 O2 -","- C64 H56 O8 -","4","1","BK1309","Aumiller, Wade D.; Gerkin, Roger E.","1,8-Bis(hydroxymethyl)anthracene","Acta Crystallographica Section C","1997","53","6","769","771","10.1107/S0108270197001108","","","0.71073","MoKα","","","0.06","","","0.06","","","","","1.67","1.67","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006185","7.4948","0.0003","11.5989","0.0006","27.147","0.003","90","","90","","90","","2359.9","0.3","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2,3-benzo-1,4-dioxa-7,10,13-triazacyclopentadec-2-ene-6,14-dione.H~2O. picrate complex","","- C20 H24 N6 O12 -","- C20 H24 N6 O12 -","- C80 H96 N24 O48 -","4","1","BM1115","Hundal, Geeta; Kumar, Subodh; Hundal, Maninder Singh; Singh, Harjit; Sanz-Aparicio, Julia; Martinez-Ripoll, Martin","10<i>H</i>^+^-2,3-Benzo-1,4-dioxa-7,10,13-triazacyclopentadec-2-ene-6,14-dione Picrate Hydrate (1/1/1)","Acta Crystallographica Section C","1997","53","6","799","801","10.1107/S0108270196015041","","","1.5418","CuKα","","0.045","0.0399","","0.1071","0.0997","","","","1.089","1.073","1.073","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006186","9.854","0.004","6.352","0.004","19.372","0.006","90","","90.52","0.03","90","","1212.5","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","methylhexamethylenetetramine fluoride tetrahydrate","","- C7 H23 F N4 O4 -","- C7 H23 F N4 O4 -","- C28 H92 F4 N16 O16 -","4","1","BM1129","Nightingale, David J.; Cronin, Leroy; Clark, James H.","Methylhexamethylenetetramine Fluoride Tetrahydrate, MeHMTAF.4H~2~O","Acta Crystallographica Section C","1997","53","6","789","791","10.1107/S0108270197000541","","","0.71069","MoKα","","0.2852","0.0828","","0.2541","0.1769","","","","0.993","1.301","1.301","","","","","has coordinates","194538","2020-10-21","18:00:00",""
"2006187","8.648","0.004","11.561","0.008","8.189","0.004","90","","114.43","0.04","90","","745.4","0.8","220","0.2","220","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H7 N O -","- C9 H7 N O -","- C36 H28 N4 O4 -","4","1","BM1136","Clelland, Iain C.; McNab, Hamish; Parsons, Simon","α-Formylphenylacetonitrile in the Solid State at 220K","Acta Crystallographica Section C","1997","53","6","807","809","10.1107/S0108270197002382","","","1.54178","CuKα","","0.0454","0.0359","","0.0976","0.0922","","","","1.045","1.096","1.096","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006188","6.107","0.001","17.653","0.004","14.448","0.003","90","","94.8","0.03","90","","1552.1","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Chloro-penta(ammine)]cobalt(III) [(hydroxy)(nitroso)tetra(nitro)]ruthenoate","","- Cl Co H16 N10 O10 Ru -","- Cl Co H16 N10 O10 Ru -","- Cl4 Co4 H64 N40 O40 Ru4 -","4","1","BR1156","Belsky, Vitaly K.; Kokunova, Vera N.","Pentaamminechlorocobalt(III) Hydroxotetranitronitrosylruthenate(III)","Acta Crystallographica Section C","1997","53","6","659","661","10.1107/S0108270196014631","","","0.71069","MoKα","","0.0198","0.0198","","0.0557","0.0557","","","","1.088","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006189","9.091","0.001","5.231","0.001","5.57","0.001","90","","90.94","0.01","90","","264.85","0.08","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Magnesium hydrogen selenite","Magnesium bis[hydrogentrioxoselenate(IV)]","","- H2 Mg O6 Se2 -","- H2 Mg O6 Se2 -","- H4 Mg2 O12 Se4 -","2","0.5","BR1165","Boldt, Kai; Engelen, Bernward; Unterderweide, Klaus","A New Acid Selenite: Mg(HSeO~3~)~2~","Acta Crystallographica Section C","1997","53","6","666","668","10.1107/S0108270197000462","","","0.71069","MoKα","","0.0366","0.0235","","0.056","0.0547","","","","1.184","1.262","1.262","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006190","6.0341","0.0004","6.0341","0.0004","7.7888","0.0006","90","","90","","90","","283.59","0.03","295","","295","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","","","- Cr2 Cu O4 -","- Cr2 Cu O4 -","- Cr8 Cu4 O16 -","4","0.125","BR1169","W.A. Dollase; H.St.C. O'Neill","The Spinels CuCr~2~O~4~ and CuRh~2~O~4~","Acta Crystallographica Section C","1997","53","6","657","659","10.1107/S0108270197000486","","","1.54184","CuKα","","","","","","","","","","1.36","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006191","6.1756","0.0005","6.1756","0.0005","7.9006","0.0006","90","","90","","90","","301.31","0.04","295","","295","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","","","- Cu O4 Rh2 -","- Cu O4 Rh2 -","- Cu4 O16 Rh8 -","4","0.125","BR1169","W.A. Dollase; H.St.C. O'Neill","The Spinels CuCr~2~O~4~ and CuRh~2~O~4~","Acta Crystallographica Section C","1997","53","6","657","659","10.1107/S0108270197000486","","","1.54184","CuKα","","","","","","","","","","2.12","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006192","19.903","0.006","13.757","0.005","10.966","0.004","90","","90.39","0.02","90","","3002.5","1.8","163","2","163","2","","","","","","","","5","P 1 21 1","P 2yb","4","Asperchrome A","","","- C41 H92 Fe N9 O30 -","- C41 H92 Fe N9 O30 -","- C82 H184 Fe2 N18 O60 -","2","1","BS1004","Hossain, M. Bilayet; Jalal, Mahbubul A. F.; van der Helm, Dick","6-<small>L</small>-Alanineferrirubin, a Ferrichrome-type Siderophore from the Fungus <i>Aspergillus ochraceous</i>","Acta Crystallographica Section C","1997","53","6","716","718","10.1107/S0108270196015909","","","0.71073","MoKα","","0.0783","0.0648","","0.183","0.1628","","","","1.061","1.079","1.079","","","","","has coordinates","199470","2020-10-21","18:00:00",""
"2006193","19.244","0.003","8.882","0.001","9.736","0.002","90","","103.99","0.01","90","","1614.8","0.5","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","ferrocenylbenzonitrile","","","- C20 H19 Fe N O -","- C20 H19 Fe N O -","- C80 H76 Fe4 N4 O4 -","4","1","BS1011","Zhang, Hongming; Lu, Yingchun; Biehl, Ed","2-(Ferrocenylmethyl)-6-methoxy-3-methylbenzonitrile and 10-(Ferrocenylmethyl)phenanthrene-9-carbonitrile","Acta Crystallographica Section C","1997","53","6","720","723","10.1107/S0108270196015958","","","0.71073","MoKα","","0.0527","0.0367","","0.1068","0.0919","","","","1.063","1.102","1.102","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006194","12.328","0.003","19.923","0.005","7.71","0.002","90","","96.63","0.02","90","","1881","0.8","220","2","220","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","ferrocenylphenanthrenecarbonitrile","","","- C26 H19 Fe N -","- C26 H19 Fe N -","- C104 H76 Fe4 N4 -","4","1","BS1011","Zhang, Hongming; Lu, Yingchun; Biehl, Ed","2-(Ferrocenylmethyl)-6-methoxy-3-methylbenzonitrile and 10-(Ferrocenylmethyl)phenanthrene-9-carbonitrile","Acta Crystallographica Section C","1997","53","6","720","723","10.1107/S0108270196015958","","","0.71073","MoKα","","0.0992","0.0501","","0.1294","0.1007","","","","1.027","1.119","1.119","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006195","7.39","0.001","12.49","0.002","19.223","0.003","90","","91.75","0.01","90","","1773.5","0.5","295","","295","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H24 O5 -","- C19 H24 O5 -","- C76 H96 O20 -","4","1","BS1017","Kennedy, Alan R.; Kerr, William J.; McKendry, Sharon","4-Cyclohexanespiro{3-[2-methoxy-2-(2,6-dimethoxyphenyl)ethenyl]oxetan-2-one}","Acta Crystallographica Section C","1997","53","6","746","748","10.1107/S0108270197001418","","","0.71069","MoKα","","0.1305","0.0605","","0.0617","0.0539","","","","","1.517","1.517","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006196","11.364","0.003","11.372","0.003","11.668","0.004","76.13","0.02","89.66","0.03","65.21","0.02","1321.3","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Dichloro-tetrabiphenylcarboxylate-dirhenium","Dichloro tetrakis(μ~2~-2-biphenylcarboxylato) dirhenium(III) - dichloromethane solvate","","- C54 H40 Cl6 O8 Re2 -","- C54 H40 Cl6 O8 Re2 -","- C54 H40 Cl6 O8 Re2 -","1","0.5","BS1024","Cotton, F. Albert; Daniels, Lee M.; Liu, Jian; Ren, Tong","Tetrakis(μ-2-biphenylcarboxylato-<i>O</i>:<i>O</i>')bis[chlororhenium(III)] Bis(dichloromethane) Solvate","Acta Crystallographica Section C","1997","53","6","714","716","10.1107/S0108270197001480","","","1.54184","CuKα","","0.0338","0.0314","","0.0842","0.0826","","","","1.079","1.091","1.091","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006198","16.179","0.002","10.992","0.002","16.695","0.002","90","","106.42","0.01","90","","2847.9","0.7","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","4,6,10,12-tetraphenyl-1,3-dithia-7,9-dioxacyclododecane","","- C32 H32 O2 S2 -","- C32 H32 O2 S2 -","- C128 H128 O8 S8 -","4","1","CF1105","Llorca, Jordi; Molins, Elies; Flores-Vela, Abelardo; Cruz-Sanchez, Samuel; Juaristi, Eusebio","4,6,10,12-Tetraphenyl-7,9-dioxa-1,3-dithiacyclododecane","Acta Crystallographica Section C","1997","53","6","816","818","10.1107/S0108270197000759","","","0.71069","MoKα","","0.1996","0.0457","","0.1828","0.1363","","","","0.684","0.807","0.807","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006199","8.002","0.005","12.286","0.002","17.38","0.004","90","","91.1","0.02","90","","1708.4","1.2","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","9-oxo-2-phenoxy-1,3,8,10-tetraaza-2λ^5^- phosphatricyclo[8.4.0.0^3,8^]tetradecane-2-sulfide","","- C15 H21 N4 O2 P S -","- C15 H21 N4 O2 P S -","- C60 H84 N16 O8 P4 S4 -","4","1","CF1146","Engelhardt, Udo; Rosefid, Mehdi","A Tricyclic Phosphorus(V)‒Hydrazine System with Twist Conformation of the Central Heterocycle","Acta Crystallographica Section C","1997","53","6","773","775","10.1107/S0108270196014898","","","0.71069","MoKα","","0.067","0.048","","0.03","0.029","","","","2.48","2.8","2.8","","","","","has coordinates","190439","2020-10-21","18:00:00",""
"2006200","11.344","0.001","7.437","0.001","15.542","0.002","90","","108.39","0.01","90","","1244.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2-Fluorophenyl)-1H,3H-thiazolo[3,4-a]benzimidazole","","- C15 H11 F N2 S -","- C15 H11 F N2 S -","- C60 H44 F4 N8 S4 -","4","1","CF1149","Bruno, Giuseppe; Grasso, Silvana; Monforte, Pietro; Nicoló, Francesco; Scopelliti, Rosario","1-(2-Fluorophenyl)-and 1-(3-Fluorophenyl)-1<i>H</i>,3<i>H</i>-thiazolo[3,4-<i>a</i>]benzimidazole","Acta Crystallographica Section C","1997","53","6","764","767","10.1107/S0108270197000760","","","0.71073","MoKα","","0.0414","0.0288","","0.075","0.0721","","","","0.933","1.051","1.051","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006201","11.249","0.001","7.421","0.001","15.867","0.002","90","","107.56","0.01","90","","1262.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(3-Fluorophenyl)-1H,3H-thiazolo[3,4-a]benzimidazole","","- C15 H11 F N2 S -","- C15 H11 F N2 S -","- C60 H44 F4 N8 S4 -","4","1","CF1149","Bruno, Giuseppe; Grasso, Silvana; Monforte, Pietro; Nicoló, Francesco; Scopelliti, Rosario","1-(2-Fluorophenyl)-and 1-(3-Fluorophenyl)-1<i>H</i>,3<i>H</i>-thiazolo[3,4-<i>a</i>]benzimidazole","Acta Crystallographica Section C","1997","53","6","764","767","10.1107/S0108270197000760","","","0.71073","MoKα","","0.0455","0.0347","","0.1011","0.0977","","","","1.049","1.171","1.171","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006202","9.193","0.0004","9.9973","0.0009","11.1516","0.0008","90","","90","","90","","1024.89","0.13","293","2","293","2","","","","","","","","3","A b a 2","A 2 -2ab","41","","","","- Mo8 O14 Sm -","- Mo8 O14 Sm -","- Mo32 O56 Sm4 -","4","","DU1168","Tortelier, J.; Gougeon, P.","SmMo~8~O~14~","Acta Crystallographica Section C","1997","53","6","668","671","10.1107/S0108270196015533","","","0.71073","MoKα","","0.0232","0.0202","","0.046","0.0453","","","","1.285","1.299","1.299","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006203","12.5928","0.0007","10.6943","0.001","16.0674","0.0005","90","","93.168","0.003","90","","2160.5","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","5,7-dichlorokynurenic acid hydrate","4-oxo-1,4-dihydro-5,7-dichloroquinoline-2-carboxylic acid hydrate","","- C10 H7 Cl2 N O4 -","- C10 H7 Cl2 N O4 -","- C80 H56 Cl16 N8 O32 -","8","1","FG1216","Kubicki, Maciej; Bassyouni, Hanan A.R.; Codding, Penelope W.","5,7-Dichlorokynurenic Acid Hydrate, an Antagonist for the Glycine Binding Site on the NMDA Receptor","Acta Crystallographica Section C","1997","53","6","739","742","10.1107/S010827019700005X","","","1.54178","CuKα","","0.0483","0.0406","","0.14","0.1123","","","","1.229","1.051","1.051","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006204","14.814","0.003","12.372","0.002","14.306","0.002","90","","91.08","0.01","90","","2621.5","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(2,2'-dipyridylmethanediol-N,N')palladium(II) Chloride Tetrahydrate","","- C22 H28 Cl2 N4 O8 Pd -","- C22 H28 Cl2 N4 O8 Pd -","- C88 H112 Cl8 N16 O32 Pd4 -","4","0.5","FG1220","Sommerer, Shaun O.; Jircitano, Alan J.; Westcott, Barry L.; Abboud, Khalil A.; Bauer, Jeanette A. Krause","Bis(di-2-pyridylmethanediol-<i>N</i>,<i>N</i>')palladium(II) Dichloride Tetrahydrate and Dichloro(di-2-pyridylmethanediol-<i>N</i>,<i>N</i>')gold(III) Chloride","Acta Crystallographica Section C","1997","53","6","707","710","10.1107/S0108270197000218","","","0.71073","MoKα","","0.0429","0.0364","","0.1206","0.1144","","","","1.054","1.098","1.098","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2006205","9.233","0.002","12.271","0.003","12.627","0.003","90","","95.58","0.03","90","","1423.8","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichloro(2,2'-dipyridylmethanediol-N,N')gold(III) Chloride","","- C11 H10 Au Cl3 N2 O2 -","- C11 H10 Au Cl3 N2 O2 -","- C44 H40 Au4 Cl12 N8 O8 -","4","1","FG1220","Sommerer, Shaun O.; Jircitano, Alan J.; Westcott, Barry L.; Abboud, Khalil A.; Bauer, Jeanette A. Krause","Bis(di-2-pyridylmethanediol-<i>N</i>,<i>N</i>')palladium(II) Dichloride Tetrahydrate and Dichloro(di-2-pyridylmethanediol-<i>N</i>,<i>N</i>')gold(III) Chloride","Acta Crystallographica Section C","1997","53","6","707","710","10.1107/S0108270197000218","","","0.71073","MoKα","","0.046","0.0365","","0.0938","0.0898","","","","1.008","1.061","1.061","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006206","11.4438","0.0012","9.5077","0.001","21.497","0.003","90","","98.245","0.01","90","","2314.8","0.5","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","7,8-Bis(2-pyridiniumthio)-7,8-dicarba-nido-undecaborate trifluoromethanesulfonate","","- C13 H20 B9 F3 N2 O3 S3 -","- C13 H20 B9 F3 N2 O3 S3 -","- C52 H80 B36 F12 N8 O12 S12 -","4","1","FG1234","Jones, Peter G.; Crespo, Olga; Gimeno, M. Concepción; Laguna, Antonio","7,8-Bis(pyridinium-2-ylthio)-7,8-dicarba-<i>nido</i>-undecaborate Trifluoromethanesulfonate","Acta Crystallographica Section C","1997","53","6","767","768","10.1107/S0108270197002497","","","0.71073","MoKα","","0.0664","0.0349","","0.0807","0.0737","","","","0.872","1.001","1.001","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006207","10.646","0.003","11.286","0.003","14.205","0.004","78.2","0.02","80.64","0.02","71.77","0.02","1577.9","0.8","143","2","143","2","","","","","","","","3","P -1","-P 1","2","","2,13-dithia[3]orthocyclo[3](2,3)-naphthalenophane","","- C20 H18 S2 -","- C20 H18 S2 -","- C80 H72 S8 -","4","2","FG1236","Jones, Peter G.; Kuś, Piotr","2,13-Dithia[3]orthocyclo[3](2,3)naphthalenophane","Acta Crystallographica Section C","1997","53","6","786","787","10.1107/S0108270197000061","","","0.71073","MoKα","","0.0594","0.0397","","0.1072","0.0916","","","","1.053","1.045","1.045","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006208","7.7374","0.0013","8.5142","0.0014","9.0238","0.0009","65.777","0.012","69.777","0.011","83.54","0.013","508.41","0.14","288","1","288","1","","","","","","","","7","P -1","-P 1","2","trans-diisothiocyanato(cyclam)chromium(III) perchlorate","trans-diisothiocyanato(1,4,8,11-tetraazacyclotetradecane)chromium(III) perchlorate","","- C12 H24 Cl Cr N6 O4 S2 -","- C12 H24 Cl Cr N6 O4 S2 -","- C12 H24 Cl Cr N6 O4 S2 -","1","0.5","FG1243","Friesen, Duane A.; Quail, J. Wilson; Waltz, William L.; Nashiem, Rodney E.","<i>cis</i>-and <i>trans</i>-Diisothiocyanato(1,4,8,11-tetraazacyclotetradecane)chromium(III) Perchlorate","Acta Crystallographica Section C","1997","53","6","687","691","10.1107/S0108270197002503","","","1.5418","CopperKα","","0.0395","0.0387","","0.1037","0.1029","","","","1.045","1.047","1.047","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006209","7.6925","0.0014","8.471","0.002","8.9387","0.0008","65.93","0.015","69.87","0.012","83.86","0.02","498.96","0.17","173","2","173","2","","","","","","","","7","P -1","-P 1","2","trans-diisothiocyanato(cyclam)chromium(III) perchlorate","trans-diisothiocyanato(1,4,8,11-tetraazacyclotetradecane)chromium(III) perchlorate","","- C12 H24 Cl Cr N6 O4 S2 -","- C12 H24 Cl Cr N6 O4 S2 -","- C12 H24 Cl Cr N6 O4 S2 -","1","0.5","FG1243","Friesen, Duane A.; Quail, J. Wilson; Waltz, William L.; Nashiem, Rodney E.","<i>cis</i>-and <i>trans</i>-Diisothiocyanato(1,4,8,11-tetraazacyclotetradecane)chromium(III) Perchlorate","Acta Crystallographica Section C","1997","53","6","687","691","10.1107/S0108270197002503","","","1.5418","CuKα","","0.0306","0.03","","0.0817","0.0811","","","","1.079","1.079","1.079","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006210","11.0105","0.0011","8.6361","0.0011","21.645","0.002","90","","90.105","0.008","90","","2058.2","0.4","288","1","288","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","cis-diisothiocyanato(cyclam)chromium(III) perchlorate","cis-diisothiocyanato(1,4,8,11-tetraazacyclotetradecane)chromium(III) perchlorate","","- C12 H24 Cl Cr N6 O4 S2 -","- C12 H24 Cl Cr N6 O4 S2 -","- C48 H96 Cl4 Cr4 N24 O16 S8 -","4","1","FG1243","Friesen, Duane A.; Quail, J. Wilson; Waltz, William L.; Nashiem, Rodney E.","<i>cis</i>-and <i>trans</i>-Diisothiocyanato(1,4,8,11-tetraazacyclotetradecane)chromium(III) Perchlorate","Acta Crystallographica Section C","1997","53","6","687","691","10.1107/S0108270197002503","","","0.71073","MoKα","","0.1197","0.0523","","0.1665","0.1362","","","","0.999","1.188","1.188","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006211","10.975","0.002","8.69","0.002","21.144","0.004","90","","90.607","0.014","90","","2016.4","0.7","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","cis-diisothiocyanato(cyclam)chromium(III) perchlorate","cis-diisothiocyanato(1,4,8,11-tetraazacyclotetradecane)chromium(III) perchlorate","","- C12 H24 Cl Cr N6 O4 S2 -","- C12 H24 Cl Cr N6 O4 S2 -","- C48 H96 Cl4 Cr4 N24 O16 S8 -","4","1","FG1243","Friesen, Duane A.; Quail, J. Wilson; Waltz, William L.; Nashiem, Rodney E.","<i>cis</i>-and <i>trans</i>-Diisothiocyanato(1,4,8,11-tetraazacyclotetradecane)chromium(III) Perchlorate","Acta Crystallographica Section C","1997","53","6","687","691","10.1107/S0108270197002503","","","0.71073","MoKα","","0.0837","0.045","","0.1482","0.1172","","","","1.06","1.125","1.125","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006212","7.0923","0.0002","23.1347","0.0005","15.1181","0.0003","90","","94.297","0.001","90","","2473.58","0.1","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C51 H50 N2 O20 -","- C51 H50 N2 O20 -","- C102 H100 N4 O40 -","2","1","FG1246","Abboud, Khalil A.; Toporek, Stan S.; Horenstein, Benjamin A.","2,3-Di-<i>O</i>-benzoyl-1-<i>O</i>-<i>p</i>-nitrophenyl-6-<i>O</i>-pivaloyl-4-<i>O</i>-(3',4',6'-tri-<i>O</i>-acetyl-2'-deoxy-2'-<i>N</i>-phthalimido-β-<small>D</small>-1'-glucopyranosyl)-β-<small>D</small>-glucopyranose","Acta Crystallographica Section C","1997","53","6","742","744","10.1107/S0108270197000097","","","0.71073","MoKα","","0.0602","0.045","","0.1201","0.1028","","","","1.044","1.053","1.053","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006213","9.595","0.005","14.008","0.004","9.413","0.005","93.53","0.03","117.14","0.04","85.03","0.03","1121.3","1","296","","296","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H22 Cl5 Cu N3 -","- C19 H22 Cl5 Cu N3 -","- C38 H44 Cl10 Cu2 N6 -","2","1","FG1248","Parvez, Masood; Sabir, Aaliya P.","Clemizole Tetrachlorocuprate(II) and Clemizole Tetrachlorocobaltate(II)","Acta Crystallographica Section C","1997","53","6","675","677","10.1107/S0108270196015922","","","0.71069","MoKα","","0.0834","0.0572","","0.0942","0.0747","","","","1.89","1.96","1.96","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006214","7.04","0.001","23.282","0.003","13.73","0.001","90","","91.11","0.01","90","","2250","0.5","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H22 Cl5 Co N3 -","- C19 H22 Cl5 Co N3 -","- C76 H88 Cl20 Co4 N12 -","4","1","FG1248","Parvez, Masood; Sabir, Aaliya P.","Clemizole Tetrachlorocuprate(II) and Clemizole Tetrachlorocobaltate(II)","Acta Crystallographica Section C","1997","53","6","675","677","10.1107/S0108270196015922","","","0.71069","MoKα","","0.1134","0.0566","","0.1568","0.0809","","","","2.31","1.67","1.67","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006215","9.17","0.003","15.54","0.007","9.339","0.002","90","","99.14","0.02","90","","1313.9","0.8","200","","200","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H18 Cl2 S2 Zn -","- C8 H18 Cl2 S2 Zn -","- C32 H72 Cl8 S8 Zn4 -","4","1","FG1260","Parvez, Masood; Mesher, Shaun T. E.; Clark, Peter D.","<i>trans</i>-[2,3-Bis(methylthio)hexane-<i>S</i>,<i>S</i>']dichlorozinc(II), <i>trans</i>-[1,2-Bis(methylthio)cyclohexane-<i>S</i>,<i>S</i>']dichlorozinc(II) and <i>cis</i>-[5,6-Bis(methylthio)-1,3-cycloheptadiene-<i>S</i>,<i>S</i>']dichlorozinc(II)","Acta Crystallographica Section C","1997","53","6","681","685","10.1107/S0108270197002631","","","0.71069","MoKα","","","0.027","","","0.022","","","","","1.403","1.403","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006216","12.325","0.002","13.196","0.002","8.535","0.001","107.69","0.01","92.31","0.01","98.63","0.01","1302.1","0.3","200","","200","","","","","","","","","5","P -1","-P 1","2","","","","- C8 H16 Cl2 S2 Zn -","- C8 H16 Cl2 S2 Zn -","- C32 H64 Cl8 S8 Zn4 -","4","2","FG1260","Parvez, Masood; Mesher, Shaun T. E.; Clark, Peter D.","<i>trans</i>-[2,3-Bis(methylthio)hexane-<i>S</i>,<i>S</i>']dichlorozinc(II), <i>trans</i>-[1,2-Bis(methylthio)cyclohexane-<i>S</i>,<i>S</i>']dichlorozinc(II) and <i>cis</i>-[5,6-Bis(methylthio)-1,3-cycloheptadiene-<i>S</i>,<i>S</i>']dichlorozinc(II)","Acta Crystallographica Section C","1997","53","6","681","685","10.1107/S0108270197002631","","","0.71069","MoKα","","0.082","0.029","","0.214","0.06","","","","0.999","0.998","0.998","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006217","7.513","0.006","12.044","0.007","7.47","0.004","95.15","0.02","93.67","0.03","103.66","0.04","651.6","0.7","200","","200","","","","","","","","","5","P -1","-P 1","2","","","","- C9 H14 Cl2 S2 Zn -","- C9 H14 Cl2 S2 Zn -","- C18 H28 Cl4 S4 Zn2 -","2","1","FG1260","Parvez, Masood; Mesher, Shaun T. E.; Clark, Peter D.","<i>trans</i>-[2,3-Bis(methylthio)hexane-<i>S</i>,<i>S</i>']dichlorozinc(II), <i>trans</i>-[1,2-Bis(methylthio)cyclohexane-<i>S</i>,<i>S</i>']dichlorozinc(II) and <i>cis</i>-[5,6-Bis(methylthio)-1,3-cycloheptadiene-<i>S</i>,<i>S</i>']dichlorozinc(II)","Acta Crystallographica Section C","1997","53","6","681","685","10.1107/S0108270197002631","","","0.71069","MoKα","","0.079","0.038","","0.109","0.09","","","","1.047","1.085","1.085","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006218","14.355","0.002","7.836","0.002","20.353","0.002","90","","106.74","0.01","90","","2192.4","0.7","296","2","296","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C16 H22 Cl5 Cu N3 -","- C16 H22 Cl5 Cu N3 -","- C64 H88 Cl20 Cu4 N12 -","4","1","FG1261","Parvez, Masood; Sabir, Aaliya P.","Chloropyramine Tetrachlorocuprate(II)","Acta Crystallographica Section C","1997","53","6","678","679","10.1107/S0108270197002060","","","0.71069","MoKα","","0.255","0.041","","0.212","0.099","","","","0.933","0.907","0.907","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006219","10.106","0.004","11.8","0.005","18.301","0.004","90","","94.42","0.02","90","","2175.9","1.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H24 Cl4 Cu N2 -","- C19 H24 Cl4 Cu N2 -","- C76 H96 Cl16 Cu4 N8 -","4","1","FG1262","Parvez, Masood; Sabir, Aaliya P.","Triprolidine Tetrachlorocuprate(II)","Acta Crystallographica Section C","1997","53","6","679","681","10.1107/S0108270197002072","","","0.71069","MoKα","","0.185","0.041","","0.193","0.092","","","","1.015","1.087","1.087","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006220","5.7618","0.0006","14.4939","0.0018","14.5031","0.0018","90","","90","","90","","1211.2","0.2","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Thieno[2,3-c]pyridine","","- C7 H5 N S -","- C7 H5 N S -","- C56 H40 N8 S8 -","8","1","FG1264","Nerenz, Heiko; Grahn, Walter; Jones, Peter G.","Thieno[2,3-<i>c</i>]pyridine, the First Structure of a Thienopyridine","Acta Crystallographica Section C","1997","53","6","787","789","10.1107/S0108270197002084","","","0.71073","MoKα","","0.0329","0.0263","","0.0776","0.0756","","","","1.06","1.139","1.139","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006221","8.939","0.002","9.36","0.002","11.438","0.002","90","","90","","90","","957","0.3","143","2","143","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Oxalyl chloride dimesylamide","","- C4 H6 Cl N O6 S2 -","- C4 H6 Cl N O6 S2 -","- C16 H24 Cl4 N4 O24 S8 -","4","1","FG1267","Dalluhn, Jörg; Henschel, Dagmar; Blaschette, Armand; Jones, Peter G.","Polysulfonylamines. LXXXII. Oxalyl Chloride Dimesylamide","Acta Crystallographica Section C","1997","53","6","781","783","10.1107/S0108270197002096","","","0.71073","MoKα","","0.0208","0.0201","","0.0575","0.0526","","","","1.073","1.075","1.075","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006222","9.1599","0.0013","9.1599","0.0013","5.445","0.003","90","","90","","120","","395.6","0.2","143","2","143","2","","","","","","","","3","P 63/m","-P 6c","176","","2,4,6-Tris(diazo)-cyclohexane-1,3,5-trione","","- C6 N6 O3 -","- C6 N6 O3 -","- C12 N12 O6 -","2","0.166667","FG1274","Jones, Peter G.; Ahrens, Birte; Höpfner, Thomas; Hopf, Henning","2,4,6-Tris(diazo)cyclohexane-1,3,5-trione","Acta Crystallographica Section C","1997","53","6","783","786","10.1107/S0108270197002114","","","0.71073","MoKα","","0.0306","0.0291","","0.0933","0.0885","","","","1.184","1.196","1.196","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006223","5.0997","0.0009","9.174","0.001","28.375","0.005","90","","90","","90","","1327.5","0.4","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,5-diaziridinyl-3-phenylquinone","","- C16 H14 N2 O2 -","- C16 H14 N2 O2 -","- C64 H56 N8 O8 -","4","1","HA1183","Hargreaves, Rob H. J.; Mayalarp, Stephen P.; Butler, John; Lee, Moses; Pennington, William T.","2,5-Diaziridinyl-3-phenyl-<i>p</i>-benzoquinone","Acta Crystallographica Section C","1997","53","6","749","751","10.1107/S0108270197001224","","","1.54178","CuKα","","0.0759","0.0451","","0.1226","0.1094","","","","0.861","1.029","1.029","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006224","6.212","0.001","10.162","0.005","27.589","0.006","90","","90","","90","","1741.6","1","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H30 O5 -","- C19 H30 O5 -","- C76 H120 O20 -","4","1","HA1184","Damas, Ana M.; Kijjoa, Anake; Pinto, Madalena","Two Dolabrane-type Diterpenoids","Acta Crystallographica Section C","1997","53","6","755","757","10.1107/S0108270196015752","","","0.71069","MoKa","","0.0422","0.0366","","0.1156","0.0996","","","","1.047","1.053","1.053","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006225","6.257","0.001","15.137","0.003","9.819","0.002","90","","96.56","0.02","90","","923.9","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H31 Cl O4 -","- C19 H31 Cl O4 -","- C38 H62 Cl2 O8 -","2","1","HA1184","Damas, Ana M.; Kijjoa, Anake; Pinto, Madalena","Two Dolabrane-type Diterpenoids","Acta Crystallographica Section C","1997","53","6","755","757","10.1107/S0108270196015752","","","0.71069","MoKa","","0.0336","0.0316","","0.0801","0.0775","","","","1.057","1.048","1.048","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006226","8.96","0.004","20.536","0.011","8.146","0.004","90","","102.97","0.04","90","","1460.6","1.3","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","guanidinium hydrogen squarate","","","- C5 H7 N3 O4 -","- C5 H7 N3 O4 -","- C40 H56 N24 O32 -","8","2","JZ1154","Tsonko Kolev; Hans Preut; Paul Bleckmann; Valentina Radomirska","Guanidinium Hydrogen Squarate","Acta Crystallographica Section C","1997","53","6","805","807","10.1107/S0108270197001182","","","0.71073","MoKα","","0.0848","0.0562","","0.1983","0.1528","","","","0.988","1.171","1.171","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006227","8.9054","0.0013","8.9054","0.0013","37.978","0.008","90","","90","","90","","3011.9","0.9","293","2","","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C30 H50 Cl2 Pd2 -","- C30 H50 Cl2 Pd2 -","- C120 H200 Cl8 Pd8 -","4","0.5","","Larbi El Firdoussi; Smaïl Allaoud; Abdellah Karim; Alejandro F. Barrero; Miguel Quirós; Yves Castanet; André Mortreux","Bis(π-allyl-6,7-dihydrohimachalene)-α,α-dichlorodipalladium","Acta Crystallographica Section C","1997","53","","710","712","","","","","","","","0.0738","","","0.153","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2006228","5.6211","0.0009","7.356","0.001","18.144","0.003","98.956","0.009","97.03","0.01","99.326","0.009","722.9","0.2","295.2","","295.2","","","","","","","","","6","P -1","-P 1","2","","","","- C15 H9 Br N2 O3 S -","- C15 H9 Br N2 O3 S -","- C30 H18 Br2 N4 O6 S2 -","2","1","JZ1178","Ruiwu, Tao; Barnes, Charles L.; Cox, Osvaldo; Hernàndez, Wigberto J.; Cardona, Damaris; Huang, Songping D.","1-(1,3-Benzothiazol-2-yl)-2-(2-bromo-5-nitrophenyl)ethanone","Acta Crystallographica Section C","1997","53","6","801","803","10.1107/S0108270197000656","","","0.7107","MoKα","","","0.0317","","","0.0375","","","","","1.766","1.766","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006229","28.663","0.0007","28.663","0.0007","7.25719","0.0001","90","","90","","90","","5962.3","0.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","(4-Ethylpyridine)(N-salicylideneglycinato)copper(II) Tetramer","","- C64 H64 Cu4 N8 O12 -","- C64 H64 Cu4 N8 O12 -","- C256 H256 Cu16 N32 O48 -","4","0.25","JZ1191","Warda, Salam A.","A (4-Ethylpyridine)(<i>N</i>-salicylideneglycinato)copper(II) Tetramer","Acta Crystallographica Section C","1997","53","6","697","699","10.1107/S0108270197002692","","","1.54178","CuKα","","0.0475","0.0435","","0.1254","0.1225","","","","1.124","1.153","1.153","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006230","13.8156","0.0012","6.947","0.002","12.4225","0.0014","90","","111.66","0.01","90","","1108.1","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Potassium 3-Dithiocarboxy-3-Aza-5-Amino Pentanoate Dihydrate","","- C5 H13 K N2 O4 S2 -","- C5 H12 K N2 O4 S2 -","- C20 H48 K4 N8 O16 S8 -","4","1","KA1221","Bogdan Prelesnik; Katarina Andjelković; Zorica Marković; Tibor Sabo; Srećko Trifunović","Potassium 3-Dithiocarboxy-3-aza-5-aminopentanoate Dihydrate","Acta Crystallographica Section C","1997","53","6","719","720","10.1107/S0108270197001650","","","0.71073","MoKα","","","0.039","","","0.041","","","","","0.957","0.957","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006231","9.2523","0.0007","30.116","0.001","10.2195","0.0007","90","","95.203","0.003","90","","2835.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dicyclohexylammonium (N,N-Dicyclohexylthiocarbamoylthio)acetate","","- C27 H48 N2 O2 S2 -","- C27 H48 N2 O2 S2 -","- C108 H192 N8 O8 S8 -","4","1","KH1126","Ng, Seik Weng","Dicyclohexylammonium (<i>N</i>,<i>N</i>-Dicyclohexylthiocarbamoylthio)acetate","Acta Crystallographica Section C","1997","53","6","779","781","10.1107/S0108270197000644","","","0.71073","MoKα","","0.0646","0.0453","","0.1249","0.115","","","","1.04","1.135","1.135","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006232","6.797","0.002","13.558","0.006","7.217","0.002","90","","96.58","0.03","90","","660.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(cyanamidonitrate)bis(imidazole) copper(II) complex, C~8~H~8~N~10~O~4~Cu~1~","","- C8 H8 Cu N10 O4 -","- C8 H8 Cu N10 O4 -","- C16 H16 Cu2 N20 O8 -","2","0.5","MU1302","Kožíšek, Jozef; Jesús García Díaz; Mária Hvastijová; Lothar Jäger","<i>trans</i>-Bis(cyanamidonitrato-<i>N</i>:<i>O</i>)bis(imidazole-<i>N</i>^3^)copper(II), [Cu(CN~3~O~2~)~2~(C~3~H~4~N~2~)~2~]","Acta Crystallographica Section C","1997","53","6","703","705","10.1107/S010827019700111X","","","0.71073","MoKα","","0.0706","0.0359","","0.102","0.0963","","","","0.975","1.174","1.174","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006233","7.4538","0.0006","12.563","0.002","12.983","0.001","90","","90","","90","","1215.8","0.2","297","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H10 I N O -","- C13 H10 I N O -","- C52 H40 I4 N4 O4 -","4","1","MU1303","Elmali, Ayhan; Elerman, Yalc̨in","2-[(2-Iodophenyl)iminomethyl]phenol","Acta Crystallographica Section C","1997","53","6","791","793","10.1107/S0108270197000619","","","0.71069","MoKα","","0.0235","0.0217","","0.0589","0.0577","","","","1.093","1.093","1.093","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006234","9.722","0.003","7.475","0.002","20.255","0.005","90","","99.75","0.01","90","","1450.7","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","onysilin","2,3-dihydro-5-hydroxy-6,7-dimethoxy-2-phenyl-4H-1-benzopyran-4-one","","- C17 H16 O5 -","- C17 H16 O5 -","- C68 H64 O20 -","4","1","MU1306","Chantrapromma, Kan; Seechamnanturakit, Vatcharee; Ponglimanont, Chanita; Pakawatchai, Chaveng; Fun, Hoong-Kun; Sivakumar, Kandasamy","2,3-Dihydro-5-hydroxy-6,7-dimethoxy-2-phenyl-4<i>H</i>-1-benzopyran-4-one (Onysilin)","Acta Crystallographica Section C","1997","53","6","734","736","10.1107/S0108270197001121","","","0.71073","MoKα","","0.0698","0.0517","","0.1655","0.1516","","","","1.086","1.202","1.202","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006235","10.75","0.002","26.735","0.006","10.533","0.001","90","","90","","90","","3027.2","0.9","293","","20","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H46 O11 -","- C31 H50 O11 -","- C124 H200 O44 -","4","1","NA1249","Chen, Hao; Tan, Ren-Xiang; Liu, Zhi-Li; Zhao, Cong-Yuan; Sun, Jie","A Clerodane Diterpene with Antibacterial Activity from <i>Ajuga lupulina</i>","Acta Crystallographica Section C","1997","53","6","814","816","10.1107/S0108270196013637","","","0.7107","MoKα","","0.0679","0.0465","","0.137","0.0614","","","","","2.38","2.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006236","10.838","0.001","9.347","0.001","13.456","0.001","90","","92.3","0.01","90","","1362","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3S,4R,5R)-5,6-diacetoxy-4-(t-butyldiphenylsilyloxy)-3-hydroxy -4-methylhex-1-en","","- C27 H36 O6 Si -","- C27 H36 O6 Si -","- C54 H72 O12 Si2 -","2","1","NA1274","Lewinski, Krzysztof","(2<i>R</i>,3<i>R</i>,4<i>S</i>)-3-(<i>tert</i>-Butyldiphenylsiloxy)-4-hydroxy-3-methylhex-5-ene-1,2-diyl Diacetate","Acta Crystallographica Section C","1997","53","6","753","755","10.1107/S0108270197000498","","","0.71069","MoKα","","0.0345","0.0317","","0.0869","0.0856","","","","1.021","1.037","1.037","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006237","11.3664","0.0002","8.8648","0.0002","5.72","0.0001","90","","90","","90","","576.352","0.019","298","","298","","","","","","","","","3","P n m a","-P 2ac 2n","62","catena-Cyclopentadienylcesium","","","- C5 H5 Cs -","- C5 H5 Cs -","- C20 H20 Cs4 -","4","0.5","NA1280","Robert E. Dinnebier; Falk Olbrich; Götz M. Bendele","Cyclopentadienylcaesium by High-Resolution X-ray Powder Diffraction","Acta Crystallographica Section C","1997","53","6","699","701","10.1107/S0108270197001984","","","0.69006","Synchrotron","","0.0545","0.0545","","","0.0746","","","","","1.406","1.406","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006238","25.31","0.01","9.242","0.002","23.006","0.002","90","0.01","117.58","0.02","90","0.02","4770","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis(propionato)[tetra(p-chlorophenyl)porphryinatotin(IV) Dichloromethane solvate","","- C51 H36 Cl6 N4 O4 Sn -","- C51 H34 Cl6 N4 O4 Sn -","- C204 H136 Cl24 N16 O16 Sn4 -","4","0.5","NA1286","Belcher, Warwick J.; Brothers, Penelope J.; Rickard, Clifton E. F.","Bis(propionato-<i>O</i>)[5,10,15,20-tetra(<i>p</i>-chlorophenyl)porphyrinato-κ^4^<i>N</i>]tin(IV) Dichloromethane Solvate","Acta Crystallographica Section C","1997","53","6","725","726","10.1107/S0108270197002333","","","0.71069","MoKα","","0.1011","0.0482","","0.1375","0.1127","","","","1.063","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006239","8.284","0.001","8.284","0.001","12.092","0.002","90","","90","","90","","829.8","0.2","297","","297","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Au2 Cs2 I6 -","- Au2 Cs2 I6 -","- Au4 Cs4 I12 -","2","0.0625","OA1010","Matsushita, Nobuyuki; Kitagawa, Hiroshi; Kojima, Norimichi","A Three-Dimensional Iodo-Bridged Mixed-Valence Gold(I, III) Compound, Cs~2~Au^I^Au^III^I~6~","Acta Crystallographica Section C","1997","53","6","663","666","10.1107/S0108270197000279","","","0.71069","MoKα","","","0.0698","","","0.0851","","","","","2.66","2.66","","","","","has coordinates","209447","2020-10-21","18:00:00",""
"2006240","15.866","0.002","17.32","0.002","10.3158","0.0009","90","","90","","90","","2834.8","0.5","296.2","","296.2","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C31 H46 O7 -","- C31 H46 O7 -","- C124 H184 O28 -","4","1","OA1013","Limmatvapirat, Sontaya; Yamaguchi, Kentaro; Yonemochi, Etsuo; Oguchi, Toshio; Yamamoto, Keiji","A 1:1 Deoxycholic Acid‒Salicylic Acid Complex","Acta Crystallographica Section C","1997","53","6","803","805","10.1107/S0108270197000899","","","1.5418","CuKα","","","0.0413","","","0.0444","","","","","1.867","1.867","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006241","8.307","0.002","6.7435","0.0009","10.102","0.002","90","","118.576","0.006","90","","496.96","0.17","296","","296","","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C6 H12 N2 O6 V -","- C6 H10 N2 O6 V -","- C12 H20 N4 O12 V2 -","2","1","OA1014","Kan Kanamori; Kazuhito Ino; Ken-Ichi Okamoto","Aqua(ethylenediamine-<i>N</i>,<i>N</i>'-diacetato-<i>O</i>,<i>O</i>')oxovanadium(IV)","Acta Crystallographica Section C","1997","53","6","672","673","10.1107/S0108270197000231","","","0.7107","MoKα","","","0.0309","","","0.045","","","","","1.417","1.417","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006242","17.329","0.005","13.631","0.003","6.943","0.002","90","","101.4","0.01","90","","1607.7","0.7","296","","296","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C10 H21 N2 Na O10 V -","- C10 H21 N2 Na O10 V -","- C40 H84 N8 Na4 O40 V4 -","4","1","OA1015","Kan Kanamori; Keisuke Miyazaki; Ken-Ichi Okamoto","Sodium (<i>N</i>-Ethylethylenediamine-<i>N</i>,<i>N</i>',<i>N</i>'-triacetato)oxovanadium(IV) Trihydrate","Acta Crystallographica Section C","1997","53","6","673","675","10.1107/S0108270197000243","","","0.7107","MoKα","","","0.0381","","","0.0617","","","","","1.398","1.398","","","","","has coordinates","199684","2020-10-21","18:00:00",""
"2006243","13.476","0.002","14.04","0.001","10.3145","0.0009","103.953","0.008","105.2","0.008","67.291","0.008","1715.7","0.3","296","","296","","","","","","","","","3","P -1","-P 1","2","","2,2-diphenyl-1,3,6,9-tetraoxacycloundecane","","- C19 H22 O4 -","- C19 H22 O4 -","- C76 H88 O16 -","4","2","OA1021","Hatsue Tamura; Shinya Ueno; Kazuhide Ogawa; Toshikazu Nagai; Takumi Oshima","Planar Chirality in 2,2-Diphenyl-1,3,6,9-tetraoxacycloundecane","Acta Crystallographica Section C","1997","53","6","759","761","10.1107/S0108270197000905","","","1.5418","CuKα","","","0.046","","","0.049","","","","","1.69","1.69","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006244","6.286","0.003","12.033","0.005","24.523","0.014","90","","95.31","0.04","90","","1846.9","1.6","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Methylbenzothiazolinospiro-2,3'-(2-methyl-[3H]phenanthr[9,10-b][1,4]oxazine)","","- C24 H18 N2 O S -","- C24 H18 N2 O S -","- C96 H72 N8 O4 S4 -","4","1","PA1249","Xiaodong Sun; Yongchao Liang; Meigong Fan; Edward T. Knobbe; Elizabeth M. Holt","1-Methylbenzothiazolinospiro-2,3'-(2-methyl[3<i>H</i>]phenanthr[9,10-<i>b</i>][1,4]oxazine) and 1-Methylbenzothiazolinospiro-2,3'-(2'-methyl[3<i>H</i>]naphth[2,1-<i>b</i>][1,4]oxazine)","Acta Crystallographica Section C","1997","53","6","820","823","10.1107/S0108270197000012","","","0.71073","MoKα","","","0.0545","","","0.057","","","","","1.3","1.3","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006245","10.237","0.003","13.364","0.007","12.296","0.007","90","","102.16","0.03","90","","1644.4","1.4","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-methylbenzothiazolinospiro-2,3'-(2'-methyl-[3H]naphth[2,1-b][1,4]oxazine)","","- C20 H16 N2 O S -","- C20 H16 N2 O S -","- C80 H64 N8 O4 S4 -","4","1","PA1249","Xiaodong Sun; Yongchao Liang; Meigong Fan; Edward T. Knobbe; Elizabeth M. Holt","1-Methylbenzothiazolinospiro-2,3'-(2-methyl[3<i>H</i>]phenanthr[9,10-<i>b</i>][1,4]oxazine) and 1-Methylbenzothiazolinospiro-2,3'-(2'-methyl[3<i>H</i>]naphth[2,1-<i>b</i>][1,4]oxazine)","Acta Crystallographica Section C","1997","53","6","820","823","10.1107/S0108270197000012","","","0.71073","MoKα","","","0.0462","","","0.0541","","","","","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006246","19.133","0.002","10.2247","0.001","20.0835","0.0014","90","","107.55","0.02","90","","3746","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","4,5,6,7,8,9-Hexamethoxy-indeno[1,2,3-ij]isoquinoline","","","- C21 H21 N O6 -","- C21 H21 N O6 -","- C168 H168 N8 O48 -","8","1","QA0003","Scherowsky, Günter; Frackowiak, Esther; Adam, David","4,5,6,7,8,9-Hexamethoxyindeno[1,2,3-<i>ij</i>]isoquinoline","Acta Crystallographica Section C","1997","53","6","IUC9700005","","10.1107/S0108270197007695","","","0.71073","MoKα","","0.1498","0.0691","","0.2177","0.1663","","","","1.191","1.319","1.319","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006247","9.356","0.002","9.609","0.002","20.529","0.004","92.16","0.03","92.81","0.03","98.73","0.03","1820.1","0.7","223","2","223","2","","","","","","","","6","P -1","-P 1","2","bis(triphenylphosphine)palladium bromide","trans-dibromobis(triphenylphosphine)palladium(II)","","- C40 H38 Br2 O P2 Pd -","- C40 H38 Br2 O P2 Pd -","- C80 H76 Br4 O2 P4 Pd2 -","2","1","QA0004","Stark, Joseph L.; Whitmire, Kenton H.","<i>trans</i>-Dibromobis(triphenylphosphine)palladium(II) Tetrahydrofuran Solvate and <i>trans</i>-Dichlorobis(triphenylphosphine)palladium(II) Bis(chloroform) Solvate","Acta Crystallographica Section C","1997","53","6","IUC9700007","","10.1107/S0108270197099502","","","0.71073","MoKα","","0.0592","0.047","","0.1418","0.1316","","","","1.051","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006248","7.88","0.002","11.201","0.002","12.043","0.002","89.19","0.03","76.76","0.03","74.65","0.03","996.6","0.4","223","2","223","2","","","","","","","","5","P -1","-P 1","2","Bis(triphenylphosphine)palladium chloride","trans-dichlorobis-(triphenylphosphine)palladium(II)","","- C38 H32 Cl8 P2 Pd -","- C38 H32 Cl8 P2 Pd -","- C38 H32 Cl8 P2 Pd -","1","0.5","QA0004","Stark, Joseph L.; Whitmire, Kenton H.","<i>trans</i>-Dibromobis(triphenylphosphine)palladium(II) Tetrahydrofuran Solvate and <i>trans</i>-Dichlorobis(triphenylphosphine)palladium(II) Bis(chloroform) Solvate","Acta Crystallographica Section C","1997","53","6","IUC9700007","","10.1107/S0108270197099502","","","0.71073","MoKα","","0.0579","0.0525","","0.1399","0.1353","","","","1.032","1.047","1.047","","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2006249","13.602","0.004","14.924","0.005","22.77","0.006","90","","105.76","0.02","90","","4448","2","299","2","299","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,1-dimethyl-1-tert-butyl-2,2,2-triphenyldisilane","","- C24 H30 Si2 -","- C24 H30 Si2 -","- C192 H240 Si16 -","8","1","QB0006","Stark, Joseph L.; Whitmire, Kenton H.","[2-(<i>tert</i>-Butyldimethylsilyl)phenyl]diphenyl(2,2,4,4-tetramethylpent-3-yloxy)silane and its Disilane Precursor, 1-<i>tert</i>-Butyl-1,1-dimethyl-2,2,2-triphenyldisilane","Acta Crystallographica Section C","1997","53","6","IUC9700006","","10.1107/S0108270197099496","","","0.71073","MoKα","","0.0946","0.0614","","0.2228","0.1781","","","","0.821","0.806","0.806","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006250","25.977","0.003","25.978","0.007","9.437","0.004","90","","90","","90","","6368","3","293","","293","2","","","","","","","","4","I -4","I -4","82","","[2-(tert-Butyldimethylsilyl)phenyl]diphenyl(2,2,4,4-tetramethylpent-3-yl- oxy)silane","","- C33 H48 O Si2 -","- C33 H48 O Si2 -","- C264 H384 O8 Si16 -","8","1","QB0006","Leigh, William J.; Kroll, Elizabeth C.; Toltl, Nicholas P.; Britten, James F.","[2-(<i>tert</i>-Butyldimethylsilyl)phenyl]diphenyl(2,2,4,4-tetramethylpent-3-yloxy)silane and its Disilane Precursor, 1-<i>tert</i>-Butyl-1,1-dimethyl-2,2,2-triphenyldisilane","Acta Crystallographica Section C","1997","53","6","IUC9700006","","10.1107/S0108270197099496","","","1.54178","CopperKα","","0.1514","0.0797","","0.2631","0.19","","","","1.009","0.983","0.983","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006251","7.29","0.003","7.926","0.003","14.654","0.004","90","","92.94","0.07","90","","845.6","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","α-PNM","4'-nitrophenyl-α-D-mannopyranoside","","- C14 H21 N O9 -","- C14.02 H15 N O9.01 -","- C28.04 H30 N2 O18.02 -","2","1","SK1000","Agianian, Bogos; Perrakis, Anastassis; Kanellopoulos, Panagiotis N.; Sheldrick, Bernard; Hamodrakas, Stavros J.","<i>p</i>-Nitrophenyl α-<small>D</small>-Mannopyranoside Ethanol Solvate","Acta Crystallographica Section C","1997","53","6","811","814","10.1107/S0108270196015776","","","1.5418","CuKα","","0.0682","0.0647","","0.1767","0.1702","","","","1.084","1.087","1.087","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006252","8.384","0.002","10.898","0.002","14.822","0.005","90","","92.76","0.02","90","","1352.7","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Diclofenac acid","(2-((2,6-Dichlorophenyl)amino-phenyl)acetic acid (HD)","","- C14 H11 Cl2 N O2 -","- C14 H11 Cl2 N O2 -","- C56 H44 Cl8 N4 O8 -","4","1","SK1077","Carlo Castellari; Stefano Ottani","Two Monoclinic Forms of Diclofenac Acid","Acta Crystallographica Section C","1997","53","6","794","797","10.1107/S0108270197002126","","","0.71069","MoKα","","0.1569","0.0397","","0.1206","0.0859","","","","1.005","1.172","1.172","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006253","20.226","0.004","6.971","0.003","20.061","0.004","90","","109.64","0.02","90","","2664","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Diclofenac acid","(2-((2,6-Dichlorophenyl)amino-phenyl)acetic acid (HD)","","- C14 H11 Cl2 N O2 -","- C14 H11 Cl2 N O2 -","- C112 H88 Cl16 N8 O16 -","8","1","SK1077","Carlo Castellari; Stefano Ottani","Two Monoclinic Forms of Diclofenac Acid","Acta Crystallographica Section C","1997","53","6","794","797","10.1107/S0108270197002126","","","0.71069","MoKα","","0.0711","0.0374","","0.1126","0.0992","","","","1.057","1.178","1.178","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006254","16.698","0.002","7.0361","0.0005","9.7093","0.0013","90","","108.754","0.011","90","","1080.2","0.2","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","His-Gly hydrochloride","L-Histidyl-glycinium Chloride","","- C8 H13 Cl N4 O3 -","- C8 H13 Cl N4 O3 -","- C32 H52 Cl4 N16 O12 -","4","1","SX1019","Steiner, Thomas","<small>L</small>-Histidylglycinium Chloride, C~8~H~13~N~4~O~3~^+^.Cl^{-^}","Acta Crystallographica Section C","1997","53","6","730","732","10.1107/S0108270197000590","","","1.54176","CuKα","","0.0333","0.0318","","0.0864","0.0854","","","","1.072","1.083","1.083","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006255","7.313","0.003","7.122","0.002","7.0719","0.0015","90","","94","0.03","90","","367.4","0.2","158","2","158","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","N-Methylmorpholinium chloride","","- C5 H12 Cl N O -","- C5 H12 Cl N O -","- C10 H24 Cl2 N2 O2 -","2","0.5","TA1080","Turnbull, Mark M.","<i>N</i>-Methylmorpholinium Chloride","Acta Crystallographica Section C","1997","53","6","818","820","10.1107/S0108270197002710","","","0.71073","MoKα","","0.0329","0.0293","","0.0823","0.0812","","","","1.059","1.118","1.118","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006256","11.81","0.001","13.8044","0.0007","8.925","0.001","90","","101.32","0.008","90","","1426.7","0.2","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-dimethoxybenzylideneisonicotinoylhydrazone","","- C15 H15 N3 O3 -","- C15 H15 N3 O3 -","- C60 H60 N12 O12 -","4","1","TA1119","Chen, Wei; Zhang, X.; Shan, B.; You, X.","3,4-Dimethoxybenzaldehyde Isonicotinoylhydrazone","Acta Crystallographica Section C","1997","53","6","775","777","10.1107/S0108270197000516","","","0.71073","MoKα","","0.0955","0.0595","","0.1405","0.1265","","","","0.973","1.158","1.158","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006257","13.731","0.001","10.294","0.001","17.23","0.001","90","","103.06","0.01","90","","2372.4","0.3","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H30 N3 S6 V -","- C15 H30 N3 S6 V -","- C60 H120 N12 S24 V4 -","4","1","TA1121","Zhu, Hong-Ping; Deng, Yu-Heng; Huang, Xiao-Ying; Chen, Chang-Neng; Liu, Qiu-Tian","Tris(<i>N</i>,<i>N</i>-diethyldithiocarbamato-<i>S</i>,<i>S</i>')vanadium(III)","Acta Crystallographica Section C","1997","53","6","692","693","10.1107/S0108270196015065","","","0.71073","MoKα","","","0.0393","","","0.0456","","","","","1.27","1.27","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006258","8.9289","0.0006","8.9289","0.0006","11.3327","0.0007","90","","90","","120","","782.46","0.09","293","2","293","2","","","","","","","","5","P 63 2 2","P 6c 2c","182","","Tris(ethylenediamine)zinc(II) Nitrate","","- C6 H24 N8 O6 Zn -","- C6 H24 N8 O6 Zn -","- C12 H48 N16 O12 Zn2 -","2","0.166667","TA1128","Neill, Debbie; Riley, Mark J.; Kennard, Colin H. L.","Tris(ethylenediamine-<i>N</i>,<i>N</i>')zinc(II) Dinitrate","Acta Crystallographica Section C","1997","53","6","701","703","10.1107/S0108270197001996","","","0.71069","MoKα","","0.0253","0.0246","","0.059","0.0584","","","","1.209","1.213","1.213","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006259","7.094","0.001","13.77","0.003","12.648","0.002","90","","90.57","0.02","90","","1235.5","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","hexaamminecobalt(III) thiosulfate monohydrate","hexaamminecobalt(III) thiosulfate chloride monohydrate","","- Cl Co H20 N6 O4 S2 -","- Cl Co H20 N6 O4 S2 -","- Cl4 Co4 H80 N24 O16 S8 -","4","1","TA1152","Sobolev, Alexander N.; Figgis, Brian N.","Hexaamminecobalt(III) Thiosulfate Chloride Monohydrate","Acta Crystallographica Section C","1997","53","6","661","663","10.1107/S0108270197002722","","","0.71069","MoKα","","0.046","0.0322","","0.0816","0.0736","","","","1.078","1.102","1.102","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006260","12.868","0.001","14.951","0.001","20.436","0.001","90","","105.58","0.01","90","","3787.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 N O5 S -","- C21 H17 N O5 S -","- C168 H136 N8 O40 S8 -","8","2","VJ1042","Govindasamy, L.; Velmurugan, D.; Ravikumar, K.; Mohanakrishnan, A.K.","4-Hydroxy-6-methoxy-9-phenylsulfonylcarbazol-3-yl Methyl Ketone","Acta Crystallographica Section C","1997","53","6","771","773","10.1107/S0108270196015624","","","0.71073","MoKα","","0.0746","0.0457","","0.1332","0.1149","","","","1.071","1.133","1.133","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006261","8.4247","0.0007","9.482","0.001","10.634","0.001","93.565","0.01","104.462","0.009","101.452","0.008","800.57","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Trimethoprim nitrate","[2,4,-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidine] nitrate.","","- C14 H19 N5 O6 -","- C14 H19 N5 O6 -","- C28 H38 N10 O12 -","2","1","VJ1045","Murugesan, S.; Thomas Muthiah, P.","Hydrogen-Bonding Patterns in Trimethoprim Nitrate, an Antifolate Drug","Acta Crystallographica Section C","1997","53","6","763","764","10.1107/S0108270196015636","","","0.7093","MoKα","","0.0671","0.0503","","0.1297","0.1219","","","","1.134","1.217","1.217","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006262","9.89","0.003","14.122","0.003","11.856","0.003","90","","98.04","0.02","90","","1639.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","3-phenylsulfonyl-3(2-propenyl)chroman-4-one","","- C18 H16 O4 S -","- C18 H16 O4 S -","- C72 H64 O16 S4 -","4","1","VJ1050","Sriram, D.; Srinivasan, S.; Santhosh, K.C.","3-Phenylsulfonyl-3-(2-propenyl)chroman-4-one","Acta Crystallographica Section C","1997","53","6","793","794","10.1107/S0108270197001261","","","0.71073","MoKα","","0.0591","0.0502","","0.1337","0.1274","","","","1.088","1.12","1.12","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006263","8.3549","0.0011","9.1092","0.0014","10.29","0.002","64.196","0.016","77.525","0.014","82.951","0.011","688","0.2","150","0.2","150","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H20 I8 S4 -","- C10 H20 I8 S4 -","- C10 H20 I8 S4 -","1","0.5","AB1440","Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Schröder, Martin","1,4,8,11-Tetrakis(diiodine)-1,4,8,11-tetrathiacyclotetradecane","Acta Crystallographica Section C","1997","53","7","886","888","10.1107/S010827019700067X","","","0.71073","MoKα","","0.0396","0.0312","","0.0689","0.0631","","","","1.156","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006264","8.754","0.002","15.055","0.003","26.742","0.005","90","","90","","90","","3524.4","1.3","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","Anhydride of diacetoxyboric and 1-cyclopropyl-6-fluoro-7-chloro-4-oxo-1,4- dihydroquinoline-3-carboxylic acid","","- C17 H14 B Cl F N O7 -","- C17 H14 B Cl F N O7 -","- C136 H112 B8 Cl8 F8 N8 O56 -","8","1","AB1445","Turel, Iztok; Leban, Ivan; Bukovec, Peter; Barbo, Martin","Boron Complex of a Member of the Quinolone Family","Acta Crystallographica Section C","1997","53","7","942","943","10.1107/S0108270197003491","","","0.71073","MoKα","","0.1014","0.0534","","0.1395","0.1128","","","","1.076","1.128","1.128","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006265","40.266","0.014","7.044","0.0013","7.1203","0.0013","90","","90","","90","","2019.6","0.9","294","1","294","1","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C23 H23 N3 O2 -","- C23 H23 N3 O2 -","- C92 H92 N12 O8 -","4","0.5","AB1460","Meehan, Paul R.; Alyea, Elmer C.; Ferguson, George","2,6-Diacetylpyridinebis(<i>p</i>-methoxyaniline), a Terdentate <i>NNN</i> Donor Ligand","Acta Crystallographica Section C","1997","53","7","888","890","10.1107/S0108270197002035","","","0.7107","MoKα","","0.0973","0.052","","0.1436","0.127","","","","0.94","1.14","1.14","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006266","9.2739","0.0013","16.682","0.002","14.69","0.002","90","","90","","90","","2272.6","0.5","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-(6-Amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycine Dihydrate","","- C7 H13 N5 O6 -","- C7 H13 N5 O6 -","- C56 H104 N40 O48 -","8","1","AB1473","Low, John N.; Ferguson, George; López, Rafael; Arranz, Paloma; Cobo, Justo; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo","<i>N</i>-(6-Amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycine‒Water (1/2)","Acta Crystallographica Section C","1997","53","7","890","892","10.1107/S0108270197003934","","","0.7107","MolybdenumKα","","0.121","0.0482","","0.1205","0.1043","","","","0.889","1.149","1.149","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006267","10.6524","0.0012","10.6524","0.0012","25.548","0.004","90","","90","","90","","2899","0.6","293","","293","","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","","","- C34 H42 O2 -","- C34 H42 O2 -","- C136 H168 O8 -","4","0.5","BK1252","Suh, Il-Hwan; Choi, Sungjo; Lewis, David E.; Jensen, William P.","Two Related Benzylcamphor Dimers","Acta Crystallographica Section C","1997","53","7","963","967","10.1107/S0108270197000371","","","0.7093","MolybdenumKα","","0.047","0.047","","0.027","0.027","","","","","2.18","2.18","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006268","13.453","0.003","10.1847","0.0016","10.2639","0.0018","90","","101.012","0.017","90","","1380.4","0.5","293","","293","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C34 H42 O2 -","- C34 H42 O2 -","- C68 H84 O4 -","2","1","BK1252","Suh, Il-Hwan; Choi, Sungjo; Lewis, David E.; Jensen, William P.","Two Related Benzylcamphor Dimers","Acta Crystallographica Section C","1997","53","7","963","967","10.1107/S0108270197000371","","","1.54056","CopperKα","","0.08","0.08","","0.067","0.067","","","","","7.32","7.32","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006269","9.51","0.002","13.75","0.003","13.41","0.002","90","","107.58","0.01","90","","1671.6","0.6","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[1,3-dimethyl-2(3H)-imidazoleselone]dichlorocobalt(II)","","- C10 H16 Cl2 Co N4 Se2 -","- C10 H16 Cl2 Co N4 Se2 -","- C40 H64 Cl8 Co4 N16 Se8 -","4","1","BK1302","Williams, Daniel J.; Jones, Timothy A.; Rice, Edward D.; Davis, Kerri J.; Ritchie, John A.; Pennington, William T.; Schimek, George L.","Dichlorobis[1,3-dimethylimidazole-2(3<i>H</i>)selone-<i>Se</i>]cobalt(II)","Acta Crystallographica Section C","1997","53","7","837","838","10.1107/S0108270196013947","","","0.71073","MoKα","","0.0626","0.0333","","0.0431","0.0398","","","","","1.16","1.16","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006270","17.762","0.002","6.7914","0.0008","8.5267","0.0011","90","","90","","90","","1028.6","0.2","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C12 H18 O2 -","- C12 H18 O2 -","- C48 H72 O8 -","4","0.5","BK1307","Rath, Nigam P.; Gu, Hong; Murray, Robert W.","1-Acetyl-3-hydroxyadamantane and 1-Carboxy-3-hydroxyadamantane","Acta Crystallographica Section C","1997","53","7","944","946","10.1107/S010827019700245X","","","0.71073","MoKα","","0.0855","0.0551","","0.1581","0.1395","","","","1.04","1.146","1.146","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006271","6.675","0.006","20.767","0.019","7.109","0.007","90","","106.08","0.06","90","","946.9","1.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C11 H16 O3 -","- C11 H16 O3 -","- C44 H64 O12 -","4","1","BK1307","Rath, Nigam P.; Gu, Hong; Murray, Robert W.","1-Acetyl-3-hydroxyadamantane and 1-Carboxy-3-hydroxyadamantane","Acta Crystallographica Section C","1997","53","7","944","946","10.1107/S010827019700245X","","","0.71073","MoKα","","0.1438","0.065","","0.1473","0.1138","","","","1.051","1.201","1.201","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006272","11.188","0.001","4.746","0.001","23.012","0.002","90","0.01","92.05","0.01","90","0.01","1221.1","0.3","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","2-(2-thienylmethylidenehydrazino)quinoline","","- C14 H11 N3 S -","- C14 H11 N3 S -","- C56 H44 N12 S4 -","4","1","BK1314","Mague, Joel T.; Vang, Sue; Berge, Douglas G.; Wacholtz, William F.","Isomerism/Tautomerism in Hydrazones Derived from Thiophenaldehydes and 2-Hydrazinoquinoline","Acta Crystallographica Section C","1997","53","7","973","979","10.1107/S0108270197001212","","","0.71073","MoKα","","0.084","0.039","","","0.048","","","","","1.45","1.45","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006273","9.8543","0.0007","9.854","0.002","28.457","0.004","90","0.01","90","0.009","90","0.009","2763.3","0.7","293","","293","","","","","","","","","4","P 43 21 2","P 41n 2abw","","","2-(methyl(2-thienyl)methylidenehydrazino)quinoline","","- C15 H13 N3 S -","- C15 H13 N3 S -","- C120 H104 N24 S8 -","8","1","BK1314","Mague, Joel T.; Vang, Sue; Berge, Douglas G.; Wacholtz, William F.","Isomerism/Tautomerism in Hydrazones Derived from Thiophenaldehydes and 2-Hydrazinoquinoline","Acta Crystallographica Section C","1997","53","7","973","979","10.1107/S0108270197001212","","","0.71073","MoKα","","0.119","0.037","","","0.043","","","","","1.242","1.242","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006274","9.585","0.0007","9.585","0.001","29.939","0.004","90","0.01","90","0.008","90","0.008","2750.6","0.5","293","","293","","","","","","","","","5","P 41 21 2","P 43n 2nw","","","2-(5-bromothien-2-ylmethylidenehydrazono)quinoline","","- C14 H10 Br N3 S -","- C14 H10 Br N3 S -","- C112 H80 Br8 N24 S8 -","8","1","BK1314","Mague, Joel T.; Vang, Sue; Berge, Douglas G.; Wacholtz, William F.","Isomerism/Tautomerism in Hydrazones Derived from Thiophenaldehydes and 2-Hydrazinoquinoline","Acta Crystallographica Section C","1997","53","7","973","979","10.1107/S0108270197001212","","","0.71073","MoKα","","0.065","0.026","","","0.033","","","","","1.06","1.06","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006275","4.6689","0.0008","11.603","0.001","23.744","0.002","90","0.008","90","0.01","90","0.01","1286.3","0.3","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","2-(5-chlorothien-2-ylmethylidenehydrazino)quinoline","","- C14 H10 Cl N3 S -","- C14 H10 Cl N3 S -","- C56 H40 Cl4 N12 S4 -","4","1","BK1314","Mague, Joel T.; Vang, Sue; Berge, Douglas G.; Wacholtz, William F.","Isomerism/Tautomerism in Hydrazones Derived from Thiophenaldehydes and 2-Hydrazinoquinoline","Acta Crystallographica Section C","1997","53","7","973","979","10.1107/S0108270197001212","","","0.71073","MoKα","","0.041","0.027","","","0.038","","","","","1.38","1.38","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006276","6.904","0.003","8.431","0.003","9.555","0.006","111.21","0.04","92.02","0.04","107.74","0.04","487.2","0.5","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C9 H10 N4 O -","- C9 H10 N4 O -","- C18 H20 N8 O2 -","2","1","BM1034","Cunningham, Ian D.; Wan, Nan Chi; Povey, David C.; Smith, Gallienus W.; Cox, Brian G.","<i>N</i>-Cyano-<i>N</i>'-(4-methoxyphenyl)guanidine","Acta Crystallographica Section C","1997","53","7","984","985","10.1107/S0108270197003065","","","0.71073","MoKα","","","0.058","","","0.076","","","","","1.026","1.026","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006277","8.5261","0.0007","10.012","0.0007","10.2216","0.0014","90","","90","","90","","872.55","0.15","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(N-Boc-amino)acetonitrile","","- C7 H12 N2 O2 -","- C7 H12 N2 O2 -","- C28 H48 N8 O8 -","4","1","BM1121","Sood, Geeta; Schwalbe, Carl H.; Fraser, William","(<i>tert</i>-Butoxycarbonylamino)acetonitrile","Acta Crystallographica Section C","1997","53","7","959","961","10.1107/S0108270197002795","","","1.54178","CuKα","","0.0295","0.0286","","0.0843","0.0831","","","","1.084","1.082","1.082","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006278","14.397","0.008","7.818","0.004","10.506","0.006","90","","99.7","0.03","90","","1165.6","1.1","100","","100","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","ibuprofen","2-(4-Isobutylphenyl)propanoic acid","","- C13 H18 O2 -","- C13 H18 O2 -","- C52 H72 O8 -","4","1","BM1126","Shankland, Norman; Wilson, Chick C.; Florence, Alastair J.; Cox, Philip J.","Refinement of Ibuprofen at 100 K by Single-Crystal Pulsed Neutron Diffraction","Acta Crystallographica Section C","1997","53","","951","954","10.1107/S0108270197003193","","","","","","","0.077","","","0.053","","","","","","","","","","","has coordinates","202021","2020-10-21","18:00:00",""
"2006279","9.186","0.002","22.603","0.006","13.685","0.003","90","","101.6","0.01","90","","2783.4","1.1","143","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(η^6^‒toluene)thallium(I)7,8,9,10,11,12-hexabromo-closo-1-carbaun- decaborate","","- C15 H22 B11 Br6 Tl -","- C15 H22 B11 Br6 Tl -","- C60 H88 B44 Br24 Tl4 -","4","1","BM1128","Mathur, Rajeev S.; Drovetskaya, Tatiana; Reed, Christopher A.","Bis(η^6^-toluene)thallium(I) 7,8,9,10,11,12-Hexabromo-<i>closo</i>-1-carbadodecaborate: a Halocarborane-Bridged Dimer with Heavy Metal‒Arene Interactions","Acta Crystallographica Section C","1997","53","7","881","883","10.1107/S010827019700320X","","","0.71073","MoKα","","0.0741","0.0439","","0.0923","0.082","","","","0.843","1.034","1.034","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006280","15.24","0.002","17.22","0.002","7.8492","0.0008","90.236","0.01","104.33","0.01","79.41","0.01","1960","0.4","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H25 N3 O2 S -","- C21 H25 N3 O2 S -","- C84 H100 N12 O8 S4 -","4","2","BM1130","Helliwell, Madeleine; Zhao, Yuekun; Joule, John A.","An Atypical Conformation of a Toluenesulfonamide","Acta Crystallographica Section C","1997","53","7","884","886","10.1107/S0108270197001492","","","0.7107","MoKα","","0.1037","0.0477","","0.0386","0.0343","","","","1.731","2.024","2.024","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006281","9.616","0.002","10.672","0.002","12.344","0.003","112.87","0.002","100.174","0.003","90.257","0.002","1145.1","0.4","294","","","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H52 Cd N6 Ni2 O10 -","- C44 H52 Cd N6 Ni2 O10 -","- C44 H52 Cd N6 Ni2 O10 -","1","0.5","BM1135","Ülkü, Dinçer; Tahir, M. Nawaz; Atakol, Orhan; Nazir, Hasan","Bis{(μ-acetato)[μ-bis(salicylidene)-1,3-propanediaminato](<i>N</i>,<i>N</i>-dimethylformamide)nickel(II)}cadmium(II)","Acta Crystallographica Section C","1997","53","7","872","874","10.1107/S0108270197002047","","","0.71073","MoKα","","","0.022","","","0.031","","","","","1.16","1.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006282","8.97","0.02","18.89","0.03","8.355","0.008","90","","90","","90","","1416","4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Tetraethyleneneglycol succinate","","- C12 H20 O7 -","- C12 H20 O7 -","- C48 H80 O28 -","4","1","BM1137","Cronin, Leroy; Moore, Madeleine H.; Semlyen, J. Anthony; Wood, Barry R.","A Cyclic Monomer of Tetraethyleneglycol Succinate","Acta Crystallographica Section C","1997","53","7","940","942","10.1107/S0108270197002928","","","0.71069","MoKα","","0.1552","0.0527","","0.3111","0.1395","","","","1.053","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006283","10.838","0.002","18.347","0.004","8.948","0.001","90","","103.34","0.01","90","","1731.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H22 N2 Ni O2 -","- C19 H21 N2 Ni O2 -","- C76 H84 N8 Ni4 O8 -","4","1","BM1142","Kabak, Mehmet; Elmali, Ayhan; Elerman, Yalçın","[<i>N</i>-(2-Hydroxybenzyl)salicylaldiminato](piperidine)nickel(II)","Acta Crystallographica Section C","1997","53","7","868","870","10.1107/S0108270197004174","","","0.71073","MoKα","","0.0497","0.0433","","0.1289","0.1233","","","","0.736","0.759","0.759","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006284","7.389","0.001","16.073","0.003","12.161","0.002","90","","106.1","0.03","90","","1387.6","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(20S)-6β-methoxy-20-(p-toluenesulfonoxymethyl)-3α,5- cyclo-5α-pregnane","","- C30 H44 O4 S -","- C30 H44 O4 S -","- C60 H88 O8 S2 -","2","1","BM1146","Ketuly, Kamal A.; Yufit, Dmitrii S.; Brooks, Charles J.W.; Freer, Andrew A.","(20<i>S</i>)-6β-Methoxy-20-(<i>p</i>-toluenesulfonyloxymethyl)-3α,5-cyclo-5α-pregnane","Acta Crystallographica Section C","1997","53","7","981","982","10.1107/S0108270197003570","","","0.71069","MoKα","","0.0942","0.0395","","0.119","0.0948","","","","1.025","1.071","1.071","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006285","5.335","0.003","7.144","0.004","12.438","0.004","90","","90","","90","","474.1","0.4","298","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Ca2 F Na O4 Si -","- Ca1.92 F Na1.08 O4 Si -","- Ca7.68 F4 Na4.32 O16 Si4 -","4","0.5","BR1103","Andaχ c, Ö.; Glasser, F. P.; Howie, R. A.","Dicalcium Sodium Fluoride Silicate","Acta Crystallographica Section C","1997","53","7","831","833","10.1107/S0108270197000449","","","0.71073","MoKα","","","0.047","","","0.06","","","","","0.81","0.81","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006286","18.4783","0.0005","6.5523","0.0002","8.4268","0.0003","90","","91.132","0.002","90","","1020.08","0.06","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetramethylammonium trivanadius heptaoxide","","- C4 H12 N O7 V3 -","- C4 N O7 V3 -","- C16 N4 O28 V12 -","4","1","BR1166","Zavalij, Peter Y.; Chirayil, Thomas; Whittingham, M. Stanley","Layered Tetramethylammonium Vanadium Oxide [N(CH~3~)~4~]V~3~O~7~ by X-ray Rietveld Refinement","Acta Crystallographica Section C","1997","53","7","879","881","10.1107/S0108270197000474","","","1.54178","CuKα","","","0.078","","0.094","0.094","","","","","","","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006287","6.661","0.001","13.652","0.002","15.613","0.002","90","","94.281","0.002","90","","1415.8","0.3","15","","15","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C10 D8 S8 -","- C10 D8 S8 -","- C40 D32 S32 -","4","1","BR1170","Dianna M. Young; Arthur J. Schultz; Aravinda M. Kini; Jack M. Williams","Isotopically Substituted Bis(ethylenedithio)tetrathiafulvalene at 15K by Time-of-Flight Neutron Diffraction","Acta Crystallographica Section C","1997","53","7","961","963","10.1107/S0108270197003077","","neutron","","Pulsedneutron","","","0.062","","","0.058","","","","","1.2","1.2","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006288","7.0565","0.0007","7.0565","0.0007","25.371","0.004","90","","90","","90","","1263.3","0.3","153","2","153","2","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","","","- Ba3 S7 Zr2 -","- Ba3 S7 Zr2 -","- Ba12 S28 Zr8 -","4","0.25","BR1173","Yi-Chung Hung; James C. Fettinger; Bryan W. Eichhorn","Ba~3~Zr~2~S~7~, the Low-Temperature Polymorph","Acta Crystallographica Section C","1997","53","7","827","829","10.1107/S0108270197003089","","","0.71073","MoKα","","0.0591","0.0366","","0.0937","0.0846","","","","1.027","1.129","1.129","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006289","16.1059","0.0004","11.5721","0.0002","17.6135","0.0003","90","","90","","90","","3282.79","0.11","296","","","","","","","","","","","5","P b c a","","","","","","- C18 H18 Cu N2 O2 -","- C18 H18 Cu N2 O2 -","- C144 H144 Cu8 N16 O16 -","8","1","CF1145","Jem-Mau Lo; Hsueh-Hua Yao; Fen-Ling Liao; Sue-Lein Wang; Tian-Huey Lu","[<i>N</i>,<i>N</i>'-Bis(salicylidene)-1,2-diimino-2-methylpropane]copper(II)","Acta Crystallographica Section C","1997","53","7","848","850","10.1107/S010827019700262X","","","0.71073","MoKα","","","0.0343","","","0.0408","","","","","0.99","0.99","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006290","18.848","0.004","14.692","0.003","7.333","0.002","90","","92.58","0.03","90","","2028.6","0.8","293.2","","293.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 F12 N4 P2 Pt -","- C12 H16 F12 N4 P2 Pt0.5 -","- C48 H64 F48 N16 P8 Pt2 -","4","0.5","CF1148","Kato, Masako; Kosuge, Chizuko; Yano, Shigenobu; Kimura, Masaru","π-Stacking of [Pt(2,2'-bipyridine)(ethylenediamine)]^2+^ as its Hexafluorophosphate Salt","Acta Crystallographica Section C","1997","53","7","838","840","10.1107/S0108270197002618","","","0.71073","MoKα","","","0.0406","","","0.0511","","","","","1.044","1.044","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006291","10.732","0.002","8.945","0.001","10.145","0.001","90","","115.81","0.01","90","","876.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","E-3,5-Dichloro-3,5-bis(chloromethyl)-1,2,4-trioxolane","","- C4 H4 Cl4 O3 -","- C4 H4 Cl4 O3 -","- C16 H16 Cl16 O12 -","4","1","CF1150","Griesbaum, Karl; McCullough, Kevin J.; Perner, Iris; Quinkert, Ralf-Olaf; Rosair, Georgina M.","(<i>E</i>)-3,5-Dichloro-3,5-bis(chloromethyl)-1,2,4-trioxolane","Acta Crystallographica Section C","1997","53","7","911","913","10.1107/S0108270197003661","","","0.71073","MoKα","","0.0487","0.0362","","0.095","0.0873","","","","1.061","1.096","1.096","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006292","13.301","0.002","32.674","0.006","20.381","0.005","90","","91.29","0.02","90","","8855","3","210","0.2","210","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","[N-(2,6-Diisopropylphenyl)imido-N] bis[N-(2,6-Diisopropylphenyl)amido-N] bis(pyridine-N) zirconium","","- C46 H63 N5 Zr -","- C46 H63 N5 Zr -","- C368 H504 N40 Zr8 -","8","2","CF1159","Blake, Alexander J.; Nikonov, Georgii I.; Mountford, Philip","Bis[<i>N</i>-(2,6-diisopropylphenyl)amido][<i>N</i>-(2,6-diisopropylphenyl)imido]bis(pyridine-<i>N</i>)zirconium","Acta Crystallographica Section C","1997","53","7","874","876","10.1107/S0108270197002606","","","0.71073","MoKα","","0.1324","0.0987","","0.1126","0.0981","","","","","1.14","1.14","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006293","10.161","0.002","15.585","0.003","12.519","0.003","90","","103.95","0.02","90","","1924","0.7","298","","298","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,3-diphenyl-2-tricyclo[3.3.1.1^3,7^]dec-2-ylidenepropane-1,3-diimine","","- C25 H26 N2 -","- C25 H26 N2 -","- C100 H104 N8 -","4","1","DE1050","Ching-Fa Yao; Yuh-Shih Chen; Wen-Chang Chen; Ren-Shyang Sheu; Jen-Kou Lai; Chuen-Her Ueng","1,3-Diphenyl-2-tricyclo[3.3.1.1^3,7^]dec-2-ylidenepropane-1,3-diimine, and its -1-imino-3-one and -1,3-dione Derivatives","Acta Crystallographica Section C","1997","53","7","956","959","10.1107/S0108270197002746","","","0.71069","MoKα","","0.069","0.047","","0.042","0.041","","","","","4.03","4.03","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006294","10.196","0.001","15.478","0.001","12.664","0.003","90","","106.36","0.01","90","","1917.6","0.5","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-Diphenyl-2-tricyclo[3,3,1,1^3,7^]dec -2-ylidenepropane-1-imino-3-one","","- C25 H25 N O -","- C25 H25 N O -","- C100 H100 N4 O4 -","4","1","DE1050","Ching-Fa Yao; Yuh-Shih Chen; Wen-Chang Chen; Ren-Shyang Sheu; Jen-Kou Lai; Chuen-Her Ueng","1,3-Diphenyl-2-tricyclo[3.3.1.1^3,7^]dec-2-ylidenepropane-1,3-diimine, and its -1-imino-3-one and -1,3-dione Derivatives","Acta Crystallographica Section C","1997","53","7","956","959","10.1107/S0108270197002746","","","0.71069","MoKα","","0.08","0.043","","0.034","0.033","","","","","2.8","2.8","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006295","15.46","0.007","10.128","0.002","12.68","0.003","90","","101.67","0.02","90","","1944.4","1.1","298","","298","","","","","","","","","3","I 1 2/c 1","-I 2yc","15","","1,3-Diphenyl-2-tricyclo[3,3,1,1^3,7^]dec -2-ylidenepropane-1,3-dione","","- C25 H24 O2 -","- C25 H24 O2 -","- C100 H96 O8 -","4","0.5","DE1050","Ching-Fa Yao; Yuh-Shih Chen; Wen-Chang Chen; Ren-Shyang Sheu; Jen-Kou Lai; Chuen-Her Ueng","1,3-Diphenyl-2-tricyclo[3.3.1.1^3,7^]dec-2-ylidenepropane-1,3-diimine, and its -1-imino-3-one and -1,3-dione Derivatives","Acta Crystallographica Section C","1997","53","7","956","959","10.1107/S0108270197002746","","","0.71069","MoKα","","0.068","0.048","","0.042","0.042","","","","","4.7","4.7","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006296","8.293","0.001","9.589","0.002","22.698","0.004","90","","90","","90","","1805","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6α,7β-dihydroxyvouacapan-17β-oic acid","","- C20 H28 O5 -","- C20 H28 O5 -","- C80 H112 O20 -","4","1","FG1165","Ruggiero, Silvana Guilardi; Rodrigues, Bernardo Lages; Fernandes, Nelson Goncalves; Stefani, Guglielmo Marconi; Veloso, Dorila Pilo","6α,7β-Dihydroxyvouacapan-17β-oic Acid","Acta Crystallographica Section C","1997","53","7","982","984","10.1107/S0108270196014904","","","0.71073","MoKα","","0.075","0.0492","","0.1581","0.1357","","","","1.216","1.215","1.215","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006297","19.239","0.003","10.5","0.002","15.696","0.002","90","","90","","90","","3170.7","0.9","143","2","143","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Cyclotetra[iodo-methylcyclopentadienyl-μ-oxo-titanium (IV)]","","- C24 H28 I4 O4 Ti4 -","- C24 H28 I4 O4 Ti4 -","- C96 H112 I16 O16 Ti16 -","4","1","FG1201","Kienitz, Carsten O.; Thöne, Carsten; Jones, Peter G.","<i>cyclo</i>-Tetrakis(μ-oxo)tetrakis[iodo(η^5^-methylcyclopentadienyl)titanium(IV)]","Acta Crystallographica Section C","1997","53","7","843","845","10.1107/S0108270196007524","","","0.71073","MoKα","","0.1167","0.0766","","0.186","0.1578","","","","1.018","1.046","1.046","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006298","7.638","0.002","10.603","0.003","14.364","0.005","107.63","0.02","94.57","0.02","107.12","0.02","1041.2","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","bis(phenyl)-1-carbamoylguanidinium phenylcarbamidonitrilate","","- C22 H21 N7 O2 -","- C22 H21 N7 O2 -","- C44 H42 N14 O4 -","2","1","FG1255","Frank H. Herbstein; Moshe Kapon; Quin-Chuang Yang","Bis(phenyl)-1-carbamoylguanidinium <i>N</i>-Phenylcarbamidonitrilate. Revision of an Earlier Proposal","Acta Crystallographica Section C","1997","53","7","922","925","10.1107/S0108270197003259","","","0.71073","MoKα","","0.0519","0.0389","","0.1007","0.092","","","","1.062","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006299","17.489","0.01","5.415","0.004","21.805","0.012","90","","95.08","0.02","90","","2057","2","178","2","178","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cis-1-Cyclohexyl-6-methylene-3,5,6,6a-tetrahydro-1H-cyclopenta[c]furan- 4-methyl 3'5'-Dintrobenzoate","","- C22 H24 N2 O7 -","- C22 H24 N2 O7 -","- C88 H96 N8 O28 -","4","1","FG1257","Lautens, Mark; Lough, Alan J.; Ren, Yi","(<i>cis</i>-1-Cyclohexyl-6-methylene-3,5,6,6a-tetrahydro-1<i>H</i>-cyclopenta[<i>c</i>]furan-4-yl)methyl 3,5-Dinitrobenzoate","Acta Crystallographica Section C","1997","53","7","936","938","10.1107/S0108270197000917","","","0.71073","MoKα","","0.216","0.076","","0.1038","0.0832","","","","1.141","1.65","1.65","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006300","6.988","0.001","11.254","0.001","11.48","0.002","90","","102.06","0.01","90","","882.9","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","(+)-4-Androsten-3-one-17β-carboxylic Acid","(+)-3-Oxoandrost-4-ene-17β-carboxylic Acid","","- C20 H28 O3 -","- C20 H28 O3 -","- C40 H56 O6 -","2","1","FG1258","Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","(+)-3-Oxoandrost-4-ene-17β-carboxylic Acid: Catemeric Hydrogen Bonding in a Steroidal Keto Acid","Acta Crystallographica Section C","1997","53","7","903","906","10.1107/S0108270197002515","","","0.71073","MoKα","","0.088","0.053","","0.13","0.113","","","","1.02","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006301","9.994","0.002","4.798","0.002","24.16","0.003","90","","92.94","0.02","90","","1157","0.6","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","benzene-1,3,5-triacetic acid","","","- C12 H12 O6 -","- C12 H12 O6 -","- C48 H48 O24 -","4","1","FG1266","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Interwoven Hydrogen-Bonding Networks in Benzene-1,3,5-triacetic Acid","Acta Crystallographica Section C","1997","53","7","967","969","10.1107/S0108270197002886","","","0.71073","MoKα","","","0.057","","","0.093","","","","","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006302","7.52","0.003","12.03","0.003","13.789","0.005","73.25","0.03","89.47","0.02","89.82","0.02","1194.5","0.7","143","2","143","2","","","","","","","","6","P -1","-P 1","2","","Heptaaquacalcium 1,2-Benzenedisulfonimide","","- C12 H22 Ca N2 O15 S4 -","- C12 H22 Ca N2 O15 S4 -","- C24 H44 Ca2 N4 O30 S8 -","2","1","FG1272","Moers, Oliver; Blaschette, Armand; Jones, Peter G.","Polysulfonylamines. LXXXIII. Heptaaquacalcium 1,2-Benzenedisulfonimide","Acta Crystallographica Section C","1997","53","7","845","848","10.1107/S0108270197002102","","","0.71073","MoKα","","0.0612","0.0424","","0.1068","0.0928","","","","1.045","1.048","1.048","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006303","19.515","0.003","5.8352","0.0009","22.854","0.003","90","","90.669","0.009","90","","2602.3","0.7","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Spiro[3-carboxy-1',3'-dihydro-2-methyl-6-oxo-2-cyclohexene-1,2'-[2H]indene]","","- C16 H16 O3 -","- C16 H16 O3 -","- C128 H128 O24 -","8","1","FG1273","Lalancette, Roger A.; Thompson, Hugh W.; Coté, Marie L.","Hydrogen-Bonding Pattern of an α,β-Unsaturated δ-Keto Acid: 1',3'-Dihydro-2-methyl-6-oxospiro[2-cyclohexene-1,2'-2'<i>H</i>-indene]-3-carboxylic Acid","Acta Crystallographica Section C","1997","53","7","901","903","10.1107/S0108270197003260","","","0.71073","MoKα","","0.092","0.0555","","0.148","0.1328","","","","0.904","1.069","1.069","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006304","13.943","0.002","8.0371","0.0007","14.374","0.001","90","","108.03","0.01","90","","1531.7","0.3","293","2","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C17 H22 O4 -","- C17 H22 O4 -","- C68 H88 O16 -","4","1","FG1275","Zukerman-Schpector, J.; Caracelli, I.; Malvestiti, Ivani; Cass, Quezia B.; Battiste, Merle A.","Intermediates in the Synthesis of Forskolin. I","Acta Crystallographica Section C","1997","53","7","969","971","10.1107/S0108270197002965","","","0.71073","MoKα","","0.0797","0.046","","0.14","0.1113","","","","1.083","1.065","1.065","","","","","has coordinates","191053","2020-10-21","18:00:00",""
"2006305","19.578","0.005","14.508","0.003","7.979","0.002","90","","106.21","0.02","90","","2176.2","0.9","178","2","178","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","1,2,3,4,5,6-hexakispropylidene-cyclohexane","","- C24 H36 -","- C24 H36 -","- C96 H144 -","4","0.5","FG1289","Jones, Peter G.; Bubenitschek, Peter; Höpfner, Thomas; Hopf, Henning","All-<i>E</i>-7,8,9,10,11,12-hexaethyl[6]radialene","Acta Crystallographica Section C","1997","53","7","920","921","10.1107/S0108270197003582","","","0.71073","MoKα","","0.1408","0.0635","","0.2205","0.1576","","","","1.008","0.996","0.996","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006306","12.614","0.004","6.607","0.002","12.921","0.004","90","","94.59","0.03","90","","1073.4","0.6","143","2","143","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3,4-Diido-2,5-dimethylhexa-2,4-diene","","- C8 H12 I2 -","- C8 H12 I2 -","- C32 H48 I8 -","4","0.5","FG1291","Jones, Peter G.; Bubenitschek, Peter; Höpfner, Thomas; Hopf, Henning","3,4-Diiodo-2,5-dimethylhexa-2,4-diene","Acta Crystallographica Section C","1997","53","7","918","920","10.1107/S0108270197003594","","","0.71073","MoKα","","0.0228","0.0215","","0.0552","0.054","","","","1.109","1.109","1.109","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006307","27.001","0.002","27.001","0.002","21.525","0.004","90","","90","","120","","13590","3","173","","173","","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C26 H36 I N2 Nd Si2 -","- C26 H36 I N2 Nd Si2 -","- C468 H648 I18 N36 Nd18 Si36 -","18","0.5","FR1006","Clark, David L.; Gordon, John C.; Scott, Brian L.; Watkin, John G.","Iodobis(pyridine-<i>N</i>)bis(η^5^-trimethylsilylcyclopentadienyl)neodymium","Acta Crystallographica Section C","1997","53","7","850","852","10.1107/S0108270196014552","","","0.71073","MoKα","","0.0254","0.0197","","0.043","0.0413","","","","1.058","1.081","1.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006308","8.101","0.002","10.321","0.002","11.145","0.002","65.96","0.03","72.4","0.03","65.93","0.03","766.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H15 Cl O3 -","- C17 H15 Cl O3 -","- C34 H30 Cl2 O6 -","2","1","FR1013","Aygün, Muhi̇tti̇n; Işik, Şami̇l; Şaşmaz, Selami̇; Tahi̇r, M. Nawaz; Erdönmez, Ahmet; Büyükgüngör, Orhan","1-(4-Chlorobenzoyloxy)-2-methoxy-4-(2-propenyl)benzene","Acta Crystallographica Section C","1997","53","7","897","899","10.1107/S0108270197000553","","","0.7107","MoKα","","0.0736","0.0658","","0.1883","0.1785","","","","1.084","1.13","1.13","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006309","10.033","0.009","20.54","0.018","15.464","0.017","90","","94.14","0.07","90","","3178","5","294","1","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-Bis(tributylphosphine-1κP)-tetra(benzyl-1κC)-octa- μ3-chloro-octahedro-hexamolybdenum(12 Mo-Mo)","","- C52 H82 Cl8 Mo6 P2 -","- C52 H82 Cl8 Mo6 P2 -","- C104 H164 Cl16 Mo12 P4 -","2","0.5","FR1022","Yamagata, Tsuneaki; Okiyama, Hiroshi; Imoto, Hideo; Saito, Taro","<i>trans</i>-[(Mo~6~Cl~8~)(C~7~H~7~)~4~{P(<i>n</i>-C~4~H~9~)~3~}~2~] and <i>trans</i>-[(Mo~6~Cl~8~)(C~8~H~5~)~4~{P(<i>n</i>-C~5~H~11~)~3~}~2~].2C~7~H~8~","Acta Crystallographica Section C","1997","53","7","859","862","10.1107/S0108270197002266","","","0.71069","Mo_Kα","","","0.062","","","0.0452","","","","","1.111","1.111","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006310","25.241","0.006","10.962","0.001","15.18","0.002","90","","98.78","0.02","90","","4151","1.2","294","1","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C76 H102 Cl8 Mo6 P2 -","- C76 H102 Cl8 Mo6 P2 -","- C152 H204 Cl16 Mo12 P4 -","2","0.5","FR1022","Yamagata, Tsuneaki; Okiyama, Hiroshi; Imoto, Hideo; Saito, Taro","<i>trans</i>-[(Mo~6~Cl~8~)(C~7~H~7~)~4~{P(<i>n</i>-C~4~H~9~)~3~}~2~] and <i>trans</i>-[(Mo~6~Cl~8~)(C~8~H~5~)~4~{P(<i>n</i>-C~5~H~11~)~3~}~2~].2C~7~H~8~","Acta Crystallographica Section C","1997","53","7","859","862","10.1107/S0108270197002266","","","0.71069","Mo_Kα","","","0.057","","","0.0451","","","","","1.205","1.205","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006311","8.567","0.002","12.189","0.002","12.557","0.003","90","","98.05","0.03","90","","1298.3","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","trans,cis,cis,cis-[5,5,5,5]fenestrane","rel-(4S,6R,9S,11S)-1-hydroxy-16-methyl-14-oxapentacyclo- [7.4.3.0^4,15^.0^11,15^.0^6,16^]hexadeca-7-ene","","- C16 H22 O2 -","- C16 H22 O2 -","- C64 H88 O8 -","4","1","FR1026","Wender, Paul A.; deLong, Mitch A.; Wireko, Fred C.","Novel Oxidative Rearrangement Product of the First <i>trans</i>,<i>cis</i>,<i>cis</i>,<i>cis</i>-[5.5.5.5]Fenestrane Derivative","Acta Crystallographica Section C","1997","53","7","954","956","10.1107/S0108270197002278","","","1.54059","CopperKα","","0.0504","0.0469","","0.1257","0.1226","","","","1.08","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006312","10.028","0.006","13.118","0.007","7.321","0.005","90","","107.33","0.04","90","","919.3","1","296","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 Mn N2 O6 -","- C20 H16 Mn N2 O6 -","- C40 H32 Mn2 N4 O12 -","2","0.5","FR1028","Okabe, Nobuo; Koizumi, Makiko","Diaquabis(2-quinolinecarboxylato-<i>N</i>,<i>O</i>)manganese(II)","Acta Crystallographica Section C","1997","53","7","852","854","10.1107/S0108270197002801","","","0.71069","MoKα","","","0.035","","","0.043","","","","","1.67","1.67","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006313","21.574","0.001","4.5576","0.0009","17.039","0.002","90","","104.238","0.005","90","","1623.9","0.4","293","","293","","","","","","","","","4","C 1 2 1","C 2y","5","","Methyl 2-aza-2-deoxy-4,6-di-O-methyl-2-N-(p-nitrophenylamino)-β-D-erythro- hexopyranosid-3-ulose.","","- C14 H19 N3 O7 -","- C14 H19 N3 O7 -","- C56 H76 N12 O28 -","4","1","HA1186","Bernardinelli, Gérald; Tronchet, Jeannine F.; Tronchet, Jean M.J.","Methyl 2-Aza-2-deoxy-4,6-di-<i>O</i>-methyl-2-<i>N</i>-(<i>p</i>-nitrophenylamino)-β-<small>D</small>-<i>erythro</i>-hexopyranosid-3-ulose","Acta Crystallographica Section C","1997","53","7","950","951","10.1107/S0108270197002345","","","1.5418","CuKα","","0.12","0.076","","0.083","0.074","","","","2.172","2.342","2.342","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006314","7.956","0.001","8.456","0.003","24.587","0.004","90","","96.15","0.02","90","","1644.6","0.7","298.2","","298.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 Cl N3 O2 -","- C18 H14 Cl N3 O2 -","- C72 H56 Cl4 N12 O8 -","4","1","HA1188","Daniel E. Bacelo; Osvaldo Cox; Luis A. Rivera; Marisol Cordero; Songping D. Huang","(<i>E</i>,<i>Z</i>)-2-(2-Chloro-5-nitrostyryl)-1-(1-propenyl)benzimidazole","Acta Crystallographica Section C","1997","53","7","907","909","10.1107/S0108270197004071","","","0.7107","MoKα","","","0.0538","","","0.0731","","","","","1.626","1.626","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006315","14.025","0.002","14.025","0.002","14.025","0.002","90","","90","","90","","2758.7","0.7","293","","293","","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","","","- Be4 N6 O19 -","- Be4 N6 O19 -","- Be32 N48 O152 -","8","0.333333","JZ1166","Haley, Martin J.; Wallwork, Stephen C.; Duffin, Bryan; Logan, Norman; Addison, C. Clifford","Hexa-μ-nitrato-μ~4~-oxo-tetraberyllium","Acta Crystallographica Section C","1997","53","7","829","830","10.1107/S010827019700303X","","","1.54184","CuKα","","","0.047","","","0.025","","","","","1.076","1.076","","","","","has coordinates","207077","2020-10-21","18:00:00",""
"2006316","7.254","0.004","11.914","0.002","14.953","0.002","90","","100.34","0.03","90","","1271.3","0.8","295.2","","295.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H14 Cl N3 O3 -","- C11 H14 Cl N3 O3 -","- C44 H56 Cl4 N12 O12 -","4","1","JZ1177","Chunqiu P. Lai; Liu Bo; Songping D. Huang","4-Amino-2-chloro-6,7-dimethoxyquinazoline Methanol Solvate","Acta Crystallographica Section C","1997","53","7","906","907","10.1107/S0108270197001236","","","0.7107","MoKα","","","0.0416","","","0.0546","","","","","1.484","1.484","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006317","9.933","0.002","17.111","0.003","12.076","0.002","90","","108.21","0.02","90","","1949.7","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","μ-bromo-μ-cyclohexylphosphido-bis(tetracarbonylmanganese)","","- C14 H12 Br Mn2 O8 P -","- C14 H12 Br Mn2 O8 P -","- C56 H48 Br4 Mn8 O32 P4 -","4","1","KA1213","Flörke, Ulrich; Haupt, Hans-Jürgen","μ-Bromo-μ-cyclohexylphosphido-bis(tetracarbonylmanganese) and μ-Bromo-μ-(pentacarbonylmanganese)phosphido-bis(tetracarbonylmanganese)","Acta Crystallographica Section C","1997","53","7","876","879","10.1107/S0108270197000735","","","0.71073","MoKα","","0.1277","0.0448","","0.0994","0.0723","","","","1.032","1.069","1.069","","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2006318","8.735","0.002","8.953","0.001","13.837","0.004","81.57","0.02","84.59","0.02","74.68","0.02","1030.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","μ-bromo-μ-(pentacarbonylmanganese)phosphido-bis(tetracarbonylmanganese)","","- C13 H Br Mn3 O13 P -","- C13 H Br Mn3 O13 P -","- C26 H2 Br2 Mn6 O26 P2 -","2","1","KA1213","Flörke, Ulrich; Haupt, Hans-Jürgen","μ-Bromo-μ-cyclohexylphosphido-bis(tetracarbonylmanganese) and μ-Bromo-μ-(pentacarbonylmanganese)phosphido-bis(tetracarbonylmanganese)","Acta Crystallographica Section C","1997","53","7","876","879","10.1107/S0108270197000735","","","0.71073","MoKα","","0.0616","0.0398","","0.0951","0.0861","","","","1.018","1.067","1.067","","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2006319","10.579","0.001","18.1356","0.0009","17.507","0.002","90","","106.044","0.006","90","","3228","0.5","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis(dicyclohexylammonium) 2,6-pyridinedicarboxylate dihydrate","","- C31 H55 N3 O6 -","- C31 H55 N3 O6 -","- C124 H220 N12 O24 -","4","1","KH1129","Ng, Seik Weng","Bis(dicyclohexylammonium) 2,6-Pyridinedicarboxylate Dihydrate","Acta Crystallographica Section C","1997","53","7","986","987","10.1107/S010827019700293X","","","0.71073","MoKα","","0.1082","0.0672","","0.1953","0.1748","","","","1.107","1.317","1.317","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006320","7.929","0.001","11.001","0.002","12.436","0.002","75.54","0.01","83.54","0.01","89.78","0.01","1043.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H21 N O6 S -","- C23 H21 N O6 S -","- C46 H42 N2 O12 S2 -","2","1","KH1141","Lakshmanan Govindasamy; Velmurugan, D.; Ravikumar, K.; Mohanakrishnan, A.K.","Ethyl 4,6-Dimethoxy-9-phenylsulfonylcarbazole-3-carboxylate","Acta Crystallographica Section C","1997","53","7","929","931","10.1107/S010827019700351X","","","0.71073","MoKα","","0.046","0.0383","","0.128","0.111","","","","0.626","0.598","0.598","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006321","26.162","0.007","26.162","0.007","13.633","0.005","90","","90","","120","","8081","4","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","tetrakis(μ-benzoato-O:O')-bis(urea-O')dicopper(II),","","- C30 H28 Cu2 N4 O10 -","- C30 H28 Cu2 N4 O10 -","- C270 H252 Cu18 N36 O90 -","9","0.5","MU1294","Leban, Ivan; Grgurevič, Nikolaj; Sieler, Joachim; Šegedin, Primož","Tetrakis(μ-benzoato-<i>O</i>:<i>O</i>')bis(urea)-1κ<i>O</i>,2κ<i>O</i>-dicopper(II)","Acta Crystallographica Section C","1997","53","7","854","856","10.1107/S0108270197003387","","","0.71073","MoKα","","0.1588","0.0621","","0.2588","0.1985","","","","0.99","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006322","9.673","0.008","11.935","0.009","11.478","0.008","90","","105.22","","90","","1278.6","1.7","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C23 H29 Cl3 Mo N2 O4 -","- C23 H28 Cl3 Mo N2 O4 -","- C46 H56 Cl6 Mo2 N4 O8 -","2","1","MU1300","Elias, Horst; Stock, Frank; Röhr, Caroline","A Dioxomolybdenum(VI) Complex with a New Enantiomerically Pure Tetrahydrosalen Ligand","Acta Crystallographica Section C","1997","53","7","862","864","10.1107/S0108270197003375","","","0.7107","MoKα","","0.0391","0.0389","","0.1014","0.101","","","","1.066","1.068","1.068","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006323","15.0089","0.0014","16.952","0.002","22.124","0.002","90","","96.172","0.006","90","","5596.4","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6,7-dihydro-8-(4-methyl-1-piperazinyl)[1]benzoxepino[4,5-c]quinoline","","- C22 H23.26 N3 O1.13 -","- C22 H23.2867 N3 O1.14333 -","- C264 H279.44 N36 O13.72 -","12","3","NA1266","Giorgi, Gianluca; Cappelli, Andrea; Anzini, Maurizio; Vomero, Salvatore; Marchetti, Fabio","Characterization of Quinoline Derivatives. I. 6,7-Dihydro-8-(4-methyl-1-piperazinyl)[1]benzoxepino[4,5-<i>c</i>]quinoline 0.13-Hydrate","Acta Crystallographica Section C","1997","53","7","987","990","10.1107/S0108270196014564","","","0.71073","MoKα","","0.1875","0.0694","","0.1628","0.1143","","","","0.934","1.212","1.212","","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2006324","11.52","0.001","4.7","0.001","12.04","0.001","90","","95.44","0.01","90","","648.96","0.16","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C13 H24 N2 O -","- C13 H24 N2 O -","- C26 H48 N4 O2 -","2","0.5","NA1270","Govindasamy, L.; Subramanian, E.","<i>N</i>,<i>N</i>'-Dicyclohexylurea","Acta Crystallographica Section C","1997","53","7","927","928","10.1107/S0108270197003399","","","1.5418","CuKα","","0.123","0.0646","","0.1807","0.161","","","","0.93","1.127","1.127","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006325","10.956","0.001","14.626","0.001","7.606","0.001","93.66","0.01","92.06","0.01","92.59","0.01","1214.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H22 N2 O6 S2 -","- C26 H22 N2 O6 S2 -","- C52 H44 N4 O12 S4 -","2","1","NA1278","Subramanian, E.; Govindasamy, L.; Ravichandran, K.","<i>trans</i>-Methyl 2,9-Bis(phenylsulfonyl)-1,2,3,4-tetrahydro-4-β-carbolinylideneacetate","Acta Crystallographica Section C","1997","53","7","925","927","10.1107/S010827019700228X","","","0.71069","MoKα","","0.0798","0.0435","","0.1657","0.1037","","","","1.074","0.833","0.833","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006326","9.826","0.002","17.899","0.004","10.307","0.002","90","","115.56","0.03","90","","1635.3","0.7","291","1","291","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,7-Bis[4'-chlorophenyl]-3,8-dihydro-1,2,5,6-dithiadiazocine","","- C16 H12 Cl2 N2 S2 -","- C16 H12 Cl2 N2 S2 -","- C64 H48 Cl8 N8 S8 -","4","1","NA1282","Beate M. Rymarczyk; Hans Preut; Richard P. Kreher","An Eight-Membered N,N,S,S-Heterocyclic Compound: 4,7-Bis(4-chlorophenyl)-3,8-dihydro-1,2,5,6-dithiadiazocine","Acta Crystallographica Section C","1997","53","7","931","933","10.1107/S0108270197002588","","","0.71069","MoKα","","0.0908","0.0629","","0.177","0.1637","","","","0.988","1.166","1.166","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006327","8.8496","0.0013","14.8198","0.0019","8.3661","0.0014","90","","92.221","0.005","90","","1096.4","0.3","295","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H22 Cl6 O2 -","- C18 H22 Cl6 O2 -","- C36 H44 Cl12 O4 -","2","1","NA1283","Ülkü, Dinçer; Tahir, M. Nawaz; Demir, Ayhan S.; Akhmedov, Idris, M.; Tanyeli, Cihangir","Configuration of the Diels‒Alder Adduct of Hexachlorocyclopentadiene with <small>L</small>-Menthyl Acrylate","Acta Crystallographica Section C","1997","53","7","899","901","10.1107/S0108270197003533","","","0.71069","MoKα","","","0.049","","","0.056","","","","","1.18","1.18","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006328","9.672","0.003","9.672","0.003","9.834","0.003","90","","90","","120","","796.7","0.4","298","","298","","","","","","","","","5","P -3","-P 3","147","manganese fluorosilicate hexahydrate","manganese hexafluorosilicate-water (1/6)","","- F6 H12 Mn O6 Si -","- F6 H12 Mn O6 Si -","- F18 H36 Mn3 O18 Si3 -","3","0.5","OH1098","Torii, Akira; Ogawa, Kazuhide; Tamura, Hatsue; Osaki, Kenji","Room-Temperature Form of Manganese Hexafluorosilicate Hexahydrate: a New Model with Submicroscopic Twinning","Acta Crystallographica Section C","1997","53","7","833","836","10.1107/S0108270196015454","","","1.5418","CuKα","","","0.04","","","0.04","","","","","1.39","1.39","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006329","5.7009","0.0008","10.509","0.002","9.42","0.002","123.78","0.01","102.66","0.01","94.08","0.01","444.53","0.16","293","","293","","","","","","","","","2","P -1","-P 1","2","","","","- C18 F16 -","- C18 F16 -","- C18 F16 -","1","0.5","PA1195","Swenson, Dale C.; Morken, Peter A.; Burton, Donald J.","Three <i>trans</i>-Diphenylperfluorotrienes","Acta Crystallographica Section C","1997","53","7","946","950","10.1107/S0108270197000504","","","0.71073","MoKα","","0","0.053","","","0.061","","","","","1.031","1.031","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006330","5.899","0.0007","9.509","0.001","9.304","0.001","102.75","0.01","94.62","0.01","115.92","0.01","448.4","0.1","293","","293","","","","","","","","","3","P -1","-P 1","2","","","","- C20 H10 F10 -","- C20 H10 F10 -","- C20 H10 F10 -","1","0.5","PA1195","Swenson, Dale C.; Morken, Peter A.; Burton, Donald J.","Three <i>trans</i>-Diphenylperfluorotrienes","Acta Crystallographica Section C","1997","53","7","946","950","10.1107/S0108270197000504","","","1.54184","CuKα","","0","0.042","","","0.067","","","","","1.194","1.194","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006331","10.2071","","17.6882","","5.9376","","90","","97.52","","90","","1062.79","","291","","291","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H10 F14 -","- C22 H10 F14 -","- C44 H20 F28 -","2","0.5","PA1195","Swenson, Dale C.; Morken, Peter A.; Burton, Donald J.","Three <i>trans</i>-Diphenylperfluorotrienes","Acta Crystallographica Section C","1997","53","7","946","950","10.1107/S0108270197000504","","","0.71073","MoKα","","0","0.052","","","0.065","","","","","1.057","1.057","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006332","14.156","0.001","19.536","0.003","9.2244","0.0004","90","","105.01","0.003","90","","2464","0.4","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","di-μ-bromo-bis{[(2,4,6-tris-tert-butylphenyl)phosphanediylmethyl-P]phenyl)- dipalladium","","- C50 H68 Br2 P2 Pd2 -","- C50 H68 Br2 P2 Pd2 -","- C100 H136 Br4 P4 Pd4 -","2","0.5","PA1251","Chentit, Mostafa; Geoffroy, Michel; Bernardinelli, Gérald","Di-μ-bromo-bis{[(2,4,6-tris-<i>tert</i>-butylphenyl)phosphanediylmethyl-<i>P</i>]phenyl-<i>C</i>^2^}dipalladium","Acta Crystallographica Section C","1997","53","7","866","868","10.1107/S0108270197003235","","","1.54183","CuKα","","0.055","0.043","","0.035","0.034","","","","2.228","2.399","2.399","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006333","11.379","0.002","21.004","0.004","15.488","0.003","90","","94.26","0.03","90","","3691.5","1.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis bistriphenylphosphineimine dodecasulfurdiirion","","- C72 H60 Fe2 N2 P4 S12 -","- C72 H60 Fe2 N2 P4 S12 -","- C144 H120 Fe4 N4 P8 S24 -","2","0.5","QB0004","van Hal, Jaap W.; Whitmire, Kenton H.","Bis[bis(triphenylphosphine)iminium] Di-μ-thio-bis[(pentasulfido)ferrate(III)]","Acta Crystallographica Section C","1997","53","7","IUC9700008","","10.1107/S0108270197099484","","","0.71073","MoKα","","0.0701","0.0398","","0.1176","0.0946","","","","1.037","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006334","7.318","0.0015","5.673","0.0011","9.989","0.002","90","","110.79","0.03","90","","387.69","0.15","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","oxazolidinone","2-oxazolidinone","","- C3 H5 N O2 -","- C3 H5 N O2 -","- C12 H20 N4 O8 -","4","1","SK1055","Wouters, Johan; Ooms, Frederic; Durant, Francois","2-Oxazolidinone","Acta Crystallographica Section C","1997","53","7","895","897","10.1107/S0108270197003752","","","1.54178","CuKα","","0.0395","0.039","","0.1","0.0995","","","","1.12","1.134","1.134","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006335","11.735","0.001","9.683","0.001","11.985","0.001","90","","118.87","0.01","90","","1192.6","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S)-cis-1-benzyloxycarbonyl-(5R)-(2S-hydroxyphenylethyl)-proline tert-butyl ester","","- C25 H31 N O5 -","- C25 H31 N O5 -","- C50 H62 N2 O10 -","2","1","SK1080","Soave, Raffaella; Roversi, Pietro; Destro, Riccardo","Two 1,5-Disubstituted Proline Esters","Acta Crystallographica Section C","1997","53","7","933","936","10.1107/S0108270197001248","","","0.71073","MoKa","","0.0354","0.0299","","0.0827","0.0802","","","","1.018","1.067","1.067","","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"2006336","11.456","0.001","9.708","0.001","12.024","0.001","90","","116.79","0.01","90","","1193.7","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S)-cis-1-benzyloxycarbonyl-(5R)-(2R-hydroxyphenylethyl)-proline tert-butyl ester.","","- C25 H31 N O5 -","- C25 H31 N O5 -","- C50 H62 N2 O10 -","2","1","SK1080","Soave, Raffaella; Roversi, Pietro; Destro, Riccardo","Two 1,5-Disubstituted Proline Esters","Acta Crystallographica Section C","1997","53","7","933","936","10.1107/S0108270197001248","","","0.71073","MoKa","","0.0487","0.031","","0.0676","0.0633","","","","0.891","0.992","0.992","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006337","5.946","0.002","16.441","0.004","9.582","0.002","90","","100.14","0.02","90","","922.1","0.4","292","","292","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(2-pyridinium)urea perchlorate","","- C6 H8 Cl N3 O5 -","- C6 H8 Cl N3 O5 -","- C24 H32 Cl4 N12 O20 -","4","1","SK1081","Velichka Velikova; Olyana Angelova; Rosica Petrova; Krasimir Kossev","<i>N</i>-(2-Pyridinium)urea Perchlorate","Acta Crystallographica Section C","1997","53","7","971","973","10.1107/S0108270197003156","","","0.71073","MoKα","","0.0638","0.0363","","0.0824","0.0737","","","","0.948","1.042","1.042","","","","","has coordinates","190725","2020-10-21","18:00:00",""
"2006338","12.041","0.002","10.731","0.002","13.011","0.002","90","","106.49","0.02","90","","1612","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3β,4β-Epoxy-5β-androstan-17-one'","","- C19 H28 O2 -","- C19 H28 O2 -","- C76 H112 O8 -","4","2","SK1084","Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J.; Tavares da Silva, E. J.; Sá e Melo, M. L.; Campos Neves, A. S.","3β,4β-Epoxy-5β-androstan-17-one","Acta Crystallographica Section C","1997","53","7","938","940","10.1107/S0108270197002138","","","0.71073","MoKα","","0.0708","0.0383","","0.0958","0.0872","","","","1.027","1.087","1.087","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006339","4.7378","0.0003","7.5284","0.0006","13.1036","0.0011","87.836","0.007","86.108","0.006","77.183","0.006","454.56","0.06","130","2","130","2","","","","","","","","4","P 1","P 1","1","lactosylurea","4-O-beta-D-galactopyranosyl-D-glucopyranosyl urea","","- C13 H28 N2 O13 -","- C13 H28 N2 O13 -","- C13 H28 N2 O13 -","1","1","SX1015","Marilyn M. Olmstead; Ming Hu; Mark J. Kurth; John M. Krochta; You-Lo Hsieh","Lactosylurea Dihydrate","Acta Crystallographica Section C","1997","53","7","915","916","10.1107/S0108270197002849","","","1.54178","CuKα","","0.0275","0.0271","","0.0694","0.0689","","","","1.072","1.072","1.072","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006340","14.58","0.002","18.5345","0.001","6.4477","0.0001","90","","90","","90","","1742.4","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(5,2'-dithien-2-yl)-2'-deoxyuridine","","- C17 H16 N2 O5 S2 -","- C17 H16 N2 O5 S2 -","- C68 H64 N8 O20 S8 -","4","1","SX1017","Wouters, J.; Creuven, I.; Norberg, B.; Evrard, G.; Durant, F.; van Aerschot, A.; Herdewijn, P.","<i>trans</i>- and <i>cis</i>-S—C—C—S Conformations in 5-(2,2'-Dithien-5-yl)-2'-deoxyuridine","Acta Crystallographica Section C","1997","53","7","892","895","10.1107/S0108270197002813","","","1.5418","CuKα","","0.048","0.0461","","0.116","0.1135","","","","1.065","1.077","1.077","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006341","8.698","0.003","5.819","0.003","10.032","0.003","90","","107.48","0.03","90","","484.3","0.3","150","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(+)-α-methyl-4-carboxyphenylglycine","","- C10 H11 N O4 -","- C10 H11 N O4 -","- C20 H22 N2 O8 -","2","1","SX1018","Wilson, Claire; Howard, Judith A. K.; Jane, David E.; Sunter, David C.; Watkins, Jeffrey C.","Absolute Configuration of (+)-α-Methyl-4-carboxyphenylglycine (MCPG), a Metabotropic Glutamate Receptor Antagonist","Acta Crystallographica Section C","1997","53","7","909","911","10.1107/S0108270197003223","","","1.54178","CuKα","","0.0502","0.0346","","0.1397","0.0881","","","","1.065","1.001","1.001","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006342","8.9803","0.0008","16.3083","0.001","9.2752","0.0007","90","","93.541","0.007","90","","1355.79","0.18","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(6Z,8Z)-2,4,6-Trimethyl-8-phenyl-7-oxa-2,4-diazabicyclo[4.2.0]octane-3,5-dione","","- C14 H16 N2 O3 -","- C14 H16 N2 O3 -","- C56 H64 N8 O12 -","4","1","SX1020","Prakash, Gautam; Fettinger, James C.; Falvey, Daniel E.","(6<i>Z</i>,8<i>Z</i>)-2,4,6-Trimethyl-8-phenyl-7-oxa-2,4-diazabicyclo[4.2.0]octane-3,5-dione","Acta Crystallographica Section C","1997","53","7","979","981","10.1107/S0108270197002850","","","0.71073","MoKα","","0.0597","0.0422","","0.1083","0.0967","","","","1.038","1.066","1.066","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006343","13.133","0.004","18.932","0.006","14.646","0.009","90","","95.7","0.03","90","","3623","3","298","","298","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C20 H38 Mo5 N4 O23 P2 -","- C20 H34 Mo5 N4 O23 P2 -","- C80 H136 Mo20 N16 O92 P8 -","4","1","TA1124","Harrison, William T. A.; Dussack, Laurie L.; Jacobson, Allan J.","Bis(piperazinium) Pentakis(trioxomolybdo)bis(phenylphosphonate) Dihydrate","Acta Crystallographica Section C","1997","53","7","856","859","10.1107/S0108270197002989","","","0.71073","MoKα","","0.022","0.022","","0.035","0.035","","","","","1.84","1.84","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006344","13.214","0.003","16.145","0.002","44.872","0.002","90","","91.039","0.009","90","","9571","3","213","1","213","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C92 H162 Co2 N4 O9 -","- C92 H162 Co2 N4 O9 -","- C368 H648 Co8 N16 O36 -","4","0.5","TA1127","Robert W. Corkery; David C.R. Hockless","A Water-Bridged Dinuclear Complex of Cobalt(II), Pyridine and Stearic Acid","Acta Crystallographica Section C","1997","53","7","840","843","10.1107/S010827019700259X","","","1.5418","CuKα","","","0.051","","","0.0607","","","","","2.306","2.306","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2006345","7.5893","0.0004","7.9361","0.0005","12.793","0.0007","104.427","0.004","95.662","0.004","90.264","0.004","742.24","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Strontiumnitratoacetate-Hemitrihydrate","","","- C2 H6 N O6.5 Sr -","- C2 H6 N O6.5 Sr -","- C8 H24 N4 O26 Sr4 -","4","2","TA1134","Lengauer, Christian L.; Giester, Gerald","Strontium Acetate Nitrate Trihydrate, [Sr~2~(CH~3~COO)~2~(NO~3~)~2~(H~2~O)~3~]","Acta Crystallographica Section C","1997","53","7","870","872","10.1107/S0108270197002990","","","0.71073","MoKα","","0.0484","0.0274","","0.061","0.0563","","","","1.043","1.113","1.113","","","","","has coordinates","223448","2020-10-21","18:00:00",""
"2006346","14.674","0.006","16.365","0.008","15.233","0.006","90","","111.39","0.03","90","","3406","3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H23 Cl2 N Ru -","- C17 H23 Cl2 N Ru -","- C136 H184 Cl16 N8 Ru8 -","8","2","TA1142","Andrew J. Steedman; Anthony K. Burrell","Dichloro(η^6^-hexamethylbenzene)(pyridine-<i>N</i>)ruthenium","Acta Crystallographica Section C","1997","53","7","864","866","10.1107/S0108270197003004","","","0.71073","MoKα","","0.0631","0.0327","","0.0949","0.0832","","","","1.049","1.086","1.086","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006347","14.074","0.002","15.738","0.002","13.588","0.002","96.82","0.01","100.61","0.01","74.63","0.01","2844.7","0.7","294","","294","","","","","","","","","5","P -1","-P 1","2","","(4RS,1'RS)-methyl 1-phenyl-2-piperidinoethyl 1,4-dihydro-2,6-dimethyl-4-(2- thienyl)pyridine-3,5-dicarboxylate methanol solvate","","- C28.5 H38 N2 O5.5 S -","- C27.5 H27 Hc9 Hn N2 O5.5 S2 -","- C110 H108 Hc36 Hn4 N8 O22 S8 -","4","2","VJ1043","Marubayashi, Nobuhiro; Mishina, Tadashi; Hamasaki, Toshio; Hirayama, Noriaki","(4<i>RS</i>,1'<i>RS</i>)-Methyl 1-Phenyl-2-piperidinoethyl 1,4-Dihydro-2,6-dimethyl-4-(2-thienyl)pyridine-3,5-dicarboxylate Methanol Solvate, C~27~H~32~N~2~O~4~S.1.5CH~4~O","Acta Crystallographica Section C","1997","53","7","913","915","10.1107/S0108270197000528","","","1.54184","Cu-Kα","","0.056","0.049","","","0.07","","","","","1.884","1.884","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2006348","5.911","0.004","7.474","0.003","16.366","0.003","100.55","0.03","91.9","0.03","91.62","0.04","710","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-[2-(napthylenyl)]-3-(4-chlorophenyl)-2-propen-1-one","","- C19 H13 Cl O -","- C19 H13 Cl O -","- C38 H26 Cl2 O2 -","2","1","VJ1049","S.Shanmuga Sundara Raj; M.N.Ponnuswamy; G.Shanmugam; S.Nanjundan","3-(4-Chlorophenyl)-1-(2-naphthyl)prop-2-enone","Acta Crystallographica Section C","1997","53","7","917","918","10.1107/S0108270197000668","","","1.5418","CuKα","","0.0619","0.0563","","0.173","0.1652","","","","1.066","1.108","1.108","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006349","10.055","0.003","22.575","0.004","18.227","0.005","90","","99.359","0.012","90","","4082.3","1.8","291","1","291","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Triphenylsilyl(thiophenyl-2)triphenylphosphonium perrhenate dichloromethane solvate","","- C43 H36 Cl2 O4 P Re S Si -","- C43 H36 Cl2 O4 P Re S Si -","- C172 H144 Cl8 O16 P4 Re4 S4 Si4 -","4","1","AB1433","Miller, John R.; Lu, Canzhong; Zheng, Yifan","Triphenyl[2-(triphenylsilyl)phenylthio]phosphonium Tetraoxorhenate(1‒)‒Dichloromethane (1/1)","Acta Crystallographica Section C","1997","53","8","1039","1041","10.1107/S0108270197003922","","","0.71073","MoKα","","0.0702","0.0308","","0.0892","0.076","","","","1.03","1.073","1.073","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006350","8.025","0.001","19.844","0.003","8.37","0.001","90","","97.44","0.01","90","","1321.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(2-Bromo-4,5-dimethoxyphenyl)-2-(N,N-dimethylamino)acetonitrile","","- C12 H15 Br N2 O2 -","- C12 H15 Br N2 O2 -","- C48 H60 Br4 N8 O8 -","4","1","AB1437","SanMartín, Raúl; Olivera, Roberto; Domínguez, Esther; Pizarro, José Luis; Arriortua, María Isabel","2-(2-Bromo-4,5-dimethoxyphenyl)-2-(dimethylamino)acetonitrile","Acta Crystallographica Section C","1997","53","8","1141","1143","10.1107/S0108270197004605","","","0.7107","MoKα","","0.2572","0.029","","0.1162","0.0414","","","","0.852","0.622","0.622","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006351","9.5433","0.0005","11.0572","0.0007","13.0444","0.0005","78.84","0.004","89.737","0.004","89.7","0.004","1350.42","0.12","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","4-BENZYL-5-ETHYLTHIO-3H-1,2-DITHIOLE-3-THIONE","","- C12 H12 S4 -","- C12 H12 S4 -","- C48 H48 S16 -","4","2","AB1441","Baggio, Ricardo; Vega, Daniel; Mario L. Aimar; Rita H. de Rossi; Javier Ellena","4-Benzyl-5-ethylthio-3<i>H</i>-1,2-dithiole-3-thione","Acta Crystallographica Section C","1997","53","8","1125","1127","10.1107/S0108270197003697","","","1.54184","CuKα","","0.056","0.049","","0.137","0.132","","","","1.12","1.164","1.164","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006352","7.4083","0.0001","8.5172","0.0001","14.9425","0.0001","87.42","0.01","78.71","0.01","77.57","0.01","902.92","0.05","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H40 Cu N6 O12 -","- C34 H40 Cu N6 O12 -","- C34 H40 Cu N6 O12 -","1","0.5","AB1457","Hökelek, Tuncer; Budak, Kıvanç; Necefoğlu, Hacali","<i>trans</i>-Diaquabis(<i>N</i>,<i>N</i>-diethylnicotinamide-<i>N</i>^1^)bis(4-nitrobenzoato-<i>O</i>)copper(II)","Acta Crystallographica Section C","1997","53","8","1049","1051","10.1107/S0108270197004915","","","0.71073","MoKα","","","0.056","","","0.0479","","","","","1.17","1.17","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006353","11.1118","0.0013","10.3425","0.0011","6.219","0.002","90","","103.75","0.02","90","","694.2","0.3","143","","298","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Diallysulfide","di-2-propenylsulfide","","- C6 H10 S -","- C6 H10 S -","- C24 H40 S4 -","4","0.5","AV1003","Bartkowska, Beata; Krüger, Carl","Diallyl Sulfide and Diallyl Disulfide","Acta Crystallographica Section C","1997","53","8","1064","1066","10.1107/S0108270197004368","","","0.71069","MoKα","","0.0409","0.0395","","0.1002","0.0998","","","","1.221","1.248","1.248","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006354","5.3456","0.0012","13.94","0.003","10.8447","0.001","90","","96.152","0.013","90","","803.5","0.3","168","","298","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Diallyldisulfide","di-2-propenyldisulfide","","- C6 H10 S2 -","- C6 H10 S2 -","- C24 H40 S8 -","4","1","AV1003","Bartkowska, Beata; Krüger, Carl","Diallyl Sulfide and Diallyl Disulfide","Acta Crystallographica Section C","1997","53","8","1064","1066","10.1107/S0108270197004368","","","0.71069","MoKα","","0.0537","0.0498","","0.1376","0.1355","","","","1.059","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006355","8.9952","0.0013","20.46","0.002","9.864","0.002","90","","90","","90","","1815.4","0.5","98","","298","","","","","","","","","3","P b c a","-P 2ac 2ab","61","Tetravinylsilane","Tetraethenylsilane","","- C8 H12 Si -","- C8 H12 Si -","- C64 H96 Si8 -","8","1","AV1004","Bartkowska, Beata; Krüger, Carl","Tetravinylsilane","Acta Crystallographica Section C","1997","53","8","1066","1068","10.1107/S010827019700437X","","","0.71069","MoKα","","0.0463","0.0399","","0.1268","0.1222","","","","1.027","1.079","1.079","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006356","28.818","0.007","21.357","0.002","13.668","0.006","90","","116.29","0.03","90","","7542","4","153","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H33 Cl N3 O17 Re -","- C35 H33 Cl N3 O17 Re -","- C280 H264 Cl8 N24 O136 Re8 -","8","1","BK1234","Absi, Michelle; Stern, Charlotte L.; Yoon, Dong I.; Hupp, Joseph T.","A Crown-Linked Donor‒Acceptor Assembly Containing Re^I^(diimine)(CO)~3~Cl and Nitrobenzene Components","Acta Crystallographica Section C","1997","53","8","1054","1055","10.1107/S010827019700036X","","","0.71069","MoKα","","","0.03","","","0.035","","","","","1.51","1.51","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006357","20.527","0.002","6.144","0.002","8.604","0.002","90","","90.08","0.02","90","","1085.1","0.4","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","anthracene-1-carboxylic acid","anthracene-1-carboxylic acid","","- C15 H10 O2 -","- C15 H10 O2 -","- C60 H40 O8 -","4","1","BK1321","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Anthracene-1-carboxylic Acid","Acta Crystallographica Section C","1997","53","8","1080","1082","10.1107/S0108270197004927","","","0.71073","MoKα","","","0.054","","","0.053","","","","","1.56","1.56","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006358","7.356","0.001","8.986","0.002","9.544","0.002","74.37","0.03","89.69","0.03","89.34","0.03","607.5","0.2","294","","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C5 H16 Cl Co N4 O7 -","- C5 H16 Cl Co N4 O7 -","- C10 H32 Cl2 Co2 N8 O14 -","2","1","BM1124","Huai-Ming Hu; Hong-Sui Sun; Chun-Ying Duan; Qun Zhao; Xiao-Zeng You","(Carbonato-<i>O</i>,<i>O</i>')bis(1,2-ethanediamine-<i>N</i>,<i>N</i>')cobalt(III) Perchlorate","Acta Crystallographica Section C","1997","53","8","1014","1015","10.1107/S0108270197004083","","","0.71073","MoKα","","0.0859","0.0672","","0.1937","0.1752","","","","1.091","1.199","1.199","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006359","8.034","0.006","9.039","0.007","11.493","0.009","106.15","0.06","92.75","0.06","106.74","0.06","760.2","1.1","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1-(2,4-Diacetoxyphenyl)-2-phenylethanone","","- C18 H16 O5 -","- C18 H16 O5 -","- C36 H32 O10 -","2","1","BM1147","Pati, Hari N.; Parmar, Virinder S.; Errington, William","1-(2,4-Diacetoxyphenyl)-2-phenylethanone","Acta Crystallographica Section C","1997","53","8","1161","1162","10.1107/S0108270197004253","","","0.71073","MoKα","","0.0637","0.0429","","0.1236","0.109","","","","1.043","1.106","1.106","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006360","10.598","0.002","24.577","0.003","11.378","0.004","90","","104.24","0.02","90","","2872.5","1.2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(Tetra(thf))lithium(I) Tetrachloro di(μ-chloro) bis(thf)dibismuthate(III)","","- C20 H40 Bi Cl4 Li O5 -","- C20 H40 Bi Cl4 Li O5 -","- C80 H160 Bi4 Cl16 Li4 O20 -","4","1","BM1150","James, Sian C.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.","Tetrahydrofuran Adducts of a Chlorobismuthate(III) Anion and Antimony Triiodide","Acta Crystallographica Section C","1997","53","8","1024","1027","10.1107/S0108270197004009","","","0.71073","MoKα","","0.1236","0.0498","","0.0863","0.0716","","","","0.854","0.994","0.994","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006361","7.92871","0.00011","12.663","0.002","11.447","0.003","90","","94.116","0.003","90","","1146.3","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Antimony(III)iodide tetrahydrofuran","","- C4 H8 I3 O Sb -","- C4 H8 I3 O Sb -","- C16 H32 I12 O4 Sb4 -","4","1","BM1150","James, Sian C.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.","Tetrahydrofuran Adducts of a Chlorobismuthate(III) Anion and Antimony Triiodide","Acta Crystallographica Section C","1997","53","8","1024","1027","10.1107/S0108270197004009","","","0.71073","MoKα","","0.0303","0.0247","","0.0565","0.055","","","","0.818","0.883","0.883","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006362","6.7504","0.0005","6.7504","","8.265","0.001","90","","90","","90","","376.62","0.05","295","","295","","","","","","","","","4","I -4 2 m","I -4 2","121","","","","- Ag2 As K S4 -","- Ag2 As K S4 -","- Ag4 As2 K2 S8 -","2","0.125","BR1149","Schimek, George L.; Kolis, Joseph W.","KAg~2~AsS~4~","Acta Crystallographica Section C","1997","53","8","991","992","10.1107/S0108270197000450","","","0.71073","MoKα","","","0.0241","","","0.0217","","","","","1.64","1.64","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006363","15.634","0.002","8.479","0.001","23.404","0.003","90","","108.6","0.01","90","","2940.4","0.7","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","dipotassium(+) bis[1,4,7,10,13,16-hexaoxacyclooctadecane- potassium(+)] hexaselenodistannate (4-) tetraethylenediamine","","- C32 H80 K4 N8 O12 Se6 Sn2 -","- C32 H80 K4 N8 O12 Se6 Sn2 -","- C64 H160 K8 N16 O24 Se12 Sn4 -","2","0.5","BR1163","Borrmann, Horst; Pirani, Ayaaz M.; Schrobilgen, Gary J.","(K^+^)~2~(18-crown-6-K^+^)~2~[Sn~2~Se~6~]^4{-^}.4en: an [Sn~2~Se~6~]^4{-^} Anion with a Short Sn","Acta Crystallographica Section C","1997","53","8","1004","1006","10.1107/S0108270197004939","","","0.71073","MoKα","","0.0365","0.0298","","0.08","0.0753","","","","1.033","1.054","1.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006364","6.6934","0.0004","9.1833","0.0005","10.1469","0.0006","69.479","0.001","77.218","0.001","75.761","0.001","559.88","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","hydrated zinc arsenate","tris(zinc arsenate) tetrahydrate","","- As6 H8 O28 Zn9 -","- As6 O28 Zn9 -","- As6 O28 Zn9 -","1","0.5","BR1175","Pingyun Feng; Xianhui Bu; Galen D. Stucky","A Synthetic Hydrated Zinc Arsenate Constructed from Tetrahedral, Trigonal Bipyramidal and Octahedral Zinc Polyhedra: [Zn~3~(AsO~4~)~2~]~3~.4H~2~O","Acta Crystallographica Section C","1997","53","8","997","1000","10.1107/S0108270197004095","","","0.71073","MoKα","","0.051","0.0458","","0.1065","0.1051","","","","0.982","1.075","1.075","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006365","11.14","0.002","12.358","0.002","20.727","0.004","87.34","0.03","85.66","0.03","88.21","0.03","2841.1","0.9","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","Bis[4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane- potassium(+1)] eclipsed-decacarbonyldichromate(2-).","","- C46 H72 Cr2 K2 N4 O22 -","- C46 H72 Cr2 K2 N4 O22 -","- C92 H144 Cr4 K4 N8 O44 -","2","1","BR1178","Horst Borrmann; Ayaaz M. Pirani; Gary J. Schrobilgen","[2,2,2-Crypt-K]~2~[Cr~2~(CO)~10~]: the First Dinuclear Metal Decacarbonyl Dianion Structure with an Eclipsed Geometry","Acta Crystallographica Section C","1997","53","8","1007","1010","10.1107/S0108270197004320","","","0.71073","MoKα","","0.039","0.0295","","0.0833","0.0767","","","","0.989","1.012","1.012","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006366","21.4587","0.0001","14.9163","0.0003","17.851","0.0003","90","","95.118","0.001","90","","5691.05","0.15","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28.5 I N4.5 O3 Sn -","- C28 H28.5 I N4.5 O3 Sn -","- C224 H228 I8 N36 O24 Sn8 -","8","2","BS1015","Watson, Suzanne; Errington, William; Fenn, David; Moore, Peter; Wallbridge, Malcolm G.H.","{Tris[<i>N</i>-(salicylidene)-2-aminoethyl]amine}tin(IV) Iodide Acetonitrile Solvate","Acta Crystallographica Section C","1997","53","8","1031","1034","10.1107/S0108270197003855","","","0.71073","MoKα","","0.0536","0.0369","","0.0975","0.0788","","","","1.14","1.122","1.122","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006367","14.33","0.001","16.39","0.003","8.484","0.001","90","","97.4","0.01","90","","1976","0.5","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","1-(8,8-Dicyanoheptafulven-3-yl)aza-15-crown-5 Ether","N-(5-Dicyanomethylenecyclohepta-1,3,6- trienyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane","","- C20 H25 N3 O4 -","- C20 H25 N3 O4 -","- C80 H100 N12 O16 -","4","1","BS1019","Kubo, Kanji; Kato, Nobuo; Mori, Akira; Takeshita, Hitoshi","1-(8,8-Dicyanoheptafulven-3-yl)aza-15-crown-5 Ether","Acta Crystallographica Section C","1997","53","8","1136","1137","10.1107/S010827019700512X","","","1.54184","CuKα","","0.0651","0.0504","","0.1491","0.1354","","","","1.051","1.08","1.08","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006368","17.229","0.003","10.817","0.005","14.851","0.006","90","","110.78","0.03","90","","2587.7","1.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(3-methyl-2,4-pentanedionato)(N,N-bis(2-chloroethyl)1,2-ethane diamine)cobalt(III) perchlorate","","- C18 H32 Cl3 Co N2 O8 -","- C18 H32 Cl3 Co N2 O8 -","- C72 H128 Cl12 Co4 N8 O32 -","4","1","BS1025","Ware, David C.; Denny, William A.; Clark, George R.","[<i>N</i>,<i>N</i>-Bis(2-chloroethyl)-1,2-ethanediamine-<i>N</i>,<i>N</i>']bis(3-methyl-2,4-pentanedionato-<i>O</i>,<i>O</i>')cobalt(III) Perchlorate: a Potential Hypoxia Selective Anticancer Agent","Acta Crystallographica Section C","1997","53","8","1058","1059","10.1107/S0108270197004186","","","0.71069","MoKα","","0.0927","0.0504","","0.1597","0.1178","","","","1.142","1.044","1.044","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006369","7.227","0.001","34.729","0.002","9.221","0.002","90","","90","","90","","2314.3","0.6","296","","296","","","","","","","","","3","P n m a","-P 2ac 2n","62","5,8-dimethoxy-1-naphthoic acid","","","- C13 H12 O4 -","- C13 H12 O4 -","- C104 H96 O32 -","8","1","BS1029","Blackburn, Anthony C.; Gerkin, Roger E.","5,8-Dimethoxy-1-naphthoic Acid and Methyl 5,8-Dimethoxy-1-naphthoate","Acta Crystallographica Section C","1997","53","8","1077","1080","10.1107/S0108270197004940","","","0.71073","MoKα","","","0.049","","","0.036","","","","","2.06","2.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006370","7.707","0.002","8.72","0.001","18.619","0.002","90","","100.97","0.01","90","","1228.4","0.4","296","","296","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","methyl 5,8-dimethoxy-1-naphthoate","","","- C14 H14 O4 -","- C14 H14 O4 -","- C56 H56 O16 -","4","1","BS1029","Blackburn, Anthony C.; Gerkin, Roger E.","5,8-Dimethoxy-1-naphthoic Acid and Methyl 5,8-Dimethoxy-1-naphthoate","Acta Crystallographica Section C","1997","53","8","1077","1080","10.1107/S0108270197004940","","","0.71073","MoKα","","","0.052","","","0.034","","","","","1.66","1.66","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006371","18.781","0.005","5.292","0.001","24.948","0.007","90","","90.47","0.02","90","","2479.5","1.1","295","","295","","","","","","","","","5","I 1 2/a 1","","","","2,2'-diaminodiphenyl disulfide hemihydrate","","- C12 H13 N2 O0.5 S2 -","- C12 H13.5 N2 O S2 -","- C96 H108 N16 O8 S16 -","8","1","CF1091","Kaitner, Branko; Pavlović, Gordana","2,2'-Diaminodiphenyl Disulfide Hemihydrate","Acta Crystallographica Section C","1997","53","8","1103","1105","10.1107/S0108270197004435","","","0.71069","MoKα","","0.031","0.031","","0.051","0.051","","","","","1.12","1.12","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006372","13.339","0.003","10.605","0.003","13.052","0.005","90","","108.78","0.02","90","","1748","0.9","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2S,3R,4R) and (2R,3S,4S)-dimethyl-2-(3,4,5-trimethoxyphenyl) tetrahydrofuran-3,4-dicarboxylate ((Ia))","","- C17 H22 O8 -","- C17 H22 O8 -","- C68 H88 O32 -","4","1","CF1156","Yang, Qing-chuan; Song, Yi-qiu; Tang, You-qi; Pei, Wei-wei; Li, Shao-hu; Ye, Xiu-lin","Two Pairs of Stereoisomers of Dimethyl 2-(3,4,5-Trimethoxyphenyl)tetrahydrofuran-3,4-dicarboxylate","Acta Crystallographica Section C","1997","53","8","1133","1136","10.1107/S0108270197004447","","","0.71073","MoKα","","0.0977","0.0556","","0.1898","0.1402","","","","0.996","1.065","1.065","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006373","5.385","0.002","19.521","0.007","16.7","0.008","90","","96.57","0.04","90","","1744","1.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2S,3R,4S) and (2R,3S,4S) -dimethyl-2-(3,4,5-trimethoxyphenyl) tetrahydrofuran-3,4-dicarboxylate ((Ib))","","- C17 H22 O8 -","- C17 H22 O8 -","- C68 H88 O32 -","4","1","CF1156","Yang, Qing-chuan; Song, Yi-qiu; Tang, You-qi; Pei, Wei-wei; Li, Shao-hu; Ye, Xiu-lin","Two Pairs of Stereoisomers of Dimethyl 2-(3,4,5-Trimethoxyphenyl)tetrahydrofuran-3,4-dicarboxylate","Acta Crystallographica Section C","1997","53","8","1133","1136","10.1107/S0108270197004447","","","0.71073","MoKα","","0.1369","0.0488","","0.2023","0.1221","","","","0.96","1.065","1.065","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006374","9.582","0.001","10.495","0.002","13.498","0.003","90","0.2","90","0.3","90","0.3","1357.4","0.4","294","","294","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H22 N4 -","- C14 H22 N4 -","- C56 H88 N16 -","4","1","CF1161","Lassaba, Essedyia; Benharref, Ahmed; Giorgi, Michel; Pierrot, Marcel","(1<i>S</i>,6<i>S</i>)-Tetrazolo[1,5-<i>g</i>]-7-aza-<i>trans</i>-himachal-2-ene","Acta Crystallographica Section C","1997","53","8","1139","1141","10.1107/S010827019700365X","","","0.71073","MoKα","","0.056","0.048","","","0.068","","","","","1.829","1.829","","","","","has coordinates,has Fobs","208466","2020-10-21","18:00:00",""
"2006375","15.117","0.001","14.4592","0.0006","15.8539","0.0009","90","","90","","90","","3465.3","0.3","297","","","","","","","","","","","4","P b c a","","","","1,8-Diiodo-10-hydroxy-10-(3-methyl-but-3-en-1-ynyl)-10H-anthracen-9-one","","- C19 H12 I2 O2 -","- C19 H12 I2 O2 -","- C152 H96 I16 O16 -","8","1","CF1169","Thalji, Reema K.; Garcia, Gabriel; Asfaw, Bruktawit; Rodriguez, Augusto; Fronczek, Frank R.","A Diiodo-Substituted 9-Anthracenone","Acta Crystallographica Section C","1997","53","8","1138","1139","10.1107/S0108270197004460","","","0.71073","MoKα","","","0.045","","","0.054","","","","","1.88","1.88","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006376","9.606","0.002","6.378","0.002","30.077","0.005","90","","90","","90","","1842.7","0.8","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","N-Carboxy-dl-Phenylalanine Anhydride","","","- C10 H9 N O3 -","- C10 H9 N O3 -","- C80 H72 N8 O24 -","8","2","DE1051","Hitoshi Kanazawa; Hidehiro Uekusa; Yuji Ohashi","<i>N</i>-Carboxy-<small>DL</small>-phenylalanine Anhydride","Acta Crystallographica Section C","1997","53","8","1154","1156","10.1107/S0108270197004010","","","1.54184","CuKα","","0.0453","0.0338","","0.0901","0.0838","","","","1.089","1.12","1.12","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006377","6.706","0.001","6.806","0.001","6.997","0.001","100.73","0.02","113.33","0.02","80.53","0.02","286.65","0.09","293","2","293","2","","","","","","","","3","P -1","-P 1","2","mercury(II)-pyrophosphate","di-mercury(II)-diphosphate","","- Hg2 O7 P2 -","- Hg2 O7 P2 -","- Hg4 O14 P4 -","2","1","DU1174","Weil, Matthias; Glaum, Robert","Mercury(II) Diphosphate, Hg~2~P~2~O~7~","Acta Crystallographica Section C","1997","53","8","1000","1003","10.1107/S0108270197003879","","","0.71073","MoKα","","0.0374","0.0266","","0.0662","0.0602","","","","1.091","1.093","1.093","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006378","7.122","0.002","18.113","0.004","10.389","0.004","90","","90","","90","","1340.2","0.7","293","","293","","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C13 H17 N3 O5 -","- C13 H17 N3 O5 -","- C52 H68 N12 O20 -","4","1","FG1253","Audette, Gerald F.; Zoghaib, Wajdi M.; Tourigny, Guy; Gupta, Sagar V.; Delbaere, Louis T. J.","3,4-Etheno-5-methoxymethyl-2'-deoxycytidine","Acta Crystallographica Section C","1997","53","8","1099","1101","10.1107/S0108270197003880","","","0.71069","MolybdenumKα","","0.095","0.094","","0.076","0.076","","","","","1.43","1.43","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006379","14.997","0.006","12.898","0.009","14.743","0.014","90","","90","","90","","2852","4","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","3-(1,8-naphthalenedicarboximido)benzonitrile, or N-(3-benzonitrile)-1,8-naphthalimide or strict IUPAC name 3-(1,3-dioxo-2,3-dihydro-1H-naphtho-[1,8-cd]- azin-2yl)benzonitrile","","- C19 H10 N2 O2 -","- C19 H10 N2 O2 -","- C152 H80 N16 O16 -","8","1","FG1259","Batchelor, Rhys A.; Hunter, Christopher A.; Simpson, Jim","3-(1,8-Naphthalenedicarboximido)benzonitrile [or <i>N</i>-(3-Cyanophenyl)-1,8-naphthalimide], C~19~H~10~N~2~O~2~","Acta Crystallographica Section C","1997","53","8","1117","1119","10.1107/S0108270197003727","","","0.71073","MoKα","","0.1431","0.0682","","0.1626","0.1373","","","","0.926","1.208","1.208","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006380","12.023","0.002","9.446","0.002","15.205","0.002","90","","90.243","0.014","90","","1726.8","0.5","294","","294","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H16 O4 S -","- C20 H16 O4 S -","- C80 H64 O16 S4 -","4","1","FG1284","Jones, Ray; Rattray, A. Graham M.; Scheffer, John R.; Trotter, James","Dimethyl 9,10-Dihydro-9,10-ethenoanthracene-11-carboxylate-12-<i>S</i>-carbonothioate","Acta Crystallographica Section C","1997","53","8","1162","1164","10.1107/S0108270197003892","","","0.7107","MoKα","","0.092","0.0393","","0.0549","0.0496","","","","1.55","1.83","1.83","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006381","12.8075","0.0018","12.8075","0.0018","16.419","0.003","90","","90","","90","","2693.2","0.7","143","2","143","2","","","","","","","","3","P 42 b c","P 4c -2ab","106","","1,8-Bis(dimethylphosphino)naphthalene","","- C14 H18 P2 -","- C14 H18 P2 -","- C112 H144 P16 -","8","1","FG1288","Jones, Peter G.; Thönnessen, Holger; Karac̨ar, Atilla; Schmutzler, Reinhard","1,8-Bis(dimethylphosphino)naphthalene: an Unusual Case of Pseudosymmetry","Acta Crystallographica Section C","1997","53","8","1119","1122","10.1107/S010827019700468X","","","0.71073","MoKα","","0.0524","0.041","","0.101","0.0913","","","","1.064","1.038","1.038","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006382","11.7734","0.0017","15.773","0.002","8.796","0.0016","90","","95.182","0.014","90","","1626.8","0.4","296","","296","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","sp-9-(o-isopropylphenyl)fluorene","","- C22 H20 -","- C22 H20 -","- C88 H80 -","4","1","FG1290","Meyers, Cal Y.; Hou, Yuqing; Scott, Delano; Robinson, Paul D.","Exclusive Formation of Crystalline <i>sp</i>-9-(<i>o</i>-Isopropylphenyl)fluorene from its <i>ap</i> Rotamer in Solution","Acta Crystallographica Section C","1997","53","8","1149","1151","10.1107/S0108270197003739","","","0.71069","MoKα","","0.183","0.0459","","0.1619","0.109","","","","1.016","1.173","1.173","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006383","10.307","0.005","16.161","0.01","22.496","0.01","91.57","0.04","89.81","0.04","101.1","0.04","3676","3","178","2","178","2","","","","","","","","6","P -1","-P 1","2","","Bis(triphenylphosphonine)iminium Trichloro(cyclopentadienyl)chromide(III)","","- C41 H35 Cl3 Cr N P2 -","- C41 H35 Cl3 Cr N P2 -","- C164 H140 Cl12 Cr4 N4 P8 -","4","2","FG1314","Scheer, Manfred; Jones, Peter G.","Bis(triphenylphosphine-<i>P</i>)iminium Trichloro(η^5^-cyclopentadienyl)chromide(III)","Acta Crystallographica Section C","1997","53","8","1038","1039","10.1107/S0108270197005234","","","0.71073","MoKα","","0.0918","0.0498","","0.1642","0.1304","","","","0.95","0.968","0.968","","","","","has coordinates","192288","2020-10-21","18:00:00",""
"2006384","8.362","0.002","16.727","0.002","11.554","0.002","90","","95.561","0.002","90","","1608.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H16 N2 O S -","- C19 H16 N2 O S -","- C76 H64 N8 O4 S4 -","4","1","FR1015","Elerman, Yalc̨in; Elmali, Ayhan; Kendi̇, Engin; Özbey, Süheyla; Ertüzün, Vedia","4-Ethyl-2-(2-hydroxynaphthylmethylidene)amino-5-methyl-3-thiophenecarbonitrile","Acta Crystallographica Section C","1997","53","8","1158","1160","10.1107/S0108270196014515","","","0.71069","MoKα","","0.067","0.046","","0.118","0.111","","","","1.122","1.215","1.215","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006385","24.967","0.003","6.075","0.002","13.232","0.002","90","","113.134","0.011","90","","1845.6","0.7","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","(-)-labda-8(17),13E-dien-15-oic","","- C20 H32 O2 -","- C20 H31.5 O2 -","- C80 H126 O8 -","4","1","FR1024","Reinaldo Atencio; Ricardo Gaitán; Sara Pekerar; José D. Medina","(13<i>E</i>)-({-})-Labda-8(17),13-dien-15-oic Acid","Acta Crystallographica Section C","1997","53","8","1068","1070","10.1107/S0108270197003016","","","0.71069","MoKα","","0.0742","0.044","","0.163","0.1194","","","","1.108","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006386","10.429","0.002","10.699","0.003","11.743","0.003","114.41","0.02","107.43","0.03","96.33","0.04","1096.3","0.6","295","","","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H50 N4 Ni3 O10 S2 -","- C42 H50 N4 Ni3 O10 S2 -","- C42 H50 N4 Ni3 O10 S2 -","1","0.5","FR1035","Ülkü, Dinçer; Ercan, Filiz; Atakol, Orhan; Dinçer, F. Nazlι","Bis{(μ-acetato)[μ-bis(salicylidene)-1,3-propanediaminato](dimethyl sulfoxide)nickel(II)}nickel(II)","Acta Crystallographica Section C","1997","53","8","1056","1057","10.1107/S0108270197004733","","","0.71073","MoKα","","","0.048","","","0.049","","","","","0.96","0.96","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006387","16.54","0.001","15.605","0.002","10.445","0.001","90","","104.9","0.01","90","","2605.3","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrachlorotetrakis(tetrahydrofuran)di-μ-thioxodiniobium(IV)","","- C16 H32 Cl4 Nb2 O4 S2 -","- C16 H32 Cl4 Nb2 O4 S2 -","- C64 H128 Cl16 Nb8 O16 S8 -","4","1","FR1039","Myungok Yoon; Victor Young Jr; Gordon J. Miller; .","A Bioctahedral Nb^IV^ Cluster with Bridging Sulfides: [Nb~2~(μ-S)~2~Cl~4~(thf)~4~]","Acta Crystallographica Section C","1997","53","8","1041","1043","10.1107/S0108270197004277","","","0.71073","MoKα","","0.0779","0.0416","","0.1112","0.0972","","","","1.034","1.089","1.089","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006388","7.567","0.0014","8.7781","0.0007","10.2806","0.0016","108.941","0.01","94.805","0.014","98.788","0.011","631.79","0.17","293","","293","","","","","","","","","7","P -1","-P 1","2","trans-diaquabis(2,2'-bipyridine)ruthenium(II) hexafluorophosphate","trans-diaquabis(2,2'-bipyridine)ruthenium(II) hexafluorophosphate","","- C20 H20 F12 N4 O2 P2 Ru -","- C20 H20 F12 N4 O2 P2 Ru -","- C20 H20 F12 N4 O2 P2 Ru -","1","0.5","FR1040","Weathers, Norman R.; Sadoski, Robert C.; Durham, Bill; Cordes, A. Wallace","<i>trans</i>-Diaquabis(2,2'-bipyridine-<i>N</i>,<i>N</i>')ruthenium(II) Bis(hexafluorophosphate)","Acta Crystallographica Section C","1997","53","8","1047","1049","10.1107/S0108270197004381","","","0.7107","MolybdenumKα","","0.04","0.04","","0.051","0.051","","","","","0.9","0.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006389","8.468","0.0014","11.1997","0.0007","6.822","0.0009","90","","90","","90","","646.99","0.14","296","","296","","","","","","","","","4","C m c m","-C 2c 2","63","1,3-dimethylimidazole-2-thione","1,3-dimethyl-2(3H)-imidazolethione","","- C5 H8 N2 S -","- C5 H8 N2 S -","- C20 H32 N8 S4 -","4","0.25","HA1189","Tomlin, David W.; Campbell, Daniel P.; Fleitz, Paul A.; Adams, W. Wade","Redetermination of 1,3-Dimethylimidazole-2-thione","Acta Crystallographica Section C","1997","53","8","1153","1154","10.1107/S0108270197004198","","","0.71073","MoKα","","","0.049","","","0.04","","","","","1.169","1.169","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006390","4.832","0.002","10.222","0.006","13.426","0.006","73.3","0.04","81.43","0.03","88.83","0.04","627.9","0.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H14 O4 -","- C15 H14 O4 -","- C30 H28 O8 -","2","1","HA1191","Damas, Ana M.; Roleira, Fernanda F.; Pinto, Madalena M. M.","2-[2-(Hydroxyethyl)phenoxy]benzoic Acid","Acta Crystallographica Section C","1997","53","8","1143","1145","10.1107/S0108270197004344","","","0.71069","MoKα","","0.0632","0.0389","","0.1235","0.0932","","","","1.031","1.033","1.033","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006391","7.498","0.003","12.564","0.004","16.296","0.013","90","","93.36","0.04","90","","1532.5","1.5","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","methyl (E)-3-(imidazol-4-yl)propenoate hemihydrate","","- C7 H9 N2 O2.5 -","- C7 H9 N2 O2.5 -","- C56 H72 N16 O20 -","8","1","HA1192","Blake, Alexander J.; McNab, Hamish; Thornley, Craig","Four Methyl Azolyl-3-propenoates","Acta Crystallographica Section C","1997","53","8","1093","1097","10.1107/S0108270197004952","","","0.71073","MoKα","","0.0365","0.0333","","0.0955","0.0926","","","","1.057","1.075","1.075","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006392","10.795","0.003","8.271","0.001","17.803","0.003","90","","92.957","0.015","90","","1587.4","0.6","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","methyl (E)-3-(pyrrol-2-yl)propenoate","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C64 H72 N8 O16 -","8","2","HA1192","Blake, Alexander J.; McNab, Hamish; Thornley, Craig","Four Methyl Azolyl-3-propenoates","Acta Crystallographica Section C","1997","53","8","1093","1097","10.1107/S0108270197004952","","","0.71073","MoKα","","0.2221","0.058","","0.2147","0.1413","","","","1.014","1.205","1.205","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006393","9.706","0.002","8.9898","0.0009","17.714","0.003","90","","90","","90","","1545.6","0.4","277","2","277","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","methyl (E)-3-(imidazol-2-yl)propenoate","","- C7 H8 N2 O2 -","- C7 H8 N2 O2 -","- C56 H64 N16 O16 -","8","1","HA1192","Blake, Alexander J.; McNab, Hamish; Thornley, Craig","Four Methyl Azolyl-3-propenoates","Acta Crystallographica Section C","1997","53","8","1093","1097","10.1107/S0108270197004952","","","0.71073","MoKα","","0.1105","0.0438","","0.1366","0.0969","","","","1.108","1.095","1.095","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006394","15.7","0.013","18.927","0.016","7.311","0.005","90","","100.13","0.06","90","","2139","3","277","2","277","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","methyl (Z)-3-(imidazol-2-yl)propenoate","","- C7 H8 N2 O2 -","- C7 H8 N2 O2 -","- C84 H96 N24 O24 -","12","3","HA1192","Blake, Alexander J.; McNab, Hamish; Thornley, Craig","Four Methyl Azolyl-3-propenoates","Acta Crystallographica Section C","1997","53","8","1093","1097","10.1107/S0108270197004952","","","0.71073","MoKα","","0.0712","0.0387","","0.1177","0.1027","","","","1.036","1.106","1.106","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006395","12.3962","0.0008","7.8062","0.0005","30.305","0.0002","90","","106.319","0.005","90","","2814.4","0.3","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 N O -","- C17 H21 N O -","- C136 H168 N8 O8 -","8","2","JZ1173","Kooijman, Huub; Spek, Anthony L.; Hoogesteger, Frans J.; Jenneskens, Leonardus W.","4-(1-Phenylpiperidin-4-ylidene)cyclohexanone","Acta Crystallographica Section C","1997","53","8","1156","1158","10.1107/S0108270197003958","","","0.71073","MoKα","","0.063","0.063","","0.148","0.148","","","","0.96","0.96","0.96","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006396","9.838","0.005","12.524","0.005","12.842","0.006","69.12","0.03","68","0.04","82.42","0.04","1370.7","1.2","126","2","126","2","","","","","","","","5","P -1","-P 1","2","Bis[anhydromesorhodochlorinato-XV methyl ester)zinc(II)]","Bis{(8,13-diethyl-2,21,22,23-tetrahydro-18-methoxycarbonyl-3,7,12,17- tetramethyl-23-oxo-3H-benzo[at]porphyrinato)zinc(II)}","","- C66 H68 N8 O6 Zn2 -","- C66 H68 N8 O6 Zn2 -","- C66 H68 N8 O6 Zn2 -","1","0.5","JZ1192","Senge, Mathias O.; Smith, Kevin M.","Bis[(anhydro-<i>meso</i>-rhodochlorinato-XV methyl ester)zinc(II)]","Acta Crystallographica Section C","1997","53","8","1022","1024","10.1107/S0108270197002977","","","0.71073","MoKα","","0.0987","0.0681","","0.1633","0.1463","","","","1.029","1.079","1.079","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006397","8.646","0.0011","10.849","0.0013","15.96","0.0002","90","","95.48","0.02","90","","1490.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dicarbonylbis(η^5^-cyclopentadienyl)-(μ-1,4-η:4,5-η-1,4-pentadien- 1,4-diyl)oxoditungsten(W-W)","","- C17 H16 O3 W2 -","- C17 H16 O3 W2 -","- C68 H64 O12 W8 -","4","1","JZ1195","Kreiter, Cornelius G.; Schwarz, C. Bettina; Frank, Walter; Reiß, Guido J.","Photochemical Reactions of Transition Metal Organyl Complexes with Olefins. 18. Dicarbonylbis(η^5^-cyclopentadienyl)(μ-1,4-η:4,5-η-1,4-pentadien-1,4-diyl)oxoditungsten(<i>W</i>—<i>W</i>)","Acta Crystallographica Section C","1997","53","8","1018","1020","10.1107/S0108270197004393","","","0.71069","MoKα","","0.0314","0.0284","","0.0747","0.0733","","","","1.136","1.16","1.16","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006398","14.1995","0.0007","11.3316","0.0005","9.7483","0.0005","90","","106.453","0.004","90","","1504.3","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(3,5-Dimethylpyridine) (N-salicylideneglycinato)-Copper(II) Polymer","","- C16 H16 Cu N2 O3 -","- C16 H16 Cu N2 O3 -","- C64 H64 Cu4 N8 O12 -","4","1","JZ1196","Warda, Salam A.","A (3,5-Dimethylpyridine-<i>N</i>)(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>'')copper(II) Polymer","Acta Crystallographica Section C","1997","53","8","1010","1011","10.1107/S0108270197004241","","","1.54178","CuKα","","0.0558","0.0553","","0.1467","0.1462","","","","1.143","1.153","1.153","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006399","16.8637","0.0014","9.3561","0.0006","7.4402","0.0013","90","","111.934","0.011","90","","1088.9","0.2","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Bipyridyl-N,N')dibromopalladium(II)","","- C10 H8 Br2 N2 Pd -","- C10 H8 Br2 N2 Pd -","- C40 H32 Br8 N8 Pd4 -","4","0.5","JZ1200","Smeets, Wilberth J.J.; Spek, Anthony L.; Hoare, Jason L.; Canty, Allan J.; Hovestad, Neldes; van Koten, Gerard","(2,2'-Bipyridyl-<i>N</i>,<i>N</i>')dibromopalladium(II)","Acta Crystallographica Section C","1997","53","8","1045","1047","10.1107/S0108270197004149","","","0.71073","MoKα","","","0.051","","","","0.135","","","","","","1.044","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006400","16.746","0.002","12.974","0.002","11.582","0.002","90","","90","","90","","2516.3","0.7","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Potassium strontium tetraborate decahydrate","","- B8 H28 K2 O28 Sr -","- B8 H28 K2 O28 Sr -","- B32 H112 K8 O112 Sr4 -","4","1","KA1150","Xavier Solans; Joaquim Solans; M. Victoria Domènech","Potassium Strontium Tetraborate Decahydrate and Ammonium Calcium Tetraborate Octahydrate","Acta Crystallographica Section C","1997","53","8","994","997","10.1107/S0108270196007032","","","0.71069","MoKα","","0.033","0.033","","0.076","0.076","","","","0.994","0.993","0.993","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"2006401","16.659","0.002","12.571","0.002","11.588","0.002","90","","90","","90","","2426.8","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Ammonium Calcium Tetraborate Octohydrate","","- B8 Ca H32 N2 O26 -","- B8 Ca H32 N2 O26 -","- B32 Ca4 H128 N8 O104 -","4","1","KA1150","Xavier Solans; Joaquim Solans; M. Victoria Domènech","Potassium Strontium Tetraborate Decahydrate and Ammonium Calcium Tetraborate Octahydrate","Acta Crystallographica Section C","1997","53","8","994","997","10.1107/S0108270196007032","","","0.71069","MoKα","","0.026","0.026","","0.067","0.067","","","","1.02","1.02","1.02","","","","","has coordinates","134621","2020-10-21","18:00:00",""
"2006402","8.676","0.001","44.948","0.002","22.143","0.002","90","","99.369","0.005","90","","8519.9","1.3","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(1RS,3SR,4RS,5RS,7SR,9SR)-4,7-diacetyl-9-hydroxy-1,3,5,9-tetramethyl -2,6,8-trioxatricyclo[3.2.1.1^3,7^]nonane","","- C14 H20 O6 -","- C14 H20 O6 -","- C336 H480 O144 -","24","6","KA1225","Raabe, Gerhard; Hall, Sydney R.; .; Thomas, Hans Günter; .; Wellen, Ulrich; .; Simons, Josef; .","(1<i>RS</i>,3<i>SR</i>,4<i>RS</i>,5<i>RS</i>,7<i>SR</i>,9<i>SR</i>)-4,7-Diacetyl-9-hydroxy-1,3,5,9-tetramethyl-2,6,8-trioxatricyclo[3.2.1.1^3,7^]nonane: a Tricyclic System Formed Under Cathodic Conditions","Acta Crystallographica Section C","1997","53","8","1107","1111","10.1107/S0108270197005477","","","1.54179","CuKα","","0.105","0.059","","0.074","0.067","","","","1.986","2.529","2.529","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006403","11.786","0.002","5.543","0.001","17.799","0.004","90","","106.16","0.03","90","","1116.9","0.4","193","2","193","2","","","","","","","","3","P 1 21 1","P 2yb","4","","9-Methylthiophenanthrene","","- C15 H12 S -","- C15 H12 S -","- C60 H48 S4 -","4","2","KA1230","Jarno Kansikas; Kaija Sipilä","Four 9-Alkylthiophenanthrenes at 193K (Alkyl = Methyl, Ethyl, Propyl and Butyl)","Acta Crystallographica Section C","1997","53","8","1127","1131","10.1107/S0108270197004575","","","0.71069","MoKα","","0.0948","0.073","","0.2093","0.1811","","","","1.04","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006404","9.054","0.004","20.644","0.009","6.659","0.003","90","","98.1","0.03","90","","1232.2","0.9","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","9-Ethylthiophenanthrene","","- C16 H14 S -","- C16 H14 S -","- C64 H56 S4 -","4","1","KA1230","Jarno Kansikas; Kaija Sipilä","Four 9-Alkylthiophenanthrenes at 193K (Alkyl = Methyl, Ethyl, Propyl and Butyl)","Acta Crystallographica Section C","1997","53","8","1127","1131","10.1107/S0108270197004575","","","0.71069","MoKα","","0.0996","0.0679","","0.1553","0.1378","","","","1.03","1.103","1.103","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006405","9.067","0.003","21.123","0.007","7.007","0.003","90","","99.12","0.03","90","","1325","0.8","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","9-Propylthiophenanthrene","","- C17 H16 S -","- C17 H16 S -","- C68 H64 S4 -","4","1","KA1230","Jarno Kansikas; Kaija Sipilä","Four 9-Alkylthiophenanthrenes at 193K (Alkyl = Methyl, Ethyl, Propyl and Butyl)","Acta Crystallographica Section C","1997","53","8","1127","1131","10.1107/S0108270197004575","","","0.71069","MoKα","","0.0863","0.0504","","0.1856","0.1419","","","","1.04","1.041","1.041","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006406","9.01","0.004","23.124","0.008","6.888","0.003","90","","97.81","0.03","90","","1421.8","1","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","9-Butylthiophenantrene","","- C18 H18 S -","- C18 H18 S -","- C72 H72 S4 -","4","1","KA1230","Jarno Kansikas; Kaija Sipilä","Four 9-Alkylthiophenanthrenes at 193K (Alkyl = Methyl, Ethyl, Propyl and Butyl)","Acta Crystallographica Section C","1997","53","8","1127","1131","10.1107/S0108270197004575","","","0.71069","MoKα","","0.0779","0.0596","","0.1664","0.1303","","","","1.964","2.169","2.169","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006407","29.268","0.003","8.9925","0.0006","13.569","0.002","90","","115.063","0.006","90","","3235","0.6","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetramethylammonium hydrogen bis[bis(N,N-dimethylthiocarbamoylthio)acetate]","","- C20 H39 N5 O4 S8 -","- C20 H39 N5 O4 S8 -","- C80 H156 N20 O16 S32 -","4","0.5","KH1134","Ng, Seik Weng","Tetramethylammonium Hydrogen Bis[bis(dimethyldithiocarbamyl)acetate]","Acta Crystallographica Section C","1997","53","8","1111","1113","10.1107/S0108270197004204","","","0.71073","MoKα","","0.0499","0.0391","","0.1043","0.0985","","","","1.037","1.095","1.095","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006408","9.515","0.001","12.234","0.001","12.787","0.001","89.888","0.008","97.377","0.009","90.29","0.009","1476.1","0.2","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Bis[aqua(chlorodifluoroacetato)triphenyltin-1,10-phenanthroline]","","- C32 H25 Cl F2 N2 O3 Sn -","- C32 H25 Cl F2 N2 O3 Sn -","- C64 H50 Cl2 F4 N4 O6 Sn2 -","2","1","KH1135","Ng, Seik Weng","Bis[aqua(chlorodifluoroacetato-<i>O</i>)triphenyltin‒1,10-phenanthroline]","Acta Crystallographica Section C","1997","53","8","1059","1061","10.1107/S0108270197003867","","","0.71073","MoKα","","0.063","0.0557","","0.1447","0.1397","","","","1.087","1.14","1.14","","","","","has coordinates","198932","2020-10-21","18:00:00",""
"2006409","10.3733","0.001","14.724","0.003","20.471","0.001","90","","90","","90","","3126.7","0.7","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H18 Cu N2 O2 -","- C18 H18 Cu N2 O2 -","- C144 H144 Cu8 N16 O16 -","8","1","KH1140","Yao, Hsueh-Hua; Lo, Jem-Mau; Chen, Bor-Hann; Lu, Tian-Huey","[<i>N</i>,<i>N</i>'-Bis(salicylidene)-1,4-diiminobutane]copper(II)","Acta Crystallographica Section C","1997","53","8","1012","1013","10.1107/S0108270197003636","","","0.7093","MolybdenumKα","","0.04","0.04","","0.032","0.032","","","","","2.19","2.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006410","15.2699","0.0009","6.833","0.002","19.9199","0.0013","90","","90","","90","","2078.4","0.6","293","1","293","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C12 H14 O3 -","- C12 H14 O3 -","- C96 H112 O24 -","8","1","KH1143","Gable, Robert W.; Gan, Chee Yong; Lambert, John N.","Methyl 8-Hydroxy-1,2,3,4-tetrahydronaphthalene-5-carboxylate","Acta Crystallographica Section C","1997","53","8","1122","1124","10.1107/S0108270197002898","","","1.5418","CuKα(nickelfiltered)","","0.095","0.05","","0.151","0.121","","","","1.027","1.151","1.151","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2006411","14.4679","0.001","11.5916","0.001","11.456","0.003","90","0.01","107.05","0.01","90","0.009","1836.8","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H23 N O4 S Si -","- C16 H23 N O4 S Si -","- C64 H92 N4 O16 S4 Si4 -","4","1","KH1145","White, Jonathan M.; Green, Alison J.","<i>endo</i>-3-Trimethylsilyl-2-norbornyl 2-Nitrobenzenesulfinate","Acta Crystallographica Section C","1997","53","8","1084","1086","10.1107/S0108270197003521","","","1.5418","CuKα","","0.0688","0.0504","","0.1463","0.1307","","","","1.049","1.087","1.087","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006412","9.079","0.001","10.188","0.002","14.92","0.002","74.49","0.01","80","0.01","83.13","0.01","1305.7","0.3","289","2","289","2","","","","","","","","5","P -1","-P 1","2","","5,8-di(4-methoxy-2,3,6-trimethylbenzenesulphonyl)-1,4-dioxa-5,8-diazaocane","","- C24 H34 N2 O8 S2 -","- C24 H34 N2 O8 S2 -","- C48 H68 N4 O16 S4 -","2","1","MU1298","Van Meervelt, Luc; Kong Thoo Lin, Paul","5,8-Bis(4-methoxy-2,3,6-trimethylbenzenesulfonyl)-1,4-dioxa-5,8-diazocane","Acta Crystallographica Section C","1997","53","8","1131","1133","10.1107/S0108270197003806","","","1.54178","CuKα","","0.0604","0.058","","0.1652","0.1628","","","","1.061","1.094","1.094","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006413","14.251","0.005","11.548","0.005","14.28","0.007","90","","99.89","0.03","90","","2315.1","1.7","193","1","193","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Tetrachloro-[4-(2-(phenylamino)pyridinium)butoxo-O] (tetrahydrofuran-O)zirconium(IV)","","- C19 H26 Cl4 N2 O2 Zr -","- C19 H26 Cl4 N2 O2 Zr -","- C76 H104 Cl16 N8 O8 Zr4 -","4","1","MU1299","Polamo, Mika; Mutikainen, Ilpo; Leskelä, Markku","A Tetrahydrofuran Ring-Opening Product: <i>trans</i>-Tetrachloro{4-[2-(phenylamino)pyridinio]butoxido-<i>O</i>}(tetrahydrofuran-<i>O</i>)zirconium(IV)","Acta Crystallographica Section C","1997","53","8","1036","1037","10.1107/S0108270197003818","","","0.71073","MoKα","","0.0609","0.0435","","0.1057","0.0994","","","","1.079","1.162","1.162","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006414","11.189","0.002","13.416","0.003","19.409","0.004","90","0.02","120.73","0.02","90","0.02","2504.4","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tris(8-hydroxyquinolinate)iron(III) ethanol solvate","","- C29 H24 Fe N3 O4 -","- C29 H24 Fe N3 O4 -","- C116 H96 Fe4 N12 O16 -","4","1","MU1310","Pech, Lucija; Bankovsky, Yurii A.; Kemme, Andrejs; Lejejs, Janis","Tris(8-hydroxyquinolinato)iron(III) Ethanol Solvate","Acta Crystallographica Section C","1997","53","8","1043","1045","10.1107/S0108270197003831","","","0.71069","MoKα","","0.081","0.062","","0.156","0.141","","","","0.944","0.972","0.972","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006415","7.522","0.002","8.663","0.002","11.349","0.002","72.61","0.03","78.96","0.03","87.31","0.03","692.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H16 Ge I2 N8 -","- C32 H16 Ge I2 N8 -","- C32 H16 Ge I2 N8 -","1","0.5","MU1316","Ejsmont, Krzysztof; Kubiak, Ryszard","Isostructural Complexes of Diiodo(phthalocyaninato)germanium(IV) and Diiodo(phthalocyaninato)tin(IV)","Acta Crystallographica Section C","1997","53","8","1051","1054","10.1107/S0108270197004836","","","0.71073","MoKα","","0.0761","0.0376","","0.0916","0.0827","","","","1.055","1.165","1.165","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006416","7.618","0.002","8.551","0.002","11.602","0.002","73.34","0.03","77.2","0.03","87.05","0.03","706","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H16 I2 N8 Sn -","- C32 H16 I2 N8 Sn -","- C32 H16 I2 N8 Sn -","1","0.5","MU1316","Ejsmont, Krzysztof; Kubiak, Ryszard","Isostructural Complexes of Diiodo(phthalocyaninato)germanium(IV) and Diiodo(phthalocyaninato)tin(IV)","Acta Crystallographica Section C","1997","53","8","1051","1054","10.1107/S0108270197004836","","","0.71073","MoKα","","0.0436","0.03","","0.0789","0.074","","","","1.039","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006417","16.382","0.0008","6.1648","0.0006","21.6676","0.0012","90","","104.835","0.003","90","","2115.3","0.3","220","2","220","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,3-Dihydro-3-phenyl-1H-isoindol-1-one","","- C14 H11 N O -","- C14 H11 N O -","- C112 H88 N8 O8 -","8","1","MU1321","McNab, Hamish; Parsons, Simon; Shannon, David A.","2,3-Dihydro-3-phenyl-1<i>H</i>-isoindol-1-one at 220K","Acta Crystallographica Section C","1997","53","8","1098","1099","10.1107/S0108270197004848","","","1.54184","CuKα","","0.0454","0.0348","","0.0944","0.0893","","","","1.048","1.129","1.129","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006418","6.36","0.001","19.272","0.002","12.604","0.002","90","","93.75","0.01","90","","1541.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N,N'-Diphenylguanidinium hydrogenselenite monohydrate","","- C13 H17 N3 O4 Se -","- C13 H17 N3 O4 Se -","- C52 H68 N12 O16 Se4 -","4","1","NA1285","Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; de Matos Gomes, E.; Martín-Gil, J.; Martín-Gil, F.J.","<i>N</i>,<i>N</i>'-Diphenylguanidinium Hydrogenselenite Monohydrate","Acta Crystallographica Section C","1997","53","8","1113","1115","10.1107/S0108270197004472","","","0.71073","MoKα","","0.1156","0.0305","","0.0813","0.062","","","","1.06","1.083","1.083","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006419","11.12","0.002","18.28","0.002","7.917","0.002","90","","98.23","0.02","90","","1592.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","11-(2-chloro-2-propenyl)-5,11-dihydroxy-2-methylanthra[1,2-b]furan-6(11H)-one","","- C20 H15 Cl O4 -","- C20 H15 Cl O4 -","- C80 H60 Cl4 O16 -","4","1","NA1287","Cambie, Richard C.; Milbank, Jared B. J.; Rickard, Clifton E. F.; Rutledge, P. Stewart","11-(2-Chloro-2-propenyl)-5,11-dihydroxy-2-methylanthra[1,2-<i>b</i>]furan-6(11<i>H</i>)-one","Acta Crystallographica Section C","1997","53","8","1102","1103","10.1107/S0108270197004289","","","0.71069","MoKα","","0.1177","0.0678","","0.237","0.182","","","","1.017","1.099","1.099","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006420","14.394","0.003","5.33","0.002","10.962","0.003","90","","99.88","0.02","90","","828.5","0.4","292","1","19","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- C4 H10 O6 Zn -","- C4 H10 O6 Zn -","- C16 H40 O24 Zn4 -","4","0.5","OA1020","Ishioka, Tsutomu; Murata, Asami; Kitagawa, Yasuyuki; Nakamura, Kazuo T.","Zinc(II) Acetate Dihydrate","Acta Crystallographica Section C","1997","53","8","1029","1031","10.1107/S0108270197004484","","","1.5418","CuKα","","","0.06","","","0.118","","","","","2.28","2.28","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006421","6.454","0.002","12.752","0.004","15.387","0.005","90","","90","","90","","1266.4","0.7","108","2","","","","","","","","","","3","I b a m","-I 2 2c","72","","","","- Cs2 Mn3 Te4 -","- Cs2 Mn3 Te4 -","- Cs8 Mn12 Te16 -","4","0.25","OH1099","Wu, Eric J.; Ibers, James A.","Cs~2~Mn~3~Te~4~","Acta Crystallographica Section C","1997","53","8","993","994","10.1107/S010827019700098X","","","0.71073","MoKα","","","0.0339","","","0.0815","","","","","1.266","1.266","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006422","34.25","0.003","9.134","0.001","13.819","0.001","90","","112.7","0.1","90","","3988","3","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H31 N5 O2 -","- C19 H30 N5 O1.5 -","- C152 H240 N40 O12 -","8","1","PT1043","Gunasekaran, K.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Rajendran, T. M.; Kandaswamy, M.","4-Hydroxy-2,6-bis[(4-methylpiperazinyl)methyl]benzonitrile Monohydrate","Acta Crystallographica Section C","1997","53","8","1116","1117","10.1107/S010827019700214X","","","1.5418","CuKα","","","0.06","","","0.082","","","","","0.878","0.878","","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2006423","4.093","0.001","11.438","0.002","12.365","0.002","90","","90.73","0.03","90","","578.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H14 N8 O4 -","- C6 H14 N8 O4 -","- C12 H28 N16 O8 -","2","0.5","QA0006","Kolev, Tsonko; .; Glavcheva, Zornitza; .; Stahl, Rainer; .; Preut, Hans; .; Bleckmann, Paul; .; Radomirska, Valentina; .","Aminoguanidinium Squarate","Acta Crystallographica Section C","1997","53","8","IUC9700010","","10.1107/S0108270197099460","","","0.56086","AgKα","","0.0559","0.034","","0.0924","0.0819","","","","1.033","1.097","1.097","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006424","12.015","0.003","9.8464","0.0015","14.912","0.002","90","","90","","90","","1764.2","0.6","294","1","294","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-Thia-5,11-dioxatricyclo[6.2.1.0^3.8^]undec-9-en-4,4-dione","","- C8 H10 O4 S -","- C8 H10 O4 S -","- C64 H80 O32 S8 -","8","1","QA0008","Ferguson, George; Schwan, Adrian L.; Kalin, Mark L.; Snelgrove, Jennifer L.","5,11-Dioxa-4-thiatricyclo[6.2.1.0^3,8^]undec-9-ene 4,4-Dioxide","Acta Crystallographica Section C","1997","53","8","IUC9700009","","10.1107/S0108270197099472","","","0.7107","MolybdenumKα","","0.1175","0.052","","","0.1128","0.129","","","","","","0.958","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006425","8.533","0.001","12.044","0.001","13.67","0.003","91.85","0.01","92.11","0.01","100.93","0.01","1377.4","0.4","218","","218","","","","","","","","","2","P -1","-P 1","2","","","","- C16 H24 -","- C16 H24 -","- C64 H96 -","4","2","SK1013","Irngartinger, Hermann; Strack, Stefan; Gleiter, Rolf; Brand, Stefan","Octamethylcuneane and Octamethylcubane: the First X-ray Crystal Structure of a Cuneane","Acta Crystallographica Section C","1997","53","8","1145","1148","10.1107/S0108270197003740","","","0.71073","MoKα","","0.128","0.048","","","0.117","","","","","2.446","2.446","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2006426","8.562","0.001","8.562","","16.833","0.001","90","","90","","120","","1068.67","0.14","238","","238","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- C16 H24 -","- C16 H24 -","- C48 H72 -","3","0.0833333","SK1013","Irngartinger, Hermann; Strack, Stefan; Gleiter, Rolf; Brand, Stefan","Octamethylcuneane and Octamethylcubane: the First X-ray Crystal Structure of a Cuneane","Acta Crystallographica Section C","1997","53","8","1145","1148","10.1107/S0108270197003740","","","0.71073","MoKα","","0.0512","0.037","","0.093","0.088","","","","1.011","1.12","1.12","","","","","has coordinates","198519","2020-10-21","18:00:00",""
"2006427","9.3767","0.0014","10.6508","0.0008","15.825","0.002","90","","90","","90","","1580.4","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","methyl 2-O-α-D-mannopyranosyl-β-D-glucopyranoside.","","- C13 H24 O11 -","- C13 H24 O11 -","- C52 H96 O44 -","4","1","SK1034","Eriksson, Lars; Stenutz, Roland; Widmalm, Gőran","Methyl 2-<i>O</i>-α-<small>D</small>-Mannopyranosyl-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section C","1997","53","8","1105","1107","10.1107/S0108270197004769","","","1.54184","CuKα","","0.036","0.0329","","0.0801","","","","","1.05","1.05","1.05","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006428","29.608","0.002","23.6935","0.0009","11.8195","0.0005","90","","90","","90","","8291.6","0.7","298","2","298","2","","","","","","","","5","C m c a","-C 2ac 2","64","","Tetramethylammonium Bis(coumarin-3-carboxylato)triphenylstannate Ethanol Solvate","","- C44 H43 N O9 Sn -","- C44 H44 N O9 Sn -","- C352 H352 N8 O72 Sn8 -","8","","SK1052","Ng, Seik Weng; Kumar Das, V.G.","Tetramethylammonium Bis(coumarin-3-carboxylato)triphenylstannate Ethanol Solvate","Acta Crystallographica Section C","1997","53","8","1034","1036","10.1107/S0108270197004307","","","0.71073","MoKα","","0.0625","0.0355","","0.0991","0.089","","","","0.997","1.125","1.125","","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"2006429","9.349","0.002","11.853","0.003","13.548","0.004","77.92","0.02","69.7","0.02","68.38","0.02","1303.3","0.6","294","","294","","","","","","","","","5","P -1","-P 1","2","","[7,8,17,18-tetracyano-5,10,15,20-tetraphenylporphyrinato]-bis(pyridine) nickel(II)","","- C60 H42 N10 Ni O2 -","- C60 H42 N10 Ni O2 -","- C60 H42 N10 Ni O2 -","1","0.5","SK1059","Duval, Hugues; Bulach, Véronique; Fischer, Jean; Weiss, Raymond","Bis(pyridine-<i>N</i>)(7,8,17,18-tetracyano-5,10,15,20-tetraphenylporphyrinato)nickel(II) Dimethanol Solvate","Acta Crystallographica Section C","1997","53","8","1027","1029","10.1107/S0108270197003995","","","0.71073","MoKα","","0.059","0.049","","","0.074","","","","","1.651","1.651","","","","","has coordinates","194546","2020-10-21","18:00:00",""
"2006430","15.7566","0.0009","15.9146","0.0009","9.5363","0.0007","90","","106.854","0.005","90","","2288.6","0.3","200","2","200","2","","","","","","","","5","C 1 2 1","C 2y","5","Carbazole-barium-pentakis(THF)-THF","","","- C48 H64 Ba N2 O6 -","- C48 H64 Ba N2 O6 -","- C96 H128 Ba2 N4 O12 -","2","0.5","SK1064","Näther, Christian; Hauck, Tim; Bock, Hans","Pentakis(tetrahydrofuran)barium Bis(carbazolate) Tetrahydrofuran Solvate","Acta Crystallographica Section C","1997","53","8","1061","1063","10.1107/S0108270197003363","","","0.71073","MoKα","","0.0233","0.0233","","0.0564","0.0564","","","","1.148","1.147","1.147","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006431","4.934","0.002","7.422","0.001","48.561","0.001","90","0.01","90","0.02","90","0.02","1778.3","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Dodecanoyl-L-Serine","","- C15 H31 N O5 -","- C15 H31 N O5 -","- C60 H124 N4 O20 -","4","1","SK1078","Schade, Boris; Fuhrhop, Jürgen-Hinrich; Hubert, Vera; Weber, Manuela; Luger, Peter","Hydrogen-Bonding Networks Involving Water in Amphiphilic <i>N</i>-Dodecanoyl-<small>L</small>-serine Monohydrate","Acta Crystallographica Section C","1997","53","8","1070","1073","10.1107/S0108270197004903","","","1.5418","Ni-filteredCuKα","","0.0558","0.0336","","0.0883","0.0787","","","","1.091","1.097","1.097","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006432","10.3727","0.0008","16.812","0.002","9.496","0.005","90","","92.585","0.014","90","","1654.3","0.9","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Authors naming system: catena-poly[{diaqua(furancarboxylato-O,O')lanthanum-bis-μ-furancarboxylato- O, O':O;O:O,O'-diaqua(furancarboxylato-O,O')lanthanum}-μ-furancarboxylato- O:O';O:O']","","- C15 H13 La O11 -","- C15 H9 La O11 -","- C60 H36 La4 O44 -","4","1","SK1088","Li, Xia; Chen, Xue-An; Zhao, Ling; Chen, Ben-Ming","<i>catena</i>-Diaquatris(α-furancarboxylato)lanthanum(III)","Acta Crystallographica Section C","1997","53","8","1015","1017","10.1107/S0108270197004022","","","0.71073","MoKα","","","0.0373","","","0.0997","","","","","1.149","1.149","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006433","10.0301","0.0006","11.7403","0.0007","11.766","0.0007","95.559","0.005","90.617","0.005","97.323","0.005","1367.38","0.14","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","1-(1-Cyanocyclohexyl)-1-hydroxy-3-phenylurea","","- C14 H17 N3 O2 -","- C14 H17 N3 O2 -","- C56 H68 N12 O8 -","4","2","SK1102","Frydenvang, Karla; Larsen, Ingrid Kjøller","1-(1-Cyanocyclohexyl)-1-hydroxy-3-phenylurea","Acta Crystallographica Section C","1997","53","8","1091","1093","10.1107/S0108270197004617","","","1.54184","CuKα","","0.0703","0.04","","0.1171","","0.1048","","","0.973","","","1.075","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006434","7.393","0.001","8.827","0.002","19.907","0.003","90","","90","","90","","1299.1","0.4","122","2","122","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)(R)-5,5-Dimethylmorpholinyl-2-Acetic Acid Ethyl Ester Hydrochloride","","- C10 H20 Cl N O3 -","- C10 H20 Cl N O3 -","- C40 H80 Cl4 N4 O12 -","4","1","SK1104","Frydenvang, Karla; Enna, Sam J.; Krogsgaard-Larsen, Povl","({-})-(<i>R</i>)-5,5-Dimethylmorpholinyl-2-acetic Acid Ethyl Ester Hydrochloride, C~10~H~20~NO~3~^+^.Cl^{-^}","Acta Crystallographica Section C","1997","53","8","1088","1091","10.1107/S0108270197004290","","","1.5418","CuKα","","0.0276","0.027","","0.0758","","0.0752","","","1.082","","","1.087","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006435","7.529","0.002","13.278","0.002","20.457","0.003","90","","92.14","0.02","90","","2043.7","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H52 Cl4 Cu2 N4 O4 -","- C40 H52 Cl4 Cu2 N4 O4 -","- C80 H104 Cl8 Cu4 N8 O8 -","2","0.5","TA1126","Ahn, Tae-Ho; Lee, Sueg-Geun; Kim, Jeong; Kim, Si-Joong; Suh, Il-Hwan","Di-μ-chloro-bis[chloro(6,7,8,9,10,11,18,19-octahydro-5<i>H</i>,17<i>H</i>-dibenzo[<i>f</i>,<i>o</i>][1,5,9,13]dioxadiazacyclohexadecane)copper(II)]","Acta Crystallographica Section C","1997","53","8","1020","1022","10.1107/S0108270197004496","","","0.71069","MoKα","","0.0724","0.0495","","0.0996","0.0893","","","","1.062","1.103","1.103","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006436","7.0337","0.0002","8.3981","0.0002","37.9873","0.0011","90","","90","","90","","2243.9","0.11","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","estrone-3-glucuronide","17-oxoestra-1,3,5(10)-triene-3-yl-b-D-glucopyranosiduronic acid hydrate","","- C24 H32 O9 -","- C24 H29 O9 -","- C96 H116 O36 -","4","1","TA1138","C. Mark Smales; Leonard F. Blackwell; Joyce M. Waters; Anthony K. Burrell","An Estrone‒Glucuronide Conjugate","Acta Crystallographica Section C","1997","53","8","1082","1084","10.1107/S0108270197004629","","","0.71073","MoKα","","0.0636","0.0513","","0.133","0.1135","","","","1.132","1.156","1.156","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006437","8.364","0.002","12.684","0.003","12.224","0.002","90","","92.36","0.03","90","","1295.7","0.5","294","","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","S-methyl-(-N-(dimethylaminophenyl)-methylenedithiocarbazate","","","- C11 H15 N3 S2 -","- C11 H15 N3 S2 -","- C44 H60 N12 S8 -","4","1","TA1150","Cun-Yuan Zhao; Chun-Ying Duan; Yu-Peng Tian; Xiao-Zeng You; Thomas C. W. Mak","<i>S</i>-Methyl β-<i>N</i>-[4-(Dimethylamino)benzylidene]dithiocarbazate","Acta Crystallographica Section C","1997","53","8","1151","1153","10.1107/S0108270197004691","","","0.71073","MoKα","","0.0561","0.0789","","0.0803","0.0852","","","","1.08","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006438","9.28","0.05","9.83","0.04","15.24","0.1","90","","93.24","0.1","90","","1388","13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 O2 S -","- C16 H14 O2 S -","- C64 H56 O8 S4 -","4","1","VJ1051","Sriram, D.; Srinivasan, S.; Santhosh, K.C.; Balasubramanian, K.K.","6-Methyl-3-phenylthiochroman-4-one and 6-Methoxy-3-phenylthiochroman-4-one: Configurational Preference of the Phenylthio Group at the Third Position due to Remote Substitution","Acta Crystallographica Section C","1997","53","8","1073","1075","10.1107/S010827019700396X","","","0.71073","MoKα","","0.0608","0.0491","","0.1305","0.1225","","","","1.08","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006439","13.113","0.004","15.26","0.006","6.762","0.005","90","","92.36","0.04","90","","1352","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 O3 S -","- C16 H14 O3 S -","- C64 H56 O12 S4 -","4","1","VJ1051","Sriram, D.; Srinivasan, S.; Santhosh, K.C.; Balasubramanian, K.K.","6-Methyl-3-phenylthiochroman-4-one and 6-Methoxy-3-phenylthiochroman-4-one: Configurational Preference of the Phenylthio Group at the Third Position due to Remote Substitution","Acta Crystallographica Section C","1997","53","8","1073","1075","10.1107/S010827019700396X","","","0.71073","MoKα","","0.059","0.0474","","0.1306","0.1214","","","","1.058","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006440","7.8642","0.0013","9.423","0.004","14.008","0.004","90","","90","","90","","1038.1","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H15 N O6 -","- C8 H15 N O6 -","- C32 H60 N4 O24 -","4","1","VJ1056","Sriram, D.; Sreenivasan, H.; Srinivasan, S.; Priya, K.; Vishnu Thirtha, M.; Loganathan, D.","β-1-<i>N</i>-Acetamido-<small>D</small>-glucopyranose","Acta Crystallographica Section C","1997","53","8","1075","1077","10.1107/S0108270197003600","","","0.71073","MoKα","","0.0446","0.0328","","0.076","0.0697","","","","1.111","1.128","1.128","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006441","7.596","0.002","22.882","0.011","9.311","0.002","90","","110.18","0.02","90","","1519","0.9","298","","298","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","trans-decahydroquinoline","N-Nitroso-3,3-dimethyl-2-phenyldecahydroquinolin-4-one","","- C17 H22 N2 O2 -","- C17 H22 N2 O2 -","- C68 H88 N8 O8 -","4","1","VJ1058","A.Thiruvalluvar; V.Parthasarathi; D.Natarajan; N.Bhavani; Mohan Bhadbhade","3,3-Dimethyl-<i>N</i>-nitroso-2-phenyldecahydroquinolin-4-one","Acta Crystallographica Section C","1997","53","8","1086","1088","10.1107/S0108270197004770","","","1.5418","CuKα","","0.0722","0.0587","","0.1681","0.1588","","","","1.076","1.148","1.148","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006442","9.4077","0.0012","10.1752","0.001","12.5542","0.0013","71.698","0.009","86.98","0.009","77.019","0.01","1111.6","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1,4-Methano-1,4,4a,9a-Tetrahydroanthracene-9,10-Dione","","- C15 H12 O2 -","- C15 H12 O2 -","- C60 H48 O8 -","4","2","AB1411","Günes̨, Bilal; Soylu, Hüseyin; Özbey, Süheyla; Kendi, Engin; Aydın, Ali","The 4:2 Diels‒Alder Adduct of 1,3-Cyclopentadiene with 1,4-Naphthoquinone","Acta Crystallographica Section C","1997","53","9","1301","1302","10.1107/S0108270197005830","","","0.71073","MoKα","","","0.0624","","0.1292","","","","","1.481","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006443","9.951","0.002","10.877","0.002","11.156","0.002","68.2","0.02","66.68","0.02","88.39","0.02","1019.5","0.4","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H30 Cu N2 O3 -","- C21 H30 Cu N2 O3 -","- C42 H60 Cu2 N4 O6 -","2","1","AB1436","Hsueh-Hua Yao; Bor-Hann Chen; Jem-Mau Lo; Fen-Ling Liao","The Dimeric Complex {2,2'-[2,2-Dimethyl-1,3-propanediylbis(aminomethyl)]diphenolato-<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>'}copper(II) Ethanol Solvate","Acta Crystallographica Section C","1997","53","9","1222","1224","10.1107/S0108270197093980","","","0.71073","MoKα","","","0.0378","","","0.0475","","","","","1.47","1.47","","","","","has coordinates","208357","2020-10-21","18:00:00",""
"2006444","11.081","0.003","15.147","0.008","15.668","0.008","90","","96.14","0.03","90","","2615","2","203","","203","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","anti-2,5-di(isopropyl)phenyldi(1-tricyclo[3.3.1.1^3,7^]decyl)methanol","","- C33 H48 O -","- C33 H48 O -","- C132 H192 O4 -","4","1","AB1450","Vaissermann, Jacqueline; Lomas, John S.","A Highly Strained Tertiary Alcohol: <i>anti</i>-Di(1-adamantyl)[2,5-di(isopropyl)phenyl]methanol","Acta Crystallographica Section C","1997","53","9","1341","1343","10.1107/S010827019700629X","","","0.71069","MoKα","","","0.0875","","","","0.0892","","","","","","1.1414","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006445","13.228","0.003","12.805","0.002","16.817","0.006","90","","119.35","0.02","90","","2482.9","1.2","288","2","288","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 N2 O3 S2 -","- C26 H26 N2 O3 S2 -","- C104 H104 N8 O12 S8 -","4","1","AB1451","Park, Koon Ha; Kang, Jin Soo; Oh, Mi-Ran; Suh, Il-Hwan","4,4'-Bis(acetylamino)-2,2'-di(2-thienyl)biphenyl‒Ethanol (1/1)","Acta Crystallographica Section C","1997","53","9","1320","1322","10.1107/S0108270197006306","","","0.71069","MoKα","","0.1478","0.05","","0.1214","0.0881","","","","0.737","1.041","1.041","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006446","8.1949","0.0008","13.754","0.0007","11.35","0.002","90.22","0.007","93.333","0.009","90.082","0.007","1277.1","0.3","294","1","294","1","","","","","","","","3","P -1","-P 1","2","","4,12,16,24-Tetrahydroxycalix[4]arene Methanol Solvate (1:2)","","- C30 H32 O6 -","- C30 H32 O6 -","- C60 H64 O12 -","2","1","AB1469","Böhmer, Volker; Ferguson, George; Frings, Michael","4,12,16,24-Tetrahydroxycalix[4]arene‒Methanol (1/2)","Acta Crystallographica Section C","1997","53","9","1293","1295","10.1107/S0108270197003703","","","0.7107","MolybdenumKα","","0.1032","0.0465","","0.1493","","0.133","","","0.957","","","1.19","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006447","5.9564","0.0008","7.883","0.0003","23.293","0.0003","90","","97.18","0.01","90","","1085.13","0.15","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","CpCo(dmit)","(4,5-disulfanyl-1,3-dithiole-2-thionato)(η-cyclopentadienyl)cobalt(III)","","- C8 H5 Co S5 -","- C8 H5 Co S5 -","- C32 H20 Co4 S20 -","4","1","AB1475","Fourmigué, Marc; Perrocheau, Vincent","Two Heteroleptic Cobalt(III) Cyclopentadienyl/Dithiolene Complexes","Acta Crystallographica Section C","1997","53","9","1213","1215","10.1107/S0108270197005544","","","0.71073","MoKα","","0.0758","0.0316","","0.0864","0.0733","","","","1.075","1.106","1.106","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006448","12.14","0.002","11.488","0.002","12.698","0.003","90","","110.91","0.02","90","","1654.3","0.6","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Cp^*^Co(dmit)","(4,5-disulfanyl-1,3-dithiole-2-thionato)(η-pentamethylcyclopentadienyl) cobalt(III)","","- C13 H15 Co S5 -","- C13 H15 Co S5 -","- C52 H60 Co4 S20 -","4","1","AB1475","Fourmigué, Marc; Perrocheau, Vincent","Two Heteroleptic Cobalt(III) Cyclopentadienyl/Dithiolene Complexes","Acta Crystallographica Section C","1997","53","9","1213","1215","10.1107/S0108270197005544","","","0.71073","MoKα","","0.09","0.05","","0.064","0.055","","","","1.11","1.193","1.193","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006449","9.678","0.008","10.701","0.009","7.28","0.006","90.15","0.05","104.32","0.05","71.59","0.05","690.8","1","294","","294","","","","","","","","","5","P -1","-P 1","2","","bis(8-aminoquinoline)dichlorodimethyltin(IV)","","- C11 H14 Cl2 N2 Sn -","- C11 H14 Cl2 N2 Sn -","- C22 H28 Cl4 N4 Sn2 -","2","1","AB1483","Alan Hazell; Kar Fong Thong; Jiexiang Ouyang; Lian Ee Khoo","(8-Aminoquinoline-<i>N</i>,<i>N</i>')dichlorodimethyltin(IV)","Acta Crystallographica Section C","1997","53","9","1226","1228","10.1107/S0108270197006331","","","0.71073","MoKα","","","0.055","","","0.066","","","","","1.671","1.671","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2006450","12.108","0.002","12.155","0.002","18.884","0.004","104.37","0.03","100.67","0.03","100.8","0.03","2565","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","[Mo(CO)(dpepp)(dppm)] (dppm = Ph~2~PCH~2~PPh~2~, dpepp = Ph~2~PCH~2~CH~2~P(Ph)CH~2~CH~2~PPh~2~)","carbonyl[bis[2-(diphenylphosphino)ethyl)]phenylphosphine- P,P',P''][methylenebis(diphenylphosphino)- P,P']molybdenum(0)","","- C60 H55 Mo O P5 -","- C60 H55 Mo O P5 -","- C120 H110 Mo2 O2 P10 -","2","1","BK1241","George, T. Adrian; DeBord, Jeffrey R. D.; Heier, Kevin; Tisdale, Robert C.; Davies, Marcia C.; Haas, Eric J.; Ross II, Charles R.; Stezowski, John J.","[Mo(C~25~H~22~P~2~)(C~34~H~33~P~3~)(CO)]","Acta Crystallographica Section C","1997","53","9","1251","1254","10.1107/S0108270196015806","","","0.71073","MoKα","","0.0821","0.051","","0.134","0.116","","","","1.02","1.05","1.05","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006451","8.903","0.003","14.911","0.004","19.778","0.004","90","","98.337","0.002","90","","2597.8","1.2","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","triphenylphosphine oxide.di-isopropyl azodicarboxylate","triphenylphosphine oxide . di-isopropyl azodicarboxylate adduct","","- C26 H31 N2 O5 P -","- C26 H31 N2 O5 P -","- C104 H124 N8 O20 P4 -","4","1","BK1276","Héroux, A.; Brisse, F.","Diisopropyl Hydrazocarboxylate‒Triphenylphosphine Oxide Adduct","Acta Crystallographica Section C","1997","53","9","1318","1320","10.1107/S0108270197005489","","","1.54018","CopperKα","","0.05","0.047","","0.056","0.056","","","","","4.22","4.22","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006452","11.5","0.004","7.97","0.002","16.521","0.003","90","","103.06","0.02","90","","1475.1","0.7","153.2","","153.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 Cu F4 N2 O4 W -","- C10 H10 Cu0.67 F4.02 N2 O3.98 W0.67 -","- C40 H40 Cu2.68 F16.08 N8 O15.92 W2.68 -","4","1","BK1279","Halasyamani, Shiv; Heier, Kevin R.; Stern, Charlotte L.; Poeppelmeier, Kenneth R.","CuW(py)~2~(H~2~ O)~2~O~2~F~4~ and CuW(py)~4~O~2~F~4~","Acta Crystallographica Section C","1997","53","9","1240","1244","10.1107/S0108270197005490","","","0.7107","MoKα","","","0.04","","","0.047","","","","","3.41","3.41","","","","","has coordinates","176342","2020-10-21","18:00:00",""
"2006453","10.45","0.002","13.396","0.003","16.067","0.007","90","","97.33","0.02","90","","2230.8","1.2","153.2","","153.2","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H20 Cu F4 N4 O2 W -","- C20 H20 Cu F4.02 N4 O1.98 W -","- C80 H80 Cu4 F16.08 N16 O7.92 W4 -","4","0.5","BK1279","Halasyamani, Shiv; Heier, Kevin R.; Stern, Charlotte L.; Poeppelmeier, Kenneth R.","CuW(py)~2~(H~2~ O)~2~O~2~F~4~ and CuW(py)~4~O~2~F~4~","Acta Crystallographica Section C","1997","53","9","1240","1244","10.1107/S0108270197005490","","","0.7107","MoKα","","","0.038","","","0.05","","","","","4.45","4.45","","","","","has coordinates","176342","2020-10-21","18:00:00",""
"2006454","10.396","0.001","14.468","0.002","12.155","0.002","90","","112.53","0.01","90","","1688.7","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis(2,2,6,6-tetramethyl-piperidinyl-1-oxy-O)bis(1,1,1,5,5,5- hexafluoroacetylacetonato-O,O"")cobalt(II)","","- C28 H38 Co F12 N2 O6 -","- C28 H38 Co F12 N2 O6 -","- C56 H76 Co2 F24 N4 O12 -","2","0.5","BK1320","Dickman, Michael H.","Bis(1,1,1,5,5,5-hexafluoroacetylacetonato-<i>O</i>,<i>O</i>')bis(2,2,6,6-tetramethylpiperidinyl-1-oxy-<i>O</i>)cobalt(II)","Acta Crystallographica Section C","1997","53","9","1192","1195","10.1107/S0108270197005945","","","0.71073","MoKα","","0.0711","0.044","","0.112","0.0989","","","","1.03","1.089","1.089","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006455","6.9122","0.0006","13.1517","0.0011","7.8098","0.0007","90","","93.324","0.001","90","","708.77","0.11","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","4-iodobenzaldehyde","","- C7 H5 I O -","- C7 H5 I O -","- C28 H20 I4 O4 -","4","2","BK1329","Britton, Doyle; Young Jr, Victor G.","<i>p</i>-Iodobenzaldehyde","Acta Crystallographica Section C","1997","53","9","1359","1362","10.1107/S0108270197006288","","","0.71073","MoKα","","0.025","0.025","","0.0672","0.0671","","","","1.09","1.085","1.085","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006456","11.217","0.001","8.1008","0.0003","14.4403","0.0008","90","","104.34","0.01","90","","1271.26","0.15","297","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","1,8-Dichloro-9,10-dihydro-9,10-ethenoanthracene","","- C16 H10 Cl2 -","- C16 H10 Cl2 -","- C64 H40 Cl8 -","4","1","BK1334","Benites, Maria del Rosario; Maverick, Andrew W.; Fronczek, Frank R.","1,8-Dichloro-9,10-dihydro-9,10-ethenoanthracene","Acta Crystallographica Section C","1997","53","9","1334","1335","10.1107/S0108270197006355","","","1.54184","Cu-Kα","","","0.039","","","","0.059","","","","","","2.301","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006457","10.58","0.002","5.034","0.002","25.762","0.002","90","","91.56","0.01","90","","1371.6","0.6","296","","296","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","4-(3-phenanthryl)butanoic acid","","","- C18 H16 O2 -","- C18 H16 O2 -","- C72 H64 O8 -","4","1","BK1335","Gerkin, Roger E.","4-(3-Phenanthryl)butanoic Acid","Acta Crystallographica Section C","1997","53","9","1275","1278","10.1107/S0108270197006367","","","0.71073","MoKα","","","0.062","","","","0.115","","","","","","1.24","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006458","10.77","0.002","10.045","0.002","16.499","0.004","90","","105.07","0.02","90","","1723.6","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6a,7-dihydro-2,6-dimethyl-7-phenyl- 6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a] pyrimidine-6a-ol","","- C20 H18 N4 O2 -","- C20 H18 N4 O2 -","- C80 H72 N16 O8 -","4","1","BM1134","Kovalevsky, A. Yu.; Chebanov, V. A.; Desenko, S. M.; Komykhov, S. A.; Orlov, V. D.; Shishkin, O. V.; Meier, H.","6a,7-Dihydro-2,6-dimethyl-7-phenyl-6<i>H</i>-chromeno[4,3-<i>d</i>]-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-6a-ol","Acta Crystallographica Section C","1997","53","9","1356","1357","10.1107/S0108270197003569","","","0.71073","MoKα","","0.091","0.043","","0.201","0.108","","","","1.152","1.149","1.149","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006459","25.76","0.004","8.159","0.0018","27.156","0.004","90","","116.257","0.012","90","","5118.6","1.7","160","2","160","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C7 H4 As Cl F6 N2 S2 -","- C7 H4 As Cl F6 N2 S2 -","- C112 H64 As16 Cl16 F96 N32 S32 -","16","4","BM1156","Clegg, William; Elsegood, Mark R.J.; Banister, Arthur J.; Hibbert, Thomas G.","5-(<i>o</i>-Chlorophenyl)-1,3-dithia-2,4-diazolylium Hexafluoroarsenate","Acta Crystallographica Section C","1997","53","9","1208","1211","10.1107/S0108270197009165","","","0.71073","MoKα","","0.0646","0.0413","","0.1154","0.1001","","","","1.075","1.091","1.091","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006460","9.827","0.004","9.827","0.004","31.658","0.006","90","","90","","120","","2647.6","1.6","295","2","295","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- Br4 Re6 Se7 -","- Br4 Re6 Se7 -","- Br24 Re36 Se42 -","6","0.166667","BR1146","Pinheiro, Carlos Basílio; Speziali, Nivaldo Lúcio; Berger, Helmut","Re~6~Se~7~Br~4~","Acta Crystallographica Section C","1997","53","9","1178","1180","10.1107/S0108270197004666","","","0.56083","AgKα","","","0.026","","","0.037","","","","","3.304","3.304","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006461","14.067","0.001","8.163","0.002","8.161","0.002","90","","90","","90","","937.1","0.3","293","","","","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Cs F5 Tb -","- Cs F5 Tb -","- Cs8 F40 Tb8 -","8","","BR1167","Gaumet, Vincent; Avignant, Daniel","Caesium Pentafluoroterbate, CsTbF~5~","Acta Crystallographica Section C","1997","53","9","1176","1178","10.1107/S0108270197005556","","","0.71073","MoKα","","","0.026","","","0.028","","","","","1.339","1.339","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006462","7.848","0.002","19.867","0.004","10.773","0.003","90","","90","","90","","1679.7","0.7","293","2","293","2","","","","","","","","5","C m c a","-C 2ac 2","64","hydrated strontium iron (III) fluoride","","","- F10 Fe2 H2 O Sr2 -","- F10 Fe2 H2 O Sr2 -","- F80 Fe16 H16 O8 Sr16 -","8","0.5","","Jean-Marc Le Meins; Annie Hemon-Ribaud; Georges Courbion","Sr~2~Fe~2~F~10~.H~2~O, the First Hydrated Strontium Iron(III) Fluoride","Acta Crystallographica Section C","1997","53","","1165","1166","","","","","","","","0.0321","","","0.0683","","","","","","","","","","","has coordinates","191889","2020-10-21","18:00:00",""
"2006463","5.1636","0.001","8.0324","0.001","14.8009","0.0002","95.796","0.001","90.315","0.001","108.078","0.001","580.16","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","cesium trizinc phosphate bis(hydrogenphosphate)","","- Cs H2 O12 P3 Zn3 -","- Cs O12 P3 Zn3 -","- Cs2 O24 P6 Zn6 -","2","1","BR1177","Pingyun Feng; Xianhui Bu; Galen D. Stucky","A Caesium Zinc Phosphate Constructed from Ladder-Like Four-Ring Chains","Acta Crystallographica Section C","1997","53","9","1170","1173","10.1107/S0108270197004423","","","0.71073","MoKα","","0.0479","0.0384","","0.11","0.0904","","","","0.988","0.909","0.909","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006464","14.636","0.002","15.185","0.003","17.928","0.002","90","","90","","90","","3984.5","1.1","293","","293","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","{2,6-bis[(4R,5R)-1,3-dimethyl-4,5-diphenylimidazolidin- 2-yl]pyridine-N^1^,N,N^1^'}chloro-copper(II) hexafluorophosphate methanol solvate","","- C39.5 H43 Cl Cu F6 N5 O0.5 P -","- C39.5 H43 Cl Cu F6 N5 O0.5 P -","- C158 H172 Cl4 Cu4 F24 N20 O2 P4 -","4","1","CF1153","Bohnen, Frank M.; Goddard, Richard; Minidis, Alexander B. E.; Alexakis, Alexandre; Pfaltz, Andreas","A Copper(II) Complex of a New Chiral Tridentate Imidazoline Ligand","Acta Crystallographica Section C","1997","53","9","1236","1238","10.1107/S0108270197003673","","","0.71069","MoKα","","0.196","0.059","","","0.139","0.179","","","","","","1.007","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006465","12.201","0.002","12.8625","0.0014","18.571","0.002","90","","90","","90","","2914.4","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Isoalangidiol monoacetate","(3α,18α)-B':A'-Neogammacerane-3,18-diol","","- C32 H54 O3 -","- C32 H54 O3 -","- C128 H216 O12 -","4","1","DE1038","Bhattacharyya, Kinkini; Chaudhuri, Siddhartha; Achari, Basudeb; Mazumdar, Biswanath; Mazumdar, Sunil Kumar","Isoalangidiol Monoacetate, a Triterpene Alcohol","Acta Crystallographica Section C","1997","53","9","1299","1301","10.1107/S0108270196014126","","","0.71073","MoKα","","0.0655","0.0525","","0.1575","0.1353","","","","0.981","1.05","1.05","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006466","18.033","0.009","14.019","0.009","8.973","0.005","90","","90","","90","","2268","2","293","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","α-(4‒Hydroxy phenyl)-N-Phenyl nitrone","N-(p-Hydroxy Benzylidene)phenylamine N-oxide","","- C13 H11 N O2 -","- C13 H11 N O2 -","- C104 H88 N8 O16 -","8","1","DE1054","Vijayalakshmi, L.; Parthasarathi, V.; Manishanker, P.","<i>N</i>-(<i>p</i>-Hydroxybenzylidene)phenylamine <i>N</i>-Oxide","Acta Crystallographica Section C","1997","53","9","1343","1344","10.1107/S010827019700560X","","","0.7071","MoKα","","0.146","0.035","","0.115","0.079","","","","0.972","1.043","1.043","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006469","8.619","0.001","13.983","0.001","7.344","0.001","94.17","0.01","68.69","0.01","102.14","0.01","806.13","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Sodium 1,6-diammoniumhexane cyclotriphosphate dihydrate","","- C6 H22 N2 Na O11 P3 -","- C6 H22 N2 Na O11 P3 -","- C12 H44 N4 Na2 O22 P6 -","2","1","DU1172","Thabet, Hédi; Jouini, Amor","Sodium 1,6-Hexanediammonium Cyclotriphosphate Dihydrate","Acta Crystallographica Section C","1997","53","9","1182","1184","10.1107/S0108270197005623","","","0.71069","MoKα","","0.0357","0.0259","","0.0754","0.0696","","","","1.05","1.066","1.066","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006470","22.822","0.003","7.667","0.001","14.697","0.001","90","","106.31","0.01","90","","2468.1","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-benzoyl-2-methylindole","","- C16 H13 N O -","- C16 H13 N O -","- C128 H104 N8 O8 -","8","1","FG1244","M. Paz Martinez-Alcazar; Isabel Fonseca; Felix H. Cano; J. Gonzalo Rodriguez; Anahi Urrutia","3-Benzoyl-2-methylindole","Acta Crystallographica Section C","1997","53","9","1345","1347","10.1107/S0108270197005180","","","1.5418","CuKα","","0.0701","0.0644","","0.1547","0.1503","","","","1.13","1.203","1.203","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006471","11.38","0.002","11.541","0.002","17.111","0.003","104.95","0.02","98.2","0.02","91.1","0.02","2145.3","0.7","295","2","295","2","","","","","","","","5","P -1","-P 1","2","Triphenylsilyl(pentacarbonyl)manganese(I)","","","- C23 H15 Mn O5 Si -","- C23 H15 Mn O5 Si -","- C92 H60 Mn4 O20 Si4 -","4","2","FG1256","Anne-Marie Lebuis; Dharamdat Christendat; Denis F. R. Gilson; Ian S. Butler","Pentacarbonyl(triphenylsilyl)manganese(I)","Acta Crystallographica Section C","1997","53","9","1206","1208","10.1107/S0108270197005192","","","0.7107","MoKα","","0.1542","0.069","","0.1078","0.0863","","","","0.918","1.054","1.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006472","13.847","0.003","9.232","0.002","14.681","0.003","90","","108.57","0.03","90","","1779","0.7","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","bis(triphenylphosphinesulfide-S)gold(I) difluorophosphate(V)","","- C36 H30 Au F2 O2 P3 S2 -","- C36 H30 Au F2.024 O2.024 P3 S2 -","- C72 H60 Au2 F4.048 O4.048 P6 S4 -","2","0.5","FG1269","LeBlanc, Daren J.; Britten, James F.; Lock, Colin J.L.","Bis(triphenylphosphine sulfide-<i>S</i>)gold(I) Difluorophosphate(V)","Acta Crystallographica Section C","1997","53","9","1204","1206","10.1107/S0108270197005209","","","0.56086","AgKα","","0.0728","0.0496","","0.1164","0.1095","","","","0.912","1.025","1.025","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006473","15.266","0.002","16.262","0.003","14.1071","0.0015","90","","90","","90","","3502.2","0.9","294","","294","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C24 H18 O2 -","- C24 H18 O2 -","- C192 H144 O16 -","8","1","FG1285","Jones, Ray; Rattray, A. Graham M.; Scheffer, John R.; Trotter, James","Methyl 8c-Phenyl-4b,8b,8c,8d-tetrahydrodibenzo[<i>a</i>,<i>f</i>]cyclopropa[<i>cd</i>]pentalene-8b-carboxylate","Acta Crystallographica Section C","1997","53","9","1262","1263","10.1107/S0108270197005258","","","1.5418","CuKα","","0.0569","0.0406","","","","0.1178","","","","","","2.22","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006474","8.766","0.002","17.885","0.002","12.612","0.002","90","","103.661","0.011","90","","1921.4","0.6","294","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 N2 O2 -","- C23 H24 N2 O2 -","- C92 H96 N8 O8 -","4","1","FG1286","Jones, Ray; Rattray, A. Graham M.; Scheffer, John R.; Trotter, James","<i>N</i>,<i>N</i>-Diethyl-<i>N</i>'-methyl-4b,8b,8c,8d-tetrahydrodibenzo[<i>a</i>,<i>f</i>]cyclopropa[<i>cd</i>]pentalene-8b,8c-dicarboxamide","Acta Crystallographica Section C","1997","53","9","1263","1265","10.1107/S010827019700526X","","","1.5418","CuKα","","0.072","0.043","","","","0.119","","","","","","1.78","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006475","7.4058","0.0009","8.7129","0.001","6.0114","0.0006","94.915","0.01","102.386","0.01","114.847","0.008","336.96","0.07","296","","296","","","","","","","","","4","P -1","-P 1","2","2-bromosenecioic acid","2-bromo-3-methyl-2-butenoic acid","","- C5 H7 Br O2 -","- C5 H7 Br O2 -","- C10 H14 Br2 O4 -","2","1","FG1293","Gerkin, Roger E.","2-Bromo-3-methyl-2-butenoic Acid (2-Bromosenecioic Acid)","Acta Crystallographica Section C","1997","53","9","1278","1280","10.1107/S0108270197005647","","","0.71073","MoKα","","","0.043","","","","0.029","","","","","","1.81","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006476","19.604","0.002","9.7659","0.0012","17.8787","0.0018","90","","105.524","0.008","90","","3298","0.6","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,13-Dithia[3]metacyclo[3](2,3)-naphthalenophane","","- C20 H18 S2 -","- C20 H18 S2 -","- C160 H144 S16 -","8","1","FG1295","Jones, Peter G.; Kuś, Piotr","2,13-Dithia[3]metacyclo[3](2,3)naphthalenophane and 2,13-Dithia[3]metacyclo[3](1,7)naphthalenophane","Acta Crystallographica Section C","1997","53","9","1307","1310","10.1107/S0108270197003946","","","0.71073","MoKα","","0.0476","0.0354","","0.0976","0.0934","","","","1.025","1.119","1.119","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006477","8.846","0.002","13.178","0.003","13.876","0.003","90","","101.28","0.02","90","","1586.3","0.6","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,13-Dithia[3]metacyclo[3](1,7)-naphthalenophane","","- C20 H18 S2 -","- C20 H18 S2 -","- C80 H72 S8 -","4","1","FG1295","Jones, Peter G.; Kuś, Piotr","2,13-Dithia[3]metacyclo[3](2,3)naphthalenophane and 2,13-Dithia[3]metacyclo[3](1,7)naphthalenophane","Acta Crystallographica Section C","1997","53","9","1307","1310","10.1107/S0108270197003946","","","0.71073","MoKα","","0.09","0.0513","","0.1273","0.1147","","","","0.921","1.064","1.064","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006478","20.12","0.004","13.075","0.004","6.149","0.004","90","","90","","90","","1617.6","1.2","294","","294","","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C18 H26 O -","- C18 H26 O -","- C72 H104 O4 -","4","1","FG1298","Fu, Tai Y.; Leibovitch, Mordechai; Scheffer, John R.; Trotter, James","(<i>Z</i>)-1-Benzoyl-4-<i>tert</i>-butyl-1-methylcyclohexane and (<i>Z</i>)-4-<i>tert</i>-Butyl-1-methyl-1-thiobenzoylcyclohexane","Acta Crystallographica Section C","1997","53","9","1255","1256","10.1107/S0108270197005283","","","1.5418","CuKα","","0.0627","0.0368","","","","0.1104","","","","","","1.12","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006479","12.853","0.001","32.252","0.003","7.945","0.001","90","","90","","90","","3293.5","0.6","294","","294","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C18 H26 S -","- C18 H26 S -","- C144 H208 S8 -","8","1","FG1298","Fu, Tai Y.; Leibovitch, Mordechai; Scheffer, John R.; Trotter, James","(<i>Z</i>)-1-Benzoyl-4-<i>tert</i>-butyl-1-methylcyclohexane and (<i>Z</i>)-4-<i>tert</i>-Butyl-1-methyl-1-thiobenzoylcyclohexane","Acta Crystallographica Section C","1997","53","9","1255","1256","10.1107/S0108270197005283","","","1.5418","CuKα","","0.0641","0.0472","","","","0.1189","","","","","","2.36","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006480","23.91","0.003","5.492","0.004","16.831","0.003","90","","112.208","0.012","90","","2046.2","1.6","200","1","200","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Diethyl-bis-thiophenyl propenoato tin complex","","","- C18 H20 O4 S2 Sn -","- C18 H20 O4 S2 Sn -","- C72 H80 O16 S8 Sn4 -","4","0.5","FG1299","Parvez, Masood; Ali, Saqib; Masood, Tariq M.; Mazhar, Muhammad; Danish, Muhammad","Diethylbis[3-(2-thienyl)-2-propenoato-<i>O</i>,<i>O</i>']tin(IV)","Acta Crystallographica Section C","1997","53","9","1211","1213","10.1107/S0108270197005210","","","0.71069","MoKα","","0.0582","0.0334","","0.211","0.0839","","","","1.215","1.204","1.204","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006481","11.65","0.003","8.53","0.007","26.837","0.003","90","","97.6","0.01","90","","2643","2","294","","294","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H37 N O5 -","- C28 H37 N O5 -","- C112 H148 N4 O20 -","4","2","FG1301","Fu, Tai Y.; Scheffer, John R.; Trotter, James","4-[2,4,6-Tris(1-methylethyl)benzoyl]benzoic Acid (<i>S</i>)-({-})-Proline","Acta Crystallographica Section C","1997","53","9","1259","1262","10.1107/S0108270197005295","","","1.5418","CuKα","","0.089","0.053","","","","0.149","","","","","","1.66","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006482","12.9397","0.0012","4.9019","0.0004","23.18","0.0003","90","","90.703","0.009","90","","1470.18","0.18","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,6,7-Trimethyl-3-(2'-pyridine)-3,4-dihydro-4-oxoquinazoline-8-carboxylic Acid","","- C17 H15 N3 O3 -","- C17 H15 N3 O3 -","- C68 H60 N12 O12 -","4","1","FG1307","Kubicki, Maciej; Szkaradzińska, Maria B.; Codding, Penelope W.","3,4-Dihydro-2,6,7-trimethyl-4-oxo-3-(2-pyridyl)quinazoline-8-carboxylic Acid","Acta Crystallographica Section C","1997","53","9","1291","1293","10.1107/S0108270197005659","","","1.54178","CuKα","","0.0934","0.0534","","0.1949","0.1214","","","","1.307","0.993","0.993","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006483","9.751","0.001","12.133","0.0002","13.9205","0.0009","90","","105.654","0.008","90","","1585.8","0.2","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H26 O2 -","- C18 H26 O2 -","- C72 H104 O8 -","4","1","FG1311","Caracelli, I.; Iulek, J.; Neves, Ademir; Vencato, Ivo; Silva Jr, F.; Brocksom, Timothy John; Zukerman-Schpector, J.","Intermediates in the Synthesis of Cembrane Diterpenes. I","Acta Crystallographica Section C","1997","53","9","1282","1284","10.1107/S0108270197005325","","","0.71073","MoKα","","0.1147","0.0574","","0.1824","0.1378","","","","1.1","1.101","1.101","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006484","12.038","0.002","5.506","0.001","13.087","0.001","90","","94.576","0.009","90","","864.7","0.2","208","","208","","","","","","","","","3","P 1 21 1","P 2yb","4","(+)-trans-2-phenylcyclopropanecarboxylic acid","(+)-trans-(1S,2S)-2-phenylcyclopropanecarboxylic acid","","- C10 H10 O2 -","- C10 H10 O2 -","- C40 H40 O8 -","4","2","FG1312","Gerkin, Roger E.","Hydrogen Bonding and Ring Asymmetry in a Substituted Cyclopropane: (+)-<i>trans</i>-(1<i>S</i>,2<i>S</i>)-2-Phenylcyclopropanecarboxylic Acid at 208K","Acta Crystallographica Section C","1997","53","9","1280","1282","10.1107/S0108270197005660","","","0.71073","MoKα","","","0.058","","","","0.068","","","","","","1.6","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006485","10.5549","0.001","14.3979","0.0014","18.135","0.0002","96.474","0.008","90.053","0.006","96.379","0.008","2721.2","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H54 Cl13 O4 P3 -","- C45 H54 Cl13 O4 P3 -","- C90 H108 Cl26 O8 P6 -","2","1","FG1315","Thönnessen, Holger; Jones, Peter G.; Schmutzler, Reinhard; Gloede, Jörg","An Unusual Calix[4]arene Derivative Containing Phosphorus with Coordination Numbers 4, 5 and 6","Acta Crystallographica Section C","1997","53","9","1310","1312","10.1107/S0108270197004721","","","0.71073","MoKα","","0.0835","0.0575","","0.1818","0.1587","","","","1.049","1.172","1.172","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006486","9.218","0.002","16.055","0.004","13.804","0.002","90","","94.89","0.02","90","","2035.5","0.7","294","","294","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H28 S -","- C22 H28 S -","- C88 H112 S4 -","4","1","FG1319","Fu, Tai Y.; Scheffer, John R.; Trotter, James","Phenyl[2,4,6-tris(1-methylethyl)phenyl]methanethione and 4-Methoxyphenyl[2,4,6-tris(1-methylethyl)phenyl]methanethione","Acta Crystallographica Section C","1997","53","9","1257","1259","10.1107/S0108270197005246","","","0.7107","MoKα","","","0.0513","","","","0.1553","","","","","","1.31","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006487","11.336","0.001","13.136","0.002","14.24","0.002","90","","96.667","0.009","90","","2106.1","0.5","294","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H30 O S -","- C23 H30 O S -","- C92 H120 O4 S4 -","4","1","FG1319","Fu, Tai Y.; Scheffer, John R.; Trotter, James","Phenyl[2,4,6-tris(1-methylethyl)phenyl]methanethione and 4-Methoxyphenyl[2,4,6-tris(1-methylethyl)phenyl]methanethione","Acta Crystallographica Section C","1997","53","9","1257","1259","10.1107/S0108270197005246","","","1.5418","CuKα","","","0.0472","","","","0.1445","","","","","","2.03","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006488","7.8306","0.0008","10.0242","0.0008","9.5404","0.0012","90","","92.282","0.01","90","","748.28","0.14","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N-chlorodimesylamine","","- C2 H6 Cl N O4 S2 -","- C2 H6 Cl N O4 S2 -","- C8 H24 Cl4 N4 O16 S8 -","4","1","FG1321","Moers, Oliver; Blaschette, Armand; Jones, Peter G.","Polysulfonylamines. LXXXV. <i>N</i>-Chlorodimesylamine","Acta Crystallographica Section C","1997","53","9","1305","1307","10.1107/S0108270197005301","","","0.71073","MoKα","","0.0222","0.0207","","0.0555","0.0549","","","","1.07","1.09","1.09","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006489","16.84","0.004","10.859","0.003","10.039","0.002","90","","90","","90","","1835.8","0.8","178","2","178","2","","","","","","","","5","C m c 21","C 2c -2","36","","(Acetonitrilo)(η^5^-1,3-di-t-butylcyclopentadienyl)trichloromolybdenum(IV)","","- C15 H24 Cl3 Mo N -","- C15 H24 Cl3 Mo N -","- C60 H96 Cl12 Mo4 N4 -","4","0.5","FG1323","Scheer, Manfred; Jones, Peter G.","(Acetonitrile-<i>N</i>)trichloro(η^5^-1,3-di-<i>tert</i>-butylcyclopentadienyl)molybdenum(IV)","Acta Crystallographica Section C","1997","53","9","1198","1199","10.1107/S0108270197005313","","","0.71073","MoKα","","0.0176","0.0173","","0.0435","0.0433","","","","1.123","1.127","1.127","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006490","6.0389","0.0004","32.772","0.003","7.3695","0.0008","90","","97.75","0.008","90","","1445.2","0.2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Silver(I) Di(4-fluorobenzenesulfonyl)amide Monohydrate","","- C12 H10 Ag F2 N O5 S2 -","- C12 H10 Ag F2 N O5 S2 -","- C48 H40 Ag4 F8 N4 O20 S8 -","4","1","FG1325","Weitze, Achim; Blaschette, Armand; Jones, Peter G.","Polysulfonylamines. LXXXVI. Silver(I) Bis(4-fluorobenzenesulfonyl)amide Monohydrate","Acta Crystallographica Section C","1997","53","9","1195","1197","10.1107/S0108270197005672","","","0.71073","MoKα","","0.0382","0.0274","","0.0661","0.0628","","","","1.045","1.113","1.113","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006491","9.941","0.002","12.084","0.003","14.001","0.003","90","","110.14","0.02","90","","1579.1","0.6","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis[1-(β-naphthyliminomethyl)-2-naphtholato-N,O]nickel(II)","","- C42 H28 N2 Ni O2 -","- C42 H28 N2 Ni O2 -","- C84 H56 N4 Ni2 O4 -","2","0.5","FG1334","Gavranić, Marijana; Kaitner, Branko; Meštrović, Ernest","Bis[<i>N</i>-(β-naphthyl)-2-oxy-1-naphthaldiminato]nickel(II)","Acta Crystallographica Section C","1997","53","9","1232","1234","10.1107/S0108270197007038","","","0.71069","MolybdenumKα","","","0.034","","","0.054","","","","","1.05","1.05","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006492","11.697","0.006","12.788","0.007","14.138","0.007","99.72","0.04","100.14","0.04","109.04","0.03","1908.8","1.8","143","2","143","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H41 N5 O7 -","- C45 H41 N5 O7 -","- C90 H82 N10 O14 -","2","1","FG1339","Johannes, Hans-Hermann; Grahn, Walter; Dix, Ina; Jones, Peter G.","1,3,3-Trimethyl-5-styryl-2-[(1,3,3-trimethyl-5-styryl-2-indolinylidene)methyl]-3<i>H</i>-indolinium Picrate: an Extended Trichromophoric System","Acta Crystallographica Section C","1997","53","9","1363","1366","10.1107/S0108270197007609","","","0.71073","MoKα","","0.158","0.071","","0.145","0.11","","","","1.041","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006493","7.946","0.002","7.19","0.003","13.593","0.002","90","","94.58","0.01","90","","774.1","0.4","296","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H6 N2 O2 -","- C9 H6 N2 O2 -","- C36 H24 N8 O8 -","4","1","FR1032","Okabe, Nobuo; Akita, Mayumi","5-Hydroxyimino-8-quinolone","Acta Crystallographica Section C","1997","53","9","1324","1325","10.1107/S0108270197006227","","","0.71069","MoKα","","","0.063","","","0.058","","","","","1.46","1.46","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2006494","7.6381","0.0002","8.0844","0.0001","12.5955","0.0004","99.042","0.001","93.042","0.002","92.225","0.002","766.14","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H18 Cl N3 O4 -","- C14 H18 Cl N3 O4 -","- C28 H36 Cl2 N6 O8 -","2","1","FR1045","Abboud, Khalil A.; Ortiz, Carlos G.; Palenik, Ruth C.; Palenik, Gus J.","2-[1-(Salicyloylhydrazono)ethyl]pyridinium Chloride Dihydrate at 173K","Acta Crystallographica Section C","1997","53","9","1322","1323","10.1107/S0108270197004745","","","0.71073","MoKα","","0.043","0.036","","0.108","0.09","","","","1.094","1.092","1.092","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006495","19.824","0.002","5.373","0.002","21.638","0.001","90","","113.308","0.006","90","","2116.7","0.8","296","","296","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","phenanthrene-9-carboxylic acid","phenanthrene-9-carboxylic acid","","- C15 H10 O2 -","- C15 H10 O2 -","- C120 H80 O16 -","8","1","FR1046","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Phenanthrene-9-carboxylic Acid","Acta Crystallographica Section C","1997","53","9","1265","1267","10.1107/S0108270197005787","","","0.71073","MoKα","","","0.044","","","","0.048","","","","","","1.64","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006496","11.497","0.002","12.507","0.002","11.789","0.002","90","","101.64","0.02","90","","1660.3","0.5","296","","296","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","benzophenone-3,3',4,4'-tetracarboxylic acid dihydrate","","","- C17 H14 O11 -","- C17 H14 O11 -","- C68 H56 O44 -","4","1","FR1049","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Benzophenone-3,3',4,4'-tetracarboxylic Acid Dihydrate","Acta Crystallographica Section C","1997","53","9","1267","1270","10.1107/S0108270197006069","","","0.71073","MoKα","","","0.054","","","","0.049","","","","","","1.49","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006497","6.686","0.003","11.304","0.009","6.399","0.002","95.46","0.04","113.56","0.03","83.54","0.05","439.8","0.4","293","","293","","","","","","","","","5","P -1","-P 1","2","","4,4-dimethyl-5-iodo-2-oxazineone","","- C6 H10 I N O2 -","- C6 H9 I N O2 -","- C12 H18 I2 N2 O4 -","2","1","FR1050","Mague, Joel T.; Ensley, Harry E.; Ling, Jing","Intermediates for the Convenient Synthesis of Bicyclic Aziridinocarbamates","Acta Crystallographica Section C","1997","53","9","1347","1350","10.1107/S0108270197006070","","","0.71073","MoKα","","0.08","0.064","","","0.082","","","","","2.216","2.216","","","","","has coordinates","278247","2022-09-28","15:09:31",""
"2006498","6.165","0.0009","6.762","0.001","11.761","0.001","102.81","0.01","90.09","0.01","117.05","0.01","422.82","0.11","293","","293","","","","","","","","","5","P -1","-P 1","2","","1-methyl-1-(1-iodoethyl)-2-oxazolidinone","","- C6 H10 I N O2 -","- C6 H10 I N O2 -","- C12 H20 I2 N2 O4 -","2","1","FR1050","Mague, Joel T.; Ensley, Harry E.; Ling, Jing","Intermediates for the Convenient Synthesis of Bicyclic Aziridinocarbamates","Acta Crystallographica Section C","1997","53","9","1347","1350","10.1107/S0108270197006070","","","0.71073","MoKα","","0.032","0.025","","","0.037","","","","","1.39","1.39","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2006499","42.768","0.009","11.338","0.002","10.123","0.001","90","","102.16","0.01","90","","4798.5","1.4","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-iodo-6-(n-pentyl)-2-oxazineone","","- C9 H16 I N O2 -","- C9 H16 I N O2 -","- C144 H256 I16 N16 O32 -","16","2","FR1050","Mague, Joel T.; Ensley, Harry E.; Ling, Jing","Intermediates for the Convenient Synthesis of Bicyclic Aziridinocarbamates","Acta Crystallographica Section C","1997","53","9","1347","1350","10.1107/S0108270197006070","","","0.71073","MoKα","","0.086","0.039","","","0.05","","","","","1.86","1.86","","","","","has coordinates,has Fobs","208362","2020-10-21","18:00:00",""
"2006500","9.07","0.001","9.734","0.001","9.779","0.002","117.86","0.01","112.16","0.01","92.36","0.01","681.5","0.2","300","2","300","2","","","","","","","","6","P -1","-P 1","2","","Tetrakis(3-picoline)palladium(II) chloride trihydrate","","- C24 H32 Cl2 N4 O2 Pd -","- C24 H36 Cl2 N4 O2 Pd -","- C24 H36 Cl2 N4 O2 Pd -","1","0.5","JZ1170","Chen, Wei; Liu, Cai-ming; Xiong, Ren-gen; You, Xiao-zeng","4:1 Lewis Base Adducts of Palladium Dichloride: [Pd(3-picoline)~4~]Cl~2~.2H~2~O","Acta Crystallographica Section C","1997","53","9","1218","1220","10.1107/S0108270197002576","","","0.71073","MoKα","","0.032","0.032","","0.083","0.083","","","","1.109","1.113","1.113","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006501","13.869","0.001","12.606","0.002","19.699","0.005","90","","96.94","0.01","90","","3418.8","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Carbonylchloro[2-(diphenylphosphanyl)thiophenolato-P,S]hydridotriphenyl phosphaneiridium(III)-Dichloromethane-(4:1)-Solvate","","- C37.25 H30.5 Cl1.5 Ir O P2 S -","- C37.25 H30.5 Cl1.5 Ir O P2 S -","- C149 H122 Cl6 Ir4 O4 P8 S4 -","4","1","JZ1186","Dahlenburg, Lutz","Carbonylchloro[2-(diphenylphosphino)thiophenolato-<i>P</i>,<i>S</i>]hydrido(triphenylphosphine-<i>P</i>)iridium(III)‒Dichloromethane Solvate (4/1)","Acta Crystallographica Section C","1997","53","9","1190","1192","10.1107/S0108270197005167","","","0.7107","MoKα","","0.0846","0.0555","","0.1672","0.1462","","","","1.068","1.123","1.123","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006502","14.4318","0.0014","10.2646","0.001","17.997","0.002","90","","103.689","0.001","90","","2590.3","0.5","123","2","123","2","","","","","","","","6","P 1 n 1","P -2yac","7","","(±)-tert-Butyl 3-Hydroxy-4-methyl-2-[(toluolsulfonyl)amino]butanoate","","- C23 H31 Cl2 N O5 S -","- C23 H31 Cl2 N O5 S -","- C92 H124 Cl8 N4 O20 S4 -","4","2","JZ1189","Görbitz, Carl Henrik; Kazmaier, Uli; Grandel, Roland","(±)-<i>tert</i>-Butyl 3-Hydroxy-4-phenyl-2-(<i>p</i>-toluenesulfonylamino)pentanoate‒Dichloromethane (1/1): a Pseudo Centre of Symmetry in an Enantiomeric Pair","Acta Crystallographica Section C","1997","53","9","1302","1305","10.1107/S0108270197006033","","","0.71073","MoKα","","0.0466","0.0412","","0.0982","0.0937","","","","1.086","1.08","1.08","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2006503","7.875","0.003","24.756","0.01","14.582","0.006","90","","104.26","0.03","90","","2755.2","1.9","126","2","126","2","","","","","","","","3","P 1 21 1","P 2yb","4","compound (1)","13^1^-Deoxo-17-depropionic acid-17-propionyl-phytochlorin","","- C33 H40 N4 -","- C33 H40 N4 -","- C132 H160 N16 -","4","2","JZ1193","Senge, Mathias O.; Smith, Kevin M.","Structure and Conformation of Photosynthetic Pigments and Related Compounds. 10. Comparison of a Phytochlorin and Phytoporphyrin Derived from Chlorophyll <i>a</i>","Acta Crystallographica Section C","1997","53","9","1314","1318","10.1107/S0108270197003648","","","0.71073","MoKα","","0.0824","0.0576","","0.1397","0.1257","","","","1.022","1.069","1.069","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006504","9.703","0.003","11.906","0.002","13.685","0.003","99.11","0.02","107.84","0.02","106.67","0.02","1388.1","0.7","126","2","126","2","","","","","","","","4","P -1","-P 1","2","compound (2)","Phytoporphyrin methyl ester","","- C34 H36 N4 O3 -","- C34 H36 N4 O3 -","- C68 H72 N8 O6 -","2","1","JZ1193","Senge, Mathias O.; Smith, Kevin M.","Structure and Conformation of Photosynthetic Pigments and Related Compounds. 10. Comparison of a Phytochlorin and Phytoporphyrin Derived from Chlorophyll <i>a</i>","Acta Crystallographica Section C","1997","53","9","1314","1318","10.1107/S0108270197003648","","","0.71073","MoKα","","0.0909","0.0654","","0.1985","0.1742","","","","1.037","1.075","1.075","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006505","12.724","0.0004","6.703","0.0005","16.8484","0.0013","90","","90","","90","","1436.98","0.16","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Monomeric (Pyrazine)(N-salicylideneaminoisobutyrato)copper(II)","","- C15 H15 Cu N3 O3 -","- C15 H15 Cu N3 O3 -","- C60 H60 Cu4 N12 O12 -","4","0.5","JZ1198","Warda, Salam A.","Monomeric (Pyrazine-<i>N</i>)(<i>N</i>-salicylidene-α-amino-2-methylpropanoato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1997","53","9","1186","1188","10.1107/S010827019700543X","","","0.71073","MoKα","","0.0318","0.0263","","0.0814","0.0779","","","","1.087","1.118","1.118","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006506","16.2226","0.0013","17.8756","0.0015","19.0452","0.0018","90","","90","","90","","5522.9","0.8","150","2","150","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","1,2,4,5-Tetrakis(trimethylsilylmethyl)benzene","","- C22 H46 Si4 -","- C22 H46 Si4 -","- C176 H368 Si32 -","8","0.25","JZ1201","Nagel, Norbert; Ansari, Manssur; Bock, Hans","1,2,4,5-Tetrakis(trimethylsilylmethyl)benzene at 150K","Acta Crystallographica Section C","1997","53","9","1329","1331","10.1107/S0108270197005179","","","0.71073","MoKα","","0.0472","0.0356","","0.0927","0.0862","","","","1.089","1.119","1.119","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006507","9.534","0.002","10.486","0.002","10.486","0.002","109.05","0.01","92","0.01","110.64","0.01","913.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-bicyclo[2.2.1]hept-5-ene-2-exo,3-exo-dicarboxylato- κ^2^O,O':κ^2^O'',O''')bis[aqua(2,2'-bipyridine-N,N')manganese(II)] Monohydrate","","- C38 H38 Mn2 N4 O11 -","- C38 H38 Mn2 N4 O11 -","- C38 H38 Mn2 N4 O11 -","1","0.5","JZ1202","Baumeister, Ute; Hartung, Helmut","Bis(μ-bicyclo[2.2.1]hept-5-ene-2-<i>exo</i>,3-<i>exo</i>-dicarboxylato-κ^2^<i>O</i>,<i>O</i>':κ^2^<i>O</i>'',<i>O</i>''')bis[aqua(2,2'-bipyridine-<i>N</i>,<i>N</i>')manganese(II)] Monohydrate","Acta Crystallographica Section C","1997","53","9","1246","1248","10.1107/S0108270197004757","","","0.71073","MoKα","","0.0572","0.0316","","0.084","0.0768","","","","1.006","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006508","10.0033","0.0001","10.0382","0.0001","14.3045","0.0001","90.619","0.001","99.805","0.001","113.053","0.001","1297.61","0.02","140","","140","","","","","","","","","2","P -1","-P 1","2","","6,6-Diphenylfulvene","","- C18 H14 -","- C18 H14 -","- C72 H56 -","4","2","JZ1206","Bolte, Michael; Amon, Michael","6,6-Diphenylfulvene at 140K","Acta Crystallographica Section C","1997","53","9","1354","1356","10.1107/S0108270197005854","","","0.71073","MoKα","","0.0628","0.0417","","0.1017","0.0909","","","","1.03","1.062","1.062","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006509","25.524","0.008","15.174","0.005","10.978","0.003","90","","109.07","0.03","90","","4018","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetracarbonylbis[(2-methoxyphenyl)diphenylphosphane]tungsten-dichloromethane (4/1)","","- C42.25 H34.5 Cl0.5 O6 P2 W -","- C42.25 H34.5 Cl0.5 O6 P2 W -","- C169 H138 Cl2 O24 P8 W4 -","4","0.5","KA1228","Dahlenburg, Lutz; Herbst, Konrad; Knoch, Falk","Tetracarbonylbis[(2-methoxyphenyl)diphenylphosphine-<i>P</i>]tungsten Dichloromethane 0.25-Solvate","Acta Crystallographica Section C","1997","53","9","1188","1190","10.1107/S0108270197006136","","","0.71073","MoKα","","0.0454","0.0402","","0.1478","0.1453","","","","1.165","1.232","1.232","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006510","14.53","0.006","13.29","0.006","14.231","0.006","90","","110.31","0.03","90","","2577","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Tricyanomethanido)bis(2,2'-bipyridine)copper(II) Tricyanomethanide","","- C28 H16 Cu N10 -","- C28 H16 Cu N10 -","- C112 H64 Cu4 N40 -","4","1","KA1238","Potočňák, Ivan; Dunaj-Jurčo, Michal; Mikloš, Dušan; Jäger, Lothar","Bis(2,2'-bipyridine-<i>N</i>,<i>N</i>')(tricyanomethanido-<i>N</i>)copper(II) Tricyanomethanide","Acta Crystallographica Section C","1997","53","9","1215","1218","10.1107/S0108270197006161","","","0.71073","MoKα","","0.0936","0.036","","0.1153","0.0882","","","","0.662","0.744","0.744","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006511","17.427","0.002","10.021","0.005","28.639","0.003","90","","106.71","0.01","90","","4790","3","293","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C44 H46 Cu2 N4 P2 S6 W -","- C44 H46 Cu2 N4 P2 S6 W -","- C176 H184 Cu8 N16 P8 S24 W4 -","4","0.5","KH1106","Wang, Quanming; Wu, Xintao; Huang, Qun; Sheng, Tianlu","A Linear Cluster with Mixed Ligands, [WCu~2~S~4~(tpt)~2~(PPh~3~)~2~]","Acta Crystallographica Section C","1997","53","9","1220","1221","10.1107/S0108270196014710","","","0.71069","MoKα","","","0.0368","","","0.0374","","","","","1.04","1.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006512","18.214","0.005","7.416","0.002","12.037","0.003","90","","108.49","0.02","90","","1542","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Phenyl-5-(2-naphthyl)-1,2,4-trioxolane-3-carbonitrile","","- C19 H13 N O3 -","- C19 H13 N O3 -","- C76 H52 N4 O12 -","4","1","KH1149","Kunsoo Lee; Taesung Huh; Hoseop Yun","The Stereochemical Assignment of the Ozonide 5-(2-Naphthyl)-3-phenyl-1,2,4-trioxolane-3-carbonitrile","Acta Crystallographica Section C","1997","53","9","1325","1327","10.1107/S010827019700646X","","","0.7107","MoKα","","0.0763","0.0719","","0.2119","0.2069","","","","1.053","1.085","1.085","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006513","8.6351","0.0008","15.6177","0.001","8.8929","0.0015","90","","115.486","0.008","90","","1082.6","0.2","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H26 N4 O8 -","- C18 H26 N4 O8 -","- C36 H52 N8 O16 -","2","0.5","LN1002","Lo, Jem-Mau; Yao, Hsueh-Hua; Lu, Tian-Huey","<i>N</i>,<i>N</i>'-Bis(2-hydroxybenzyl)-1,4-butanediammonium Dinitrate","Acta Crystallographica Section C","1997","53","9","1327","1329","10.1107/S0108270197005878","","","0.7107","MolybdenumKα","","0.043","0.042","","0.049","0.048","","","","","1.21","1.21","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006514","6.231","0.001","9.447","0.001","9.394","0.001","90","","92.32","0.01","90","","552.52","0.12","205","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Bis(trichlorosilyl)ethane","1,1,1,4,4,4-Hexachloro-1,4-disilabutane","","- C2 H4 Cl6 Si2 -","- C2 H4 Cl6 Si2 -","- C4 H8 Cl12 Si4 -","2","0.5","LN1006","Mitzel, Norbert W.; Riede, Jürgen; Schmidbaur, Hubert","1,1,1,4,4,4-Hexachloro-1,4-disilabutane","Acta Crystallographica Section C","1997","53","9","1335","1337","10.1107/S0108270197005866","","","0.71069","MoKα","","0.0232","0.019","","0.0619","0.05","","","","1.12","1.145","1.145","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006515","7.802","0.002","13.221","0.003","7.142","0.001","90","","91.24","0.03","90","","736.5","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","dimethylammonium trichloropalladate","","- C2 H8 Cl3 N Pd -","- C2 H8 Cl3 N Pd -","- C8 H32 Cl12 N4 Pd4 -","4","0.5","MU1264","Eric S. Raper; Maria Kubiak; Tadeusz Głowiak","Dimethylammonium Trichloropalladate","Acta Crystallographica Section C","1997","53","9","1201","1204","10.1107/S010827019700379X","","","0.71069","MoKα","","0.0336","0.0267","","0.0673","0.0652","","","","1.192","1.257","1.257","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006516","5.751","0.002","7.718","0.003","12.469","0.004","90","","102.76","0.03","90","","539.8","0.3","85","2","85","2","","","","","","","","5","P 1 21 1","P 2yb","4","","calcium D-3-phoshoglycerate tetrahydrate","","- C3 H13 Ca O11 P -","- C3 H13 Ca O11 P -","- C6 H26 Ca2 O22 P2 -","2","1","MU1266","Jerzykiewicz, Lucjan B.; Lis, T.","Calcium <small>D</small>-3-Phosphoglycerate Tetrahydrate at 85K","Acta Crystallographica Section C","1997","53","9","1249","1251","10.1107/S0108270197005143","","","0.71069","MoKα","","0.0285","0.0227","","0.0567","0.055","","","","1.076","1.078","1.078","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006517","13.339","0.004","5.48","0.002","18.208","0.005","90","","93.73","0.02","90","","1328.1","0.7","292","","292","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(2-Pyridyl)urea","","- C6 H7 N3 O -","- C6 H7 N3 O -","- C48 H56 N24 O8 -","8","1","MU1272","Velichka Velikova; Olyana Angelova; Krassimir Kossev","<i>N</i>-(2-Pyridyl)urea","Acta Crystallographica Section C","1997","53","9","1273","1275","10.1107/S0108270197004782","","","0.71073","MoKα","","0.065","0.039","","0.075","0.053","","","","1.449","1.028","1.028","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2006518","5.215","0.001","9.167","0.003","10.597","0.004","74.61","0.03","84.65","0.02","86.42","0.05","485.9","0.3","292","","292","","","","","","","","","5","P -1","-P 1","2","","N-(2-pyridinium)urea perrhenate","","- C6 H8 N3 O5 Re -","- C6 H8 N3 O5 Re -","- C12 H16 N6 O10 Re2 -","2","1","MU1281","Velichka Velikova; Rosica Petrova; Olyana Angelova","<i>N</i>-(2-Pyridinium)urea Perrhenate","Acta Crystallographica Section C","1997","53","9","1230","1232","10.1107/S0108270197004794","","","0.71073","MoKα","","0.051","0.045","","0.115","0.081","","","","1.658","1.18","1.18","","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2006519","6.422","0.001","10.129","0.003","10.176","0.001","85.6","0.01","72.95","0.01","75.97","0.02","614","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Chloro(N-pyrrolidinecarbodithioato-S,S')dimethyltin(IV)","","- C7 H14 Cl N S2 Sn -","- C7 H14 Cl N S2 Sn -","- C14 H28 Cl2 N2 S4 Sn2 -","2","1","MU1288","Othman, Abdul Hamid; Fun, Hoong-Kun; M. Yamin, Bohari","Chlorodimethyl(<i>N</i>-pyrrolidinecarbodithioato-<i>S</i>,<i>S</i>')tin(IV)","Acta Crystallographica Section C","1997","53","9","1228","1230","10.1107/S0108270197004861","","","0.71073","MoKα","","0.0328","0.0317","","0.085","0.0842","","","","1.152","1.172","1.172","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006520","8.386","0.002","8.149","0.002","17.267","0.004","90","","99.04","0.04","90","","1165.3","0.5","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","1","MU1289","Kožíšek, Jozef; Ingrid Svoboda; Štefan Marchalín; Bernard Decroix","<i>cis</i>-6,10b,11,12-Tetrahydro-12-hydroxypyrrolo[1',2':2,3]pyridazino[6,1-<i>a</i>]isoindol-6-one","Acta Crystallographica Section C","1997","53","9","1362","1363","10.1107/S0108270197004800","","","0.71069","MoKα","","0.0364","0.0325","","0.0898","0.0843","","","","1.045","1.046","1.046","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006521","9.465","0.002","10.505","0.002","15.797","0.003","70.63","0.03","83.13","0.03","69.87","0.03","1391.2","0.6","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H42 N4 O6 -","- C26 H42 N4 O6 -","- C52 H84 N8 O12 -","2","1","MU1293","Lawrence C. Nathan; Michael E. Silver","A Hydrated Schiff Base Derivative of Bis(acetylacetone)ethylenediimine with 2-Pyridinylethyl Side Chains","Acta Crystallographica Section C","1997","53","9","1351","1354","10.1107/S0108270197005155","","","0.71073","MoKα","","0.1658","0.0666","","0.2253","0.1765","","","","0.984","1.273","1.273","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2006522","19.923","0.005","41.216","0.009","10.068","0.003","90","","90","","90","","8267","4","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","catena-poly[hexakis(acetonitrile)aluminium tri{[tetrachlorotellurate(IV)]μ-chloro}]-acetonitrile solvate,","","- C14 H21 Al Cl15 N7 Te3 -","- C14 H21.5 Al Cl15 N7 Te3 -","- C112 H172 Al8 Cl120 N56 Te24 -","8","1","MU1301","Favier, F.; Pascal, J. L.; Belin, C.; Tillard-Charbonnel, M.","A New Pentachlorotellurate(IV): <i>catena</i>-Poly[hexakis(acetonitrile)aluminium tris[tetrachlorotellurate(IV)-μ-chloro] acetonitrile]","Acta Crystallographica Section C","1997","53","9","1234","1236","10.1107/S0108270197004824","","","0.7107","MoKα","","0.0379","0.0375","","0.0812","0.0788","","","","1.013","1.013","1.013","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006523","20.239","0.005","10.911","0.002","15.197","0.006","90","","126.58","0.011","90","","2694.9","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-Chlorophenyl-2,6-dimethyl phenylsulphone","","- C14 H13 Cl O2 S -","- C14 H13 Cl O2 S -","- C112 H104 Cl8 O16 S8 -","8","1","MU1313","Jeyaraman, Jeyakanthan; Velmurugan, D.","4-Chlorophenyl 2,6-Dimethylphenyl Sulfone","Acta Crystallographica Section C","1997","53","9","1344","1345","10.1107/S0108270197005714","","","0.71069","MoKα","","0.0712","0.0513","","0.1532","0.1371","","","","1.056","1.118","1.118","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006524","8.389","0.001","8.58","0.001","8.934","0.001","90","","93.689","0.002","90","","641.72","0.13","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H12 N4 O4 -","- C13 H12 N4 O4 -","- C26 H24 N8 O8 -","2","1","NA1281","Cole, Jacqueline M.; Howard, Judith A. K.; MacBride, J. A. Hugh","3,5-Dinitro-2-{[(<i>R</i>)-({-})-1-phenylethyl]amino}pyridine","Acta Crystallographica Section C","1997","53","9","1331","1334","10.1107/S0108270197005507","","","0.71073","MoKα","","0.0549","0.0449","","0.1276","0.0971","","","","1.169","1.115","1.115","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006525","38.846","0.002","7.434","0.001","7.367","0.001","90","","90","","90","","2127.5","0.4","293","","293","","","","","","","","","5","P c a b","-P 2bc 2ac","61","","bis-(β-phenylethylammonium) tetrachlorocadmate","","- C16 H24 Cd Cl4 N2 -","- C16 H24 Cd Cl4 N2 -","- C64 H96 Cd4 Cl16 N8 -","4","0.5","NA1289","Monika Groh; Spengler, Roland; Burzlaff, Hans; Zouari, Fatma; Ben Salah, Abdelhamid","(C~6~H~5~CH~2~CH~2~NH~3~)~2~[CdCl~4~]","Acta Crystallographica Section C","1997","53","9","1199","1201","10.1107/S0108270197005726","","","0.70926","MoKα~1~","","","","","","0.039","","","","","0.95","0.95","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006526","11.507","0.002","7.399","0.001","15.802","0.002","90","","106.83","0.01","90","","1287.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2,4-difluorophenyl)-1H,3H-thiazolo[3,4-a]benzimidazole","","- C15 H10 F2 N2 S -","- C15 H10 F2 N2 S -","- C60 H40 F8 N8 S4 -","4","1","NA1293","Bruno, Giuseppe; Chimirri, Alba; Monforte, Anna Maria; Nicoló, Francesco; Scopelliti, Rosario","1-Aryl-1<i>H</i>,3<i>H</i>-thiazolo[3,4-<i>a</i>]benzimidazole Derivatives","Acta Crystallographica Section C","1997","53","9","1337","1341","10.1107/S0108270197004976","","","0.71073","MoKα","","0.0402","0.0332","","0.0897","0.0878","","","","1.077","1.16","1.16","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006527","7.74","0.002","13.03","0.005","14.694","0.005","83.3","0.03","79.2","0.03","76.72","0.03","1412.5","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(2,6-dichlorophenyl)-1H,3H-thiazolo[3,4-a]benzimidazole","","- C15 H10 Cl2 N2 S -","- C15 H10 Cl2 N2 S -","- C60 H40 Cl8 N8 S4 -","4","2","NA1293","Bruno, Giuseppe; Chimirri, Alba; Monforte, Anna Maria; Nicoló, Francesco; Scopelliti, Rosario","1-Aryl-1<i>H</i>,3<i>H</i>-thiazolo[3,4-<i>a</i>]benzimidazole Derivatives","Acta Crystallographica Section C","1997","53","9","1337","1341","10.1107/S0108270197004976","","","0.71073","MoKα","","0.0521","0.0381","","0.111","0.1062","","","","1.074","1.216","1.216","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006528","22.093","0.005","7.878","0.001","31.473","0.005","90","","100.28","0.03","90","","5389.9","1.7","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","1-(2-chloro-6-fluorophenyl)-1H,3H-thiazolo[3,4-a]benzimidazole","","- C15 H10 Cl F N2 S -","- C15 H10 Cl F N2 S -","- C240 H160 Cl16 F16 N32 S16 -","16","2","NA1293","Bruno, Giuseppe; Chimirri, Alba; Monforte, Anna Maria; Nicoló, Francesco; Scopelliti, Rosario","1-Aryl-1<i>H</i>,3<i>H</i>-thiazolo[3,4-<i>a</i>]benzimidazole Derivatives","Acta Crystallographica Section C","1997","53","9","1337","1341","10.1107/S0108270197004976","","","0.71073","MoKα","","0.1274","0.0769","","0.2136","0.1892","","","","0.905","1.149","1.149","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006529","7.643","0.003","6.509","0.002","24.14","0.001","90","","97.76","0.03","90","","1189.9","0.6","292","","292","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-amino-5-nitro-pyridine : 3-nitro-2-pyridone (1 : 1)","","- C10 H9 N5 O5 -","- C10 H9 N5 O5 -","- C40 H36 N20 O20 -","4","1","NA1296","Velikova, Velichka; Kossev, Krasimir; Angelova, Olyana","1:1 Molecular Complex of 2-Amino-5-nitropyridine and 3-Nitro-2-pyridone","Acta Crystallographica Section C","1997","53","9","1270","1273","10.1107/S0108270197005799","","","0.71073","MoKα","","0.0973","0.0424","","0.138","","0.1043","","","1.023","","","1.132","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006530","7.3706","0.0003","14.3273","0.0007","15.9318","0.0008","90","","90","","90","","1682.41","0.14","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)(4aS,6R,8aS)-4a,5,9,10,11,12-hexahydro-3-methoxy-11-methyl-6H-benzofuro [3a,3,2-ef] [2]benzazepin-6-ol hydrobromide","","- C17 H22 Br N O3 -","- C17 H22 Br N O3 -","- C68 H88 Br4 N4 O12 -","4","1","NA1303","Oswald M. Peeters; Norbert M. Blaton; Camiel J. De Ranter","({-})-Galanthaminium Bromide","Acta Crystallographica Section C","1997","53","9","1284","1286","10.1107/S0108270197006240","","","1.54184","CuKα","","0.0299","0.0295","","0.0811","","0.0811","","","1.044","","","1.044","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006531","13.177","0.002","18.645","0.003","21.8","0.003","90","","99.82","0.01","90","","5277.5","1.4","23","","296","","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","Dipotassium Trieuropium Trihydrogen Hexatitanooctadecatungstodigermanate","","- Eu3 Ge2 H77 K2 O114 Ti6 W18 -","- Eu3 Ge2 K2 O114 Ti6 W18 -","- Eu6 Ge4 K4 O228 Ti12 W36 -","2","0.5","OA1005","Sugeta, Moriyasu; Yamase, Toshihiro","A Tricapped Trigonal Prismatic EuO(H~2~O)~8~ Site in Trihydrogen Tris(octaaquaeuropium) Dipotassium Digermanohexatitanooctadecatungstate(14‒) Tridecahydrate","Acta Crystallographica Section C","1997","53","9","1166","1170","10.1107/S0108270197002941","","","0.7107","MoKα","","","0.066","","","0.057","","","","","2.3","2.3","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006532","6.979","0.001","15.649","0.002","12.515","0.002","90","","90","","90","","1366.8","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","carbonylchloro(η^5^-cyclopentadienyl)(1-ethoxybutylidene)ruthenium","","- C12 H17 Cl O2 Ru -","- C12 H17 Cl O2 Ru -","- C48 H68 Cl4 O8 Ru4 -","4","1","QB0009","Abboud, Khalil A.; Yin, Jianguo; Jones, William, M.","Carbonylchloro(η^5^-cyclopentadienyl)(1-ethoxybutylidene)ruthenium","Acta Crystallographica Section C","1997","53","9","IUC9700011","","10.1107/S0108270197099459","","","0.71073","MoKα","","0.0365","0.0262","","0.0545","0.0523","","","","1.012","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006533","11.184","0.002","6.433","0.001","13.156","0.004","90","","113.72","0.01","90","","866.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Amino-5-formyl-1,3-dimethyl-2-thiouracil","","- C7 H9 N3 O2 S -","- C7 H9 N3 O2 S -","- C28 H36 N12 O8 S4 -","4","1","QB0011","Pomés Hernández, Ramón; Dago Morales, Angel; Mascarenhas, Yvonne; Moreno Carretero, Miguel; Jimenez Pulido, Sonia; Hueso Ureña, Francisco","6-Amino-5-formyl-1,3-dimethyl-2-thiouracil","Acta Crystallographica Section C","1997","53","9","IUC9700012","","10.1107/S0108270197099447","","","0.71069","MoKα","","0.1098","0.0494","","0.1349","0.1025","","","","1.052","1.071","1.071","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006534","8.4068","0.0004","11.4513","0.0005","14.9166","0.0006","76.375","0.003","81.461","0.003","71.342","0.003","1318.07","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Bis(barium disaccharinate triglyme)","","","- C44 H52 Ba2 N4 O20 S4 -","- C44 H52 Ba2 N4 O20 S4 -","- C44 H52 Ba2 N4 O20 S4 -","1","0.5","SK1065","Näther, Christian; Hauck, Tim; Bock, Hans","Bis(barium disaccharinate triglyme)","Acta Crystallographica Section C","1997","53","9","1244","1246","10.1107/S0108270197003351","","","0.71073","MoKα","","0.0362","0.0301","","0.0745","0.0713","","","","1.061","1.074","1.074","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006535","6.527","0.001","17.257","0.003","13.99","0.003","90","","93.58","0.03","90","","1572.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2-Benzoxazolyl)-3-(5-diethylamino-2-furyl)propenenitrile","","- C18 H17 N3 O2 -","- C18 H17 N3 O2 -","- C72 H68 N12 O8 -","4","1","SK1099","Ján Lokaj; Viktor Kettmann; Jarmila Štetinová; Rudolf Kada; Viktor Vrábel","2-(1,3-Benzoxazol-2-yl)-3-(5-diethylamino-2-furyl)propenenitrile","Acta Crystallographica Section C","1997","53","9","1358","1359","10.1107/S0108270197005337","","","0.71073","MoKα","","0.102","0.0629","","0.2109","0.1404","","","","0.901","1.309","1.309","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006536","12.05","0.007","14.901","0.01","8.363","0.007","103.6","0.06","99.13","0.06","74.71","0.05","1400.4","1.8","150","","150","","","","","","","","","8","P -1","-P 1","2","","","","- C14 H30 Cl4 F3 N4 O7 Ru S -","- C14 H30 Cl4 F3 N4 O7 Ru S -","- C28 H60 Cl8 F6 N8 O14 Ru2 S2 -","2","1","SK1100","Levason, William; Quirk, Jeffrey J.; Reid, Gillian","<i>trans</i>-[RuCl~2~(dmf)~4~]CF~3~SO~3~.CH~2~Cl~2~","Acta Crystallographica Section C","1997","53","9","1224","1226","10.1107/S0108270197005349","","","0.71073","MoKα","","0.064","0.0448","","0.0548","0.0532","","","","2.5","2.787","2.787","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006537","13.5225","0.0008","6.9078","0.0003","17.6194","0.001","90","","102.327","0.005","90","","1607.9","0.15","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","5-Ethyl-2-methylpyridine-(N-salicylideneglycinato)copper(II) Polymer","","- C17 H18 Cu N2 O3 n -","- C17 H18 Cu N2 O3 -","- C68 H72 Cu4 N8 O12 -","4","1","SK1101","Warda, Salam A.","<i>catena</i>-Poly[[(5-ethyl-2-methylpyridine-<i>N</i>)copper(II)]-μ-(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>'')]","Acta Crystallographica Section C","1997","53","9","1184","1186","10.1107/S0108270197005350","","","1.54178","CuKα","","0.0394","0.0367","","0.1051","0.1042","","","","1.07","1.091","1.091","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006538","8.985","0.0008","8.985","0.0008","17.1652","0.001","90","","90","","90","","1385.75","0.19","293","2","293","2","","","","","","","","5","P 43","P 4cw","78","","(11R-trans)-11-ethylthio-1,2,3,10,11,11a-hexahydro‒5H-pyrrolo[2,1-c][1,4] benzodiazepin-5-one","","- C14 H18 N2 O S -","- C14 H18 N2 O S -","- C56 H72 N8 O4 S4 -","4","1","SK1103","Kubicki, Maciej; Szkaradzińska, Maria B.; Codding, Penelope W.","(11<i>R</i>,11a<i>S</i>-<i>trans</i>)-11-Ethylthio-2,3,5,10,11,11a-hexahydro-1<i>H</i>-pyrrolo[2,1-<i>c</i>][1,4]benzodiazepin-5-one","Acta Crystallographica Section C","1997","53","9","1288","1290","10.1107/S0108270197005581","","","1.54178","CuKα","","0.0558","0.0529","","0.1476","0.1443","","","","1.083","1.115","1.115","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006539","6.93","0.0002","15.5478","0.0015","16.5453","0.0013","90","","90","","90","","1782.7","0.2","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4R,5S,2'S,3'S)-3-(3'-hydroxy-2'-methyl-7'-octinoyl)-5-phenyl- 4-methyl-2-oxazolidinone","","- C19 H23 N O4 -","- C19 H23 N O4 -","- C76 H92 N4 O16 -","4","1","SX1016","Carballo, Rosa; Fernández-Suárez, Miryam; Muñoz, Luis; Riguera, Ricardo; Maichle-Mössmer, Cäcilia","Absolute Configuration of an Intermediate in the Asymmetric Synthesis of Natural β-Hydroxy and β-Amino Acids","Acta Crystallographica Section C","1997","53","9","1312","1314","10.1107/S0108270197005957","","","1.5418","CuKα","","0.0361","0.0348","","0.0948","0.093","","","","1.043","1.041","1.041","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006540","17.977","0.004","11.819","0.007","14.696","0.002","90","","90.775","0.015","90","","3122","2","293","","293","","","","","","","","","6","I 1 2/c 1","-I 2yc","15","","","","- C30 H30 Cl2 Co N8 O2 -","- C30 H30 Cl2 Co N8 O2 -","- C120 H120 Cl8 Co4 N32 O8 -","4","0.5","TA1062","Cheng, K.-L.; Sheu, S.-C.; Lee, G.-H.; Lin, Y-C.; Wang, Y.; Ho, T.-I.","[6,6'-Bis(benzimidazol-2-yl-<i>N</i>^3^)-2,2'-bipyridine]dichlorocobalt(II)‒Dimethylformamide (1/2)","Acta Crystallographica Section C","1997","53","9","1238","1240","10.1107/S0108270196015387","","","0.71073","MoKα","","0.149","0.149","","0.048","0.048","","","","","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006541","10.5","0.005","15.507","0.004","6.804","0.004","90","","90.48","0.05","90","","1107.8","0.9","300","","300","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- Ba2 Cl7 Er -","- Ba2 Cl7 Er -","- Ba8 Cl28 Er4 -","4","1","TA1137","Tsuchiya, S.; Hanaue, Y.; Kimura, E.; Ishizawa, N.","Ba~2~ErCl~7~","Acta Crystallographica Section C","1997","53","9","1180","1181","10.1107/S0108270197004502","","","0.7107","Mo_Kα","","0.047","0.032","","0.03","0.029","","","","1.442","1.527","1.527","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006542","10.597","0.002","21.337","0.002","5.855","0.001","90","","90","","90","","1323.9","0.4","296","","23","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H18 N2 O11 S -","- C6 H18 N2 O12 S -","- C24 H72 N8 O48 S4 -","4","1","TA1155","Zhang, Hong; Wang, Ximin; Chang, Xienan; Xiao, Weiqiang; Zhang, Kecong; Teo, Boon K.","An Assessment of Ionic and Hydrogen Bonding in the Crystal Structure of (<small>DL</small>-Serine. H^+^)~2~.SO~4~^2{-^}.H~2~O","Acta Crystallographica Section C","1997","53","9","1286","1288","10.1107/S0108270197006951","","","0.7107","MoKα","","","0.034","","","0.032","","","","","1.95","1.95","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006543","11.075","0.001","9.268","0.001","40.17","0.005","90","","94.05","0.01","90","","4112.9","0.8","293","3","293","3","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[2,4-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidine] . [4-amino-N-(4,6-dimethyl-2-pyrimidinyl)benzene-sulfonamide] 1:2 complex monohydrate","","- C38 H48 N12 O8 S2 -","- C38 H48 N12 O8 S2 -","- C152 H192 N48 O32 S8 -","4","1","VJ1044","Nicola Sardone; Giampiero Bettinetti; Milena Sorrenti","Trimethoprim–Sulfadimidine 1:2 Molecular Complex Monohydrate","Acta Crystallographica Section C","1997","53","9","1295","1299","10.1107/S0108270197000425","","","1.54184","CuKα","","0.055","0.049","","","0.05","","","","","1.616","1.616","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2006544","13.087","0.001","9.835","0.001","6.015","0.002","90","","103.33","0.01","90","","753.3","0.3","296.2","","296.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- Cu4 H6 O10 S -","- Cu4 H6 O10 S -","- Cu16 H24 O40 S4 -","4","1","AB1459","Helliwell, Madeleine; Smith, Joseph V.","Brochantite","Acta Crystallographica Section C","1997","53","10","1369","1371","10.1107/S0108270197006318","","","0.7107","MoKα","","0.1053","0.0416","","0.0492","0.0394","","","","1.467","1.619","1.619","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006545","11.388","0.002","10.171","0.002","11.767","0.005","90","0.03","90","0.03","90","0.01","1362.9","0.7","294","","294","","","","","","","","","4","P b c a","","","","","","- C5 H8 N4 O2 -","- C5 H8 N4 O2 -","- C40 H64 N32 O16 -","8","1","AB1467","Piacenza, Guy; Beguet, Christelle; Wimmer, Eric; Gallo, Roger; Giorgi, Michel","2,4,6,8-Tetraazabicyclo[3.3.1]nonane-3,7-dione and 2,4,6,8-Tetraacetyl-2,4,6,8-tetraazabicyclo[3.3.1]nonane-3,7-dione","Acta Crystallographica Section C","1997","53","10","1459","1462","10.1107/S0108270197006495","","","0.71073","MoKα","","0.049","0.039","","","0.052","","","","","1.835","1.835","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006546","8.979","0.002","16.265","0.006","10.342","0.001","90","0.02","99.63","0.02","90","0.02","1489.1","0.7","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H16 N4 O6 -","- C13 H16 N4 O6 -","- C52 H64 N16 O24 -","4","1","AB1467","Piacenza, Guy; Beguet, Christelle; Wimmer, Eric; Gallo, Roger; Giorgi, Michel","2,4,6,8-Tetraazabicyclo[3.3.1]nonane-3,7-dione and 2,4,6,8-Tetraacetyl-2,4,6,8-tetraazabicyclo[3.3.1]nonane-3,7-dione","Acta Crystallographica Section C","1997","53","10","1459","1462","10.1107/S0108270197006495","","","0.71073","MoKα","","0.071","0.047","","","0.062","","","","","2.165","2.165","","","","","has coordinates,has Fobs","208377","2020-10-21","18:00:00",""
"2006547","12.479","0.003","27.145","0.008","12.591","0.004","90","","97.4","0.01","90","","4230","2","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5,11,17,23-tetra(methylthio)-25,26,27,28-tetrapropoxy-calix[4]arene","","- C44 H56 O4 S4 -","- C44 H56 O4 S4 -","- C176 H224 O16 S16 -","4","1","AB1468","Schultz, Thomas M.; Hazell, Rita G.; Larsen, Mogens","The Cone Conformer of a Tetrakis(methylthio)tetrapropoxycalix[4]arene","Acta Crystallographica Section C","1997","53","10","1495","1497","10.1107/S0108270197007725","","","0.71073","MoKα","","","0.057","","","0.067","","","","","1.466","1.466","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006548","11.097","0.005","9.869","0.005","17.325","0.004","90","","104.9","0.02","90","","1833.6","1.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Cu{Ni(CN)~4~}(dien)(mea)].2H~2~O","Tetracyanonickelato(II){N-(2-aminoethyl)-1,2-ethanediamine}(2-aminoeth anol)copper(II)-water(1/2)","","- C10 H24 Cu N8 Ni O3 -","- C10 H24 Cu N8 Ni O3 -","- C40 H96 Cu4 N32 Ni4 O12 -","4","1","AB1476","Kurihara, Hiroyuki; Nishikiori, Shin-ichi; Iwamoto, Toschitake","Monodentate Ligation of Tetracyanonickelate(II): (2-Aminoethanol)[<i>N</i>-(2-aminoethyl)-1,2-ethanediamine][tetracyanonickelato(II)]copper(II)‒Water (1/2)","Acta Crystallographica Section C","1997","53","10","1409","1411","10.1107/S010827019700632X","","","0.71069","MoKα","","","0.0433","","","0.1087","","","","","1.102","1.102","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2006549","9.511","0.001","12.754","0.002","10.363","0.001","97.42","0.01","87.45","0.01","106.81","0.01","1193.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H50 Cl2 Fe2 P2 Pt -","- C56 H50 Cl2 Fe2 P2 Pt -","- C56 H50 Cl2 Fe2 P2 Pt -","1","0.5","AB1485","Otto, Stefanus; Roodt, Andreas","<i>trans</i>-Dichlorobis(ferrocenyldiphenylphosphine-<i>P</i>)platinum(II)‒Benzene (1/2)","Acta Crystallographica Section C","1997","53","10","1414","1416","10.1107/S0108270197008044","","","1.54178","CuKα","","0.044","0.043","","0.112","0.109","","","","1.05","1.036","1.036","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006550","16.488","0.007","18.221","0.003","11.67","0.008","90","","103.76","0.04","90","","3405","3","173","1","173","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(±)-(E)-3-(4-hydroxyphenyl)-N-[4-(3-methyl-2,5-dioxo-1- pyrrolidinyl)butyl]-2-propenamide","","- C18 H22 N2 O4 -","- C18 H22 N2 O4 -","- C144 H176 N16 O32 -","8","2","AB1491","Linden, Anthony; Kuehne, Paul; Hesse, Manfred","A Putrescine Triamide from <i>Lilium regale</i>","Acta Crystallographica Section C","1997","53","10","1472","1475","10.1107/S0108270197008457","","","0.71069","MoKα","","0.1559","0.0636","","0.2236","","0.1835","","","1.235","","","1.047","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006551","8.8144","0.0001","9.1481","0.0001","27.8748","0.0003","90","","97.827","0.001","90","","2226.74","0.04","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C31 H22 O3 -","- C31 H22 O3 -","- C124 H88 O12 -","4","1","BK1278","Muneer, M.; Rath, Nigam P.; George, M. V.","Photoproducts Derived from 9-Substituted Dibenzobarrelenes","Acta Crystallographica Section C","1997","53","10","1475","1478","10.1107/S0108270197006343","","","0.71073","MoKα","","0.084","0.048","","0.128","0.104","","","","1.01","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006552","8.7753","0.0001","9.2567","0.0001","28.1011","0.0002","90","","92.934","0.001","90","","2279.67","0.04","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C31 H22 O3 -","- C31 H22 O3 -","- C124 H88 O12 -","4","1","BK1278","Muneer, M.; Rath, Nigam P.; George, M. V.","Photoproducts Derived from 9-Substituted Dibenzobarrelenes","Acta Crystallographica Section C","1997","53","10","1475","1478","10.1107/S0108270197006343","","","0.71073","MoKα","","0.068","0.048","","0.118","0.107","","","","1.06","1.12","1.12","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006553","8.537","0.001","15.946","0.005","18.756","0.004","90","","92.53","0.02","90","","2550.8","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-diphenyl[2,6-diacetylpyridinebis(thiosemicarbazone)]tin(IV) chloride","","- C23 H24 Cl N7 S2 Sn -","- C23 H24 Cl N7 S2 Sn -","- C92 H96 Cl4 N28 S8 Sn4 -","4","1","BK1300","Moreno, Patricia C.; Francisco, Regina H. P.; Gambardella, M. Teresa do P.; Sousa, Gerimario F. de; Abras, Anuar","<i>trans</i>-[2,6-Diacetylpyridine bis(thiosemicarbazone)(1‒)]diphenyltin(IV) Chloride","Acta Crystallographica Section C","1997","53","10","1411","1414","10.1107/S0108270197007002","","","0.71073","MoKα","","0.071","0.036","","0.098","0.078","","","","1.109","1.039","1.039","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006554","3.971","0.002","8.904","0.002","31.417","0.002","90","","92.84","0.03","90","","1109.5","0.6","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,4-dimethoxy-2-naphthoic acid","","","- C13 H12 O4 -","- C13 H13 O4 -","- C52 H52 O16 -","4","1","BK1333","Blackburn, Anthony C.; Gerkin, Roger E.","1,4-Dimethoxy-2-naphthoic Acid","Acta Crystallographica Section C","1997","53","10","1425","1427","10.1107/S0108270197008299","","","0.71073","MoKα","","","0.059","","","","0.053","","","","","","1.58","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006555","12.5744","0.0004","7.4608","0.0002","14.4604","0.0004","90","","90.304","0.001","90","","1356.58","0.07","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-cyano-6-(4'-methoxyphenyl)-5-methyl-4-methylthio-2-pyranone","","- C15 H13 N O3 S -","- C15 H13 N O3 S -","- C60 H52 N4 O12 S4 -","4","1","BM1145","Azim, Abul; Parmar, Virinder S.; Errington, William","3-Cyano-6-(4-methoxyphenyl)-5-methyl-4-methylthio-2<i>H</i>-pyran-2-one","Acta Crystallographica Section C","1997","53","10","1436","1438","10.1107/S0108270197007336","","","0.71073","MoKα","","0.0635","0.0485","","0.11","0.1004","","","","1.177","1.184","1.184","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006556","29.0856","0.0013","9.7417","0.0004","21.114","0.0009","90","","126.853","0.001","90","","4787.1","0.4","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Aquatetrachlorotris(tetrahydrofuran)thorium(IV). Tetrahydrofuran Solvate.","","- C16 H34 Cl4 O5 Th -","- C16 H34 Cl4 O5 Th -","- C128 H272 Cl32 O40 Th8 -","8","1","BM1151","Spry, Marcus P; Errington, William; Willey, Gerald R","Aquatetrachlorotris(tetrahydrofuran-<i>O</i>)thorium(IV) Tetrahydrofuran Solvate (1/1)","Acta Crystallographica Section C","1997","53","10","1388","1390","10.1107/S0108270197008378","","","0.71073","MoKα","","0.0358","0.0239","","0.0498","0.0461","","","","1.026","1.049","1.049","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006557","4.939","0.002","20.11","0.006","10.003","0.003","90","","98.85","0.02","90","","981.7","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Author name: bis(aqua)bis(1-methoxy-4-carbomethoxy-1,3-butanedionato-O,O')zinc(II)","","- C14 H22 O12 Zn -","- C14 H22 O12 Zn -","- C28 H44 O24 Zn2 -","2","0.5","BM1165","John Fawcett; Raymond D. W. Kemmitt; David R. Russell; Kuldip Singh","Diaquabis(dimethyl 3-oxopentanedioato-<i>O</i>^1^,<i>O</i>^3^)zinc(II)","Acta Crystallographica Section C","1997","53","10","1422","1424","10.1107/S010827019700838X","","","0.71073","MoKα","","0.055","0.034","","0.092","0.081","","","","1.061","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006558","23.0801","0.0002","5.51742","0.00006","19.5747","0.0002","90","","122.93","0.0004","90","","2092.21","0.04","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis-methylammonium heptamolybdate(VI)","","- C2 H12 Mo7 N2 O22 -","- C2 Mo7 N2 O22 -","- C8 Mo28 N8 O88 -","4","0.5","BR1181","Zavalij, Peter Y.; Whittingham, M. Stanley","The Layered Methylammonium Molybdate (NH~3~CH~3~)~2~[Mo~7~O~22~] from X-ray Powder Data","Acta Crystallographica Section C","1997","53","10","1374","1376","10.1107/S010827019700601X","","","1.54056","CuKα~1~","","","0.038","","","","","","","2.47","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006559","9.507","0.007","11.989","0.007","14.874","0.009","90","","92.31","0.06","90","","1694","1.9","296.2","","296.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H9 Br3 Mo N3 S3 -","- C9 H6 Br3 Mo N3 S3 -","- C36 H24 Br12 Mo4 N12 S12 -","4","1","BR1185","James, Michael; Kawaguchi, Hiroyuki; Tatsumi, Kazuyuki","<i>trans</i>-Tribromotris(1,3-thiazole-<i>N</i>)molybdenum(III)","Acta Crystallographica Section C","1997","53","10","1391","1393","10.1107/S0108270197007129","","","0.7107","MoKα","","0.049","0.049","","0.061","0.061","","","","2.346","2.346","2.346","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006560","9.127","0.001","10.522","0.001","37.195","0.002","90","","90","","90","","3572","0.6","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Tyr-D-Tic","tyrosyl-D-tetrahydroisoquinoline-3-carboxylic acid","","- C19 H23 N2 O5.5 -","- C19 H23 N2 O5.5 -","- C152 H184 N16 O44 -","8","2","BS1028","Deschamps, Jeffrey R.; Flippen-Anderson, Judith L.; Christi Moore; Robert Cudney; George, Clifford","Tyrosinium-<small>D</small>-tetrahydroisoquinoline-3-carboxylate 1.5-Hydrate and Tyrosyl-<small>D</small>-tetrahydroisoquinoline-3-carboxamide Hydrate","Acta Crystallographica Section C","1997","53","10","1478","1482","10.1107/S0108270197006975","","","1.54178","CuKα","","0.0529","0.0458","","0.1267","0.1207","","","","1.063","1.083","1.083","","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2006561","8.981","0.001","10.597","","9.703","0.001","90","","98.76","0.01","90","","912.68","0.14","223","2","223","2","","","","","","","","4","P 1 21 1","P 2yb","4","Tyr-D-Tic-NH2","tyrosyl-D-tetrahydroisoquinoline-3-carboxamide","","- C19 H23 N3 O4 -","- C19 H23 N3 O4 -","- C38 H46 N6 O8 -","2","1","BS1028","Deschamps, Jeffrey R.; Flippen-Anderson, Judith L.; Christi Moore; Robert Cudney; George, Clifford","Tyrosinium-<small>D</small>-tetrahydroisoquinoline-3-carboxylate 1.5-Hydrate and Tyrosyl-<small>D</small>-tetrahydroisoquinoline-3-carboxamide Hydrate","Acta Crystallographica Section C","1997","53","10","1478","1482","10.1107/S0108270197006975","","","1.54178","CuKα","","0.0536","0.0484","","0.1408","0.1339","","","","1.044","1.049","1.049","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006562","11.799","0.002","8.155","0.002","25.063","0.003","90","","91.11","0.01","90","","2411.1","0.8","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H70 N4 O12 -","- C46 H70 N4 O12 -","- C92 H140 N8 O24 -","2","0.5","CF1074","Griesar, Klaus; Haase, Wolfgang; Svoboda, Ingrid; Fuess, Hartmut","A Nitroxide Tetraradical Exhibiting Ferromagnetic Coupling","Acta Crystallographica Section C","1997","53","10","1488","1490","10.1107/S0108270197002461","","","0.71069","MoKα","","0.0655","0.0374","","0.1269","0.104","","","","0.861","0.851","0.851","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006563","9.89","0.003","10.437","0.003","14.79","0.004","90","","97.75","0.02","90","","1512.7","0.8","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","trans 1-hydroxy-2,6-diphenyl-4-piperidone oxime ?","","- C17 H18 N2 O2 -","- C17 H18 N2 O2 -","- C68 H72 N8 O8 -","4","1","CF1113","Díaz, Eduardo; Barrios, Héctor; Toscano, Rubén A.","Three <i>trans</i>-2,6-Diaryl Derivatives of Oximes of <i>N</i>-Hydroxy-4-piperidone","Acta Crystallographica Section C","1997","53","10","1468","1471","10.1107/S0108270197002953","","","1.54178","CuKα","","0.0712","0.0501","","0.1383","0.128","","","","1.058","1.188","1.188","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006564","10.169","0.005","14.129","0.008","10.039","0.006","90","","90.67","0.04","90","","1442.3","1.4","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-1-hydroxy-2,6-bis(1-methyl-2-pyrrolyl)-4-piperidone oxime","","- C15 H20 N4 O2 -","- C15 H20 N4 O2 -","- C60 H80 N16 O8 -","4","1","CF1113","Díaz, Eduardo; Barrios, Héctor; Toscano, Rubén A.","Three <i>trans</i>-2,6-Diaryl Derivatives of Oximes of <i>N</i>-Hydroxy-4-piperidone","Acta Crystallographica Section C","1997","53","10","1468","1471","10.1107/S0108270197002953","","","1.54178","CuKα","","0.0913","0.0898","","0.2585","0.2555","","","","1.106","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006565","9.479","0.003","10.229","0.003","8.625","0.002","108.98","0.02","112.91","0.02","91.69","0.02","716.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","trans 1-hydroxy-2,6-bis(2-thiophenyl)-4-piperidone oxime","","- C13 H14 N2 O2 S2 -","- C13 H14 N2 O2 S2 -","- C26 H28 N4 O4 S4 -","2","1","CF1113","Díaz, Eduardo; Barrios, Héctor; Toscano, Rubén A.","Three <i>trans</i>-2,6-Diaryl Derivatives of Oximes of <i>N</i>-Hydroxy-4-piperidone","Acta Crystallographica Section C","1997","53","10","1468","1471","10.1107/S0108270197002953","","","1.54178","CuKα","","0.0717","0.0696","","0.1938","0.1909","","","","1.064","1.1","1.1","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006566","7.8937","0.0006","10.808","0.002","19.523","0.002","90","","90","","90","","1665.6","0.4","298","2","298","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6α,7β-dihydroxyvouacapan-17β-lactone","","- C20 H26 O4 -","- C20 H26 O4 -","- C80 H104 O16 -","4","1","CF1155","Abrahão-Junior, Odonirio; Gambardella, Maria Teresa do P.; Ruggiero, Silvana Guilardi; Sacramento, Tania Marcia; Stefani, Guglielmo Marconi; Pilo-Veloso, Dorila","6α-Hydroxyvouacapan-7β,17β-lactone","Acta Crystallographica Section C","1997","53","10","1508","1510","10.1107/S0108270197006057","","","0.71073","MoKα","","0.2099","0.0565","","0.1795","0.1099","","","","1.169","1.109","1.109","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006567","12.2981","0.001","12.873","0.003","12.508","0.003","90","","97.358","0.01","90","","1963.9","0.7","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 Cl3 Fe N4 O4 -","- C15 H20 Cl3 Fe N4 O4 -","- C60 H80 Cl12 Fe4 N16 O16 -","4","1","CF1163","Alcock, Nathaniel W.; Rybak-Akimova, Elena V.; Busch, Daryle H.","A <i>cis</i>-Octahedral Dichloro Complex of Fe^III^ with a Tetradentate Dipyridyl‒Diamino Ligand","Acta Crystallographica Section C","1997","53","10","1385","1387","10.1107/S0108270197004459","","","0.71073","MoKα","","0.0748","0.0476","","0.1137","0.1001","","","","1.032","1.062","1.062","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006568","6.681","0.003","9.093","0.001","16.067","0.003","70.89","0.01","75.48","0.03","83.96","0.04","892.5","0.5","293","","293","","","","","","","","","4","P -1","-P 1","2","","2-Isobutyl-4-oxo-5,5-dimethyltetrahydropyran","","- C17 H24 N4 O5 -","- C17 H24 N4 O5 -","- C34 H48 N8 O10 -","2","1","CF1165","Lane, Alexandra L.; Rossiter, Karen J.; Sell, Charles S.; Watkin, David J.","The Novel Fragrance 2-Isobutyl-4-oxo-5,5-dimethyltetrahydropyran as its 2,4-Dinitrophenylhydrazone Derivative","Acta Crystallographica Section C","1997","53","10","1444","1445","10.1107/S0108270197008470","","","1.5418","CuKα","","","0.055","","","0.1771","","","","","0.741","0.741","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006569","30.404","0.004","10.276","0.001","18.742","0.003","90","","108.92","0.01","90","","5539.2","1.3","163","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C34 H26 O3 P Rh -","- C34 H26 O3 P Rh -","- C272 H208 O24 P8 Rh8 -","8","2","CF1166","Lamprecht, Delanie; Lamprecht, Gert J.; Botha, J. Mattheus; Umakoshi, Keisuke; Sasaki, Yoichi","Carbonyl(1,3-diphenyl-1,3-propanedionato-<i>O</i>,<i>O</i>')(triphenylphosphine-<i>P</i>)rhodium(I)","Acta Crystallographica Section C","1997","53","10","1403","1405","10.1107/S0108270197007439","","","0.71073","MoKα","","","0.035","","","0.043","","","","","2.564","2.564","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006570","9.1496","0.0008","8.5119","0.0006","19.9057","0.0017","90","","98.99","0.002","90","","1531.2","0.2","220","2","220","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-(3',4'-Dimethoxyphenyl)-3-(3-methylphenyl)prop-2-enone","","- C18 H18 O3 -","- C18 H18 O3 -","- C72 H72 O12 -","4","1","CF1168","Sharma, Nawal K.; Kumar, Rajesh; Parmar, Virinder S.; Errington, William","1-(3,4-Dimethoxyphenyl)-3-(3-methylphenyl)prop-2-en-1-one","Acta Crystallographica Section C","1997","53","10","1438","1440","10.1107/S0108270197006677","","","0.71073","MoKα","","0.0609","0.0471","","0.1283","0.1149","","","","1.066","1.073","1.073","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006571","9.1163","0.0009","16.05","0.002","8.705","0.0008","90","","99.608","0.002","90","","1255.8","0.2","230","2","230","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-cyano-6-(2'-methoxyphenyl)-4-methylthio-2-pyranone","","- C14 H11 N O3 S -","- C14 H11 N O3 S -","- C56 H44 N4 O12 S4 -","4","1","CF1174","Malhotra, Sanjay; Parmar, Virinder S; Errington, William","3-Cyano-6-(2-methoxyphenyl)-4-methylthio-2<i>H</i>-pyran-2-one","Acta Crystallographica Section C","1997","53","10","1442","1444","10.1107/S0108270197007294","","","0.71073","MoKα","","0.06","0.0438","","0.1232","0.1124","","","","0.992","1.049","1.049","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006572","7.726","0.002","10.22","0.002","15.169","0.003","90","","99.67","0.02","90","","1180.7","0.5","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H16 I Li O4 -","- C8 H16 I Li O4 -","- C32 H64 I4 Li4 O16 -","4","1","CF1181","Eaborn, Colin; Farook, Adam; Hitchcock, Peter B.; Smith, J. David","<i>catena</i>-Poly[[(1,4-dioxane-<i>O</i>^1^)iodolithium]-μ-(1,4-dioxane-<i>O</i>^1^:<i>O</i>^4^)]","Acta Crystallographica Section C","1997","53","10","1387","1388","10.1107/S0108270197008482","","","0.71073","MoKα","","0.0511","0.0335","","0.0842","0.0757","","","","1.005","1.038","1.038","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006573","8.5946","0.0006","18.775","0.002","9.0289","0.0006","90","","91.58","0.04","90","","1456.4","0.2","220","2","220","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(2-Acetoxy-4-methyoxyphenyl)-2-phenylethanone","","- C17 H16 O4 -","- C17 H16 O4 -","- C68 H64 O16 -","4","1","CF1183","Pati, Hari N.; Parmar, Virinder S.; Errington, William","1-(2-Acetoxy-4-methoxyphenyl)-2-phenylethanone","Acta Crystallographica Section C","1997","53","10","1440","1442","10.1107/S0108270197007567","","","0.71073","MoKα","","0.0524","0.0393","","0.1006","0.0915","","","","1.121","1.142","1.142","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006574","22.01","0.01","9.573","0.003","25.895","0.004","90","","96.37","0.02","90","","5422","3","296.2","","296.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H62 Cs4 Dy2 N6 O33 -","- C28 H62 Cs4 Dy2 N6 O32.5 -","- C112 H248 Cs16 Dy8 N24 O130 -","4","0.5","FG1240","Sakagami, Narumi; Homma, Jun-ichi; Konno, Takumi; Okamoto, Ken-ichi","Tetracaesium Bis(diethylenetriamine-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''-pentacetato)didysprosate(III) Tridecahydrate","Acta Crystallographica Section C","1997","53","10","1378","1381","10.1107/S0108270197006021","","","0.7107","MoKα","","","0.0329","","","0.0372","","","","","1.262","1.262","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006575","6.9449","0.0005","10.5817","0.0005","17.8569","0.0008","74.196","0.004","78.952","0.004","73.558","0.004","1201.68","0.12","293","","293","","","","","","","","","3","P -1","-P 1","2","","5-Formyl-1,1,8,8-tetrakis(methoxycarbonyl)-(4E,11Z,13E)- cyclopentadeca-4,11,13-triene","","- C24 H32 O9 -","- C24 H32 O9 -","- C48 H64 O18 -","2","1","FG1245","Drouin, Marc; Hall, Dennis G.; Caillé, Alain-Sébastien; Pierre Deslongchamps","Unique <i>trans</i>-<i>syn</i>-<i>cis</i> [6.6.7] Tricycle Derivative from Transannular Diels‒Alder Contraction of a Model 15-Membered <i>trans</i>-<i>cis</i>-<i>cis</i> Macrocyclic Triene","Acta Crystallographica Section C","1997","53","10","1490","1493","10.1107/S0108270197005635","","","1.54184","CopperKα","","0.067","0.046","","0.068","0.061","","","","","1.41","1.41","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006576","13.549","0.002","15.413","0.002","24.49","0.002","79.073","0.011","75.749","0.009","70.254","0.012","4633.6","1.1","293","2","193","2","","","","","","","","4","P -1","-P 1","2","","rac-1S,2S,7R,10R)-(8Z)-1-p-bromobenzoyl-5,5,13,13-tetrakis(methoxycarbonyl) tricyclo[8.5.0.0^2,7^]pentadec-8-ene.","","- C31.51 H38.52 Br O10.25 -","- C31.506 H38.5197 Br O10.253 -","- C189.036 H231.118 Br6 O61.518 -","6","3","FG1245","Drouin, Marc; Hall, Dennis G.; Caillé, Alain-Sébastien; Pierre Deslongchamps","Unique <i>trans</i>-<i>syn</i>-<i>cis</i> [6.6.7] Tricycle Derivative from Transannular Diels‒Alder Contraction of a Model 15-Membered <i>trans</i>-<i>cis</i>-<i>cis</i> Macrocyclic Triene","Acta Crystallographica Section C","1997","53","10","1490","1493","10.1107/S0108270197005635","","","1.54184","CopperKα","","0.0845","0.0614","","0.1753","0.1568","","","","1.067","1.178","1.178","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2006577","9.504","0.003","18.536","0.005","10.305","0.003","90","","112.76","0.02","90","","1674","0.9","295","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","[hydridotris(pyrazolyl)borato]-bis[1,1-diphenylhydrazido(2-)]chloromo- lybdenum(VI)","","- C33 H30 B Cl Mo N10 -","- C33 H30 B Cl Mo N10 -","- C66 H60 B2 Cl2 Mo2 N20 -","2","1","FG1296","Carolina Manzur; David Carrillo; Daphne Boys","Chlorobis[1,1'-diphenylhydrazido(2‒)-<i>N</i>^2^][hydridotris(pyrazolyl-<i>N</i>^2^)borato]molybdenum(VI)","Acta Crystallographica Section C","1997","53","10","1401","1403","10.1107/S0108270197007452","","","0.71073","MoKα","","0.037","0.03","","0.075","0.073","","","","1.008","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006578","7.921","0.0009","10.668","0.001","10.728","0.001","90","","94.4","0.01","90","","903.86","0.16","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H25 Br O4 -","- C20 H25 Br O4 -","- C40 H50 Br2 O8 -","2","1","FG1310","Zukerman-Schpector, J.; Castellano, E.E.; Ceschi, Marco Antonio; Brocksom, Timothy John; Wikaira, Jan L.","Intermediates in the Synthesis of <i>Daphniphyllum</i> Alkaloids. I. A Tetracyclic Oxygen Analogue","Acta Crystallographica Section C","1997","53","10","1482","1483","10.1107/S0108270197005222","","","0.71073","MoKα","","0.092","0.042","","0.117","","0.098","","","1.077","","","1.159","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006579","9.911","0.0015","5.404","0.002","10.0873","0.0013","90","","106.347","0.01","90","","518.4","0.2","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","1-(2-deoxy-α-D-erythro-pentopyranosyl)-1-(R),2-(R)-4-methyl-4- triazolidine-3,5-dione","","- C8 H13 N3 O5 -","- C8 H13 N3 O5 -","- C16 H26 N6 O10 -","2","1","FG1326","Meyers, Cal Y.; Hou, Yuqing; Kolb, Vera M.; Robinson, Paul D.","(1<i>R</i>,2<i>R</i>)-4-Methylurazole-α-<small>D</small>-pyranosyl-2-deoxyriboside from Reaction of 4-Methylurazole with 2-Deoxy-<small>D</small>-ribose","Acta Crystallographica Section C","1997","53","10","1502","1505","10.1107/S0108270197007476","","","0.71069","MoKα","","0.0728","0.0383","","0.12","","0.1037","","","1.046","1.111","1.111","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006580","11.448","0.002","12.098","0.002","19.305","0.003","90","","106.3","0.02","90","","2566.2","0.8","143","2","143","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","10-Iodo-bis(5-iodo-1,3,3-trimethylindoline-2yl)monomethinium Perchlorate","","- C23 H24 Cl I3 N2 O4 -","- C23 H24 Cl I3 N2 O4 -","- C92 H96 Cl4 I12 N8 O16 -","4","1","FG1330","Johannes, Hans-Hermann; Grahn, Walter; Dix, Ina; Jones, Peter G.","5-Iodo-2-[iodo(5-iodo-1,3,3-trimethyl-2-indolinylidene)methyl]-1,3,3-trimethyl-3<i>H</i>-indolium Perchlorate: a Highly Overcrowded Cyanine Dye","Acta Crystallographica Section C","1997","53","10","1432","1434","10.1107/S0108270197007580","","","0.71073","MoKα","","0.037","0.0286","","0.0599","0.0558","","","","1.076","1.081","1.081","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006581","11.6191","0.0014","12.576","0.002","13.474","0.002","106.666","0.01","100.155","0.008","103.946","0.01","1765.6","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","N,N'-Di(benzenesulfonyl)sulfamide Dichloromethane Solvate (1/0.5)","","- C12.5 H13 Cl N2 O6 S3 -","- C12.5 H13 Cl N2 O6 S3 -","- C50 H52 Cl4 N8 O24 S12 -","4","2","FG1336","Hiemisch, Oliver; Henschel, Dagmar; Blaschette, Armand; Jones, Peter G.","Polysulfonylamines. LXXXVII. Bis(benzenesulfonamido) Sulfone‒Dichloromethane (1/0.5)","Acta Crystallographica Section C","1997","53","10","1429","1432","10.1107/S010827019700704X","","","0.71073","MoKα","","0.0828","0.0411","","0.0941","0.0833","","","","0.856","0.99","0.99","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2006582","24.312","0.005","9.464","0.002","9.454","0.003","90","","90.06","0.02","90","","2175.3","0.9","178","2","178","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-Acetamidoadamantane","","- C12 H19 N O -","- C12 H19 N O -","- C96 H152 N8 O8 -","8","1","FG1344","Pröhl, Hans-Heinrich; Blaschette, Armand; Jones, Peter G.","1-Acetamidoadamantane","Acta Crystallographica Section C","1997","53","10","1434","1436","10.1107/S0108270197007610","","","0.71073","MoKα","","0.0595","0.0387","","0.1151","0.0986","","","","1.029","1.087","1.087","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006583","8.528","0.002","11.565","0.002","11.993","0.003","71.34","0.02","74.77","0.02","79.26","0.02","1074.5","0.4","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H30 N4 O12 -","- C18 H30 N4 O12 -","- C36 H60 N8 O24 -","2","1","FR1042","Finnen, Daniel C.; Pinkerton, A. Alan","The Chelating Agent <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''',<i>N</i>'''-Triethylenetetraminehexacetic Acid (TTHA)","Acta Crystallographica Section C","1997","53","10","1455","1457","10.1107/S0108270197005969","","","0.71073","MoKα","","0.105","0.043","","","0.049","","","","","1.39","1.39","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006584","7.489","0.001","5.534","0.004","18.722","0.002","90","","91.3","0.03","90","","775.7","0.6","296","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C9 H8 O3 -","- C9 H8 O3 -","- C36 H32 O12 -","4","1","FR1047","Okabe, Nobuo; Inubushi, Chika","Phenylpyruvic Acid","Acta Crystallographica Section C","1997","53","10","1449","1450","10.1107/S0108270197006525","","","0.71069","MoKα","","","0.057","","","0.07","","","","","2.16","2.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006585","9.134","0.001","12.328","0.001","10.314","0.001","90","","90","","90","","1161.4","0.19","296","","296","","","","","","","","","4","P b c m","-P 2c 2b","57","titanium endo-isodicyclopentadienide trichloride","(η^5^-endo-tricyclo[5.2.1.0^2,6^]deca-2,5-dien-3-yl) trichlorotitanium","","- C10 H11 Cl3 Ti -","- C10 H11 Cl3 Ti -","- C40 H44 Cl12 Ti4 -","4","0.5","FR1048","Gallucci, Judith C.; Kozmina, Natasha; Paquette, Leo A.; Zaegel, Florence; Meunier, Philippe; Gautheron, Bernard","<i>endo</i> and <i>exo</i> Isomers of Isodicyclopentadienyltrichlorotitanium","Acta Crystallographica Section C","1997","53","10","1416","1420","10.1107/S0108270197006781","","","0.7107","MoKα","","","0.038","","","","0.03","","","","","","1.58","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006586","12.4368","0.0008","9.062","0.0001","10.3153","0.0009","90","","90","","90","","1162.56","0.13","296","","296","","","","","","","","","4","P c a 21","P 2c -2ac","29","titanium exo-isodicyclopentadienide trichloride","(η^5^-exo-tricyclo[5.2.1.0^2,6^]deca-2,5-dien-3-yl) trichlorotitanium","","- C10 H11 Cl3 Ti -","- C10 H11 Cl3 Ti -","- C40 H44 Cl12 Ti4 -","4","1","FR1048","Gallucci, Judith C.; Kozmina, Natasha; Paquette, Leo A.; Zaegel, Florence; Meunier, Philippe; Gautheron, Bernard","<i>endo</i> and <i>exo</i> Isomers of Isodicyclopentadienyltrichlorotitanium","Acta Crystallographica Section C","1997","53","10","1416","1420","10.1107/S0108270197006781","","","0.7107","MoKα","","","0.026","","","","0.023","","","","1.7","1.7","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006587","9.029","0.002","15.416","0.003","14.695","0.003","90","","107.8","0.03","90","","1947.5","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","tetrakis(ethylenediamine)yttrium (2.75)hydrosulfide 0.25Iodine","tetrakis(ethylenediamine)yttrium (2.75)hydrosulfide 0.25Iodine","","- C8 H34.72 I0.28 N8 S2.72 Y -","- C8 H34.722 I0.278 N8 S2.722 Y -","- C32 H138.888 I1.112 N32 S10.888 Y4 -","4","0.5","FR1053","George, Clifford; Purdy, Andrew P.","Tetrakis(ethylenediamine)yttrium(III) Hydrosulfide Iodide","Acta Crystallographica Section C","1997","53","10","1381","1383","10.1107/S010827019700749X","","","0.71073","MoKα","","0.068","0.044","","0.105","0.095","","","","1.055","1.094","1.094","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006588","7.446","0.001","12.1722","0.0006","6.9261","0.0007","90","","108.93","0.01","90","","593.79","0.11","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-aminonicotinic acid","","","- C6 H6 N2 O2 -","- C6 H6 N2 O2 -","- C24 H24 N8 O8 -","4","1","FR1064","Dobson, Allison J.; Gerkin, Roger E.","2-Aminonicotinic Acid","Acta Crystallographica Section C","1997","53","10","1427","1429","10.1107/S0108270197008226","","","0.71073","MoKα","","","0.062","","","","0.057","","","","","","1.74","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006589","7.667","0.001","6.862","0.001","14.608","0.002","90","","90","","90","","768.54","0.18","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Coppermolybdate","","- Cu3 Mo2 O9 -","- Cu3 Mo2 O9 -","- Cu12 Mo8 O36 -","4","0.5","JZ1185","Udo Steiner; Werner Reichelt","A Reinvestigation of Cu~3~Mo~2~O~9~, a Compound Containing Copper(II) in Compressed Octahedral Coordination","Acta Crystallographica Section C","1997","53","10","1371","1373","10.1107/S0108270197005751","","","0.71073","MoKα","","0.0316","0.0307","","0.0729","0.0724","","","","1.338","1.344","1.344","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006590","12.079","0.003","12.15","0.003","17.641","0.004","87.02","0.03","78","0.03","60.87","0.03","2208.4","1.2","300","1","300","1","","","","","","","","6","P -1","-P 1","2","","[tetrakis(μ~3~tetrahydrofurfuroxo-O,O')-tetra(ethanol)-tetrachloro- tetra(magnesium(II),manganese(II))] ethanol solvent","","- C29 H63 Cl4 Mg2 Mn2 O12.5 -","- C29 H62.5 Cl4 Mg2 Mn2 O12.5 -","- C58 H125 Cl8 Mg4 Mn4 O25 -","2","1","JZ1203","Jerzykiewicz, Lucjan B.; Utko, Józef; Sobota, Piotr","[(Mg~0.5~,Mn~0.5~)~4~{μ~3~,η^2^-OCH~2~CH(CH~2~)~3~O}~4~(EtOH)~4~Cl~4~].0.5EtOH","Acta Crystallographica Section C","1997","53","10","1393","1396","10.1107/S0108270197007920","","","0.71073","MoKα","","0.057","0.0442","","0.12","0.1112","","","","","1.072","1.072","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2006591","10.766","0.002","10.825","0.002","11.857","0.003","71.88","0.02","63.47","0.02","73.18","0.02","1156.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","3-methyl-11,14,17,20-tetraoxa- 2,4,3-diazaphospha-tricyclo[20,3,1,1^5,9^]-heptacosa- 1(26),5,7,9(27),22,24-hexaene-3-sulfide","","- C21 H31 N2 O5 P S -","- C21 H31 N2 O5 P S -","- C42 H62 N4 O10 P2 S2 -","2","1","JZ1208","Declercq, Jean-Paul; Delangle, Pascale; Dutasta, Jean-Pierre; Van Oostenryck, Luc; Tinant, Bernard","1:1 Molecular Complex Between Water and a Macrocyclic Crown Phosphonamide","Acta Crystallographica Section C","1997","53","10","1484","1486","10.1107/S0108270197006604","","","0.71069","MoKα","","0.0687","0.0502","","0.14","","0.1322","","","1.022","","","1.13","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006592","14.954","0.002","12.157","0.001","9.701","0.001","90","","100.76","0.01","90","","1732.6","0.3","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(piperidinium) Tetrachloromercurate","","- C10 H24 Cl4 Hg N2 -","- C10 H24 Cl4 Hg N2 -","- C40 H96 Cl16 Hg4 N8 -","4","1","JZ1222","Spengler, Roland; Zouari, Fatma; Ben Salah, Abdelhamid; Burzlaff, Hans","Bis(piperidinium) Tetrachloromercurate","Acta Crystallographica Section C","1997","53","10","1407","1409","10.1107/S0108270197008512","","","0.70926","MoKα~1~","","0.048","0.039","","0.042","","0.04","","","1.31","","","1.38","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006593","5.932","0.001","15.12","0.005","23.564","0.006","90","","90","","90","","2113.5","1","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R,2R)-(-)-N,N'-bis(quinoline-2-methylene)-1,2-cyclohexyldiimine","","- C26 H24 N4 -","- C26 H24 N4 -","- C104 H96 N16 -","4","1","KA1231","Adnan S. Abu-Surrah; Timo V. Laine; Timo Repo; Riad Fawzi; Manfred Steimann; Bernhard Rieger","An Enantiomerically Pure Schiff Base Ligand","Acta Crystallographica Section C","1997","53","10","1458","1459","10.1107/S0108270197006148","","","0.71073","MoKα","","0.045","0.0318","","0.0715","0.0677","","","","1.373","1.486","1.486","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006594","10.834","0.001","9.75","0.001","12.381","0.001","90","","99","0.01","90","","1291.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(salicylato)bis(nicotinamide)copper(II)","","- C26 H22 Cu N4 O8 -","- C26 H22 Cu N4 O8 -","- C52 H44 Cu2 N8 O16 -","2","0.5","KA1233","Leban, Ivan; Kozlevčar, Bojan; Sieler, Joachim; Šegedin, Primož","Bis(nicotinamide-<i>N</i>)bis(salicylato-<i>O</i>,<i>O</i>')copper(II), the Monoclinic Form","Acta Crystallographica Section C","1997","53","10","1420","1422","10.1107/S010827019700615X","","","0.71073","MoKα","","0.046","0.0365","","0.0811","0.0757","","","","1.088","1.106","1.106","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006595","7.8931","0.0002","11.9354","0.0003","18.0705","0.0004","90","","90","","90","","1702.37","0.07","133","","133","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-[3-Nitro-phenyl]-[1,3]dioxolane","","- C9 H9 N O4 -","- C9 H9 N O4 -","- C72 H72 N8 O32 -","8","1","KA1235","Bolte, Michael; Marx, Raimund; Scholtyssik, Maria","2-(3-Nitrophenyl)-1,3-dioxolane at 150K","Acta Crystallographica Section C","1997","53","10","1464","1466","10.1107/S0108270197007166","","","0.71073","MoKα","","0.0316","0.0286","","0.08","0.0785","","","","1.056","1.095","1.095","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006596","11.991","0.002","13.951","0.004","14.923","0.004","96.02","0.02","94.49","0.02","98.42","0.02","2444.7","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C57 H49 Cl N6 O7 P2 Ru -","- C57 H43 Cl N6 O7 P2 Ru -","- C114 H86 Cl2 N12 O14 P4 Ru2 -","2","1","KH1147","Lim, Jong Wan; Yeo, Hwan Jin; Jeong, Jong Hwa","<i>trans</i>-[Bis-2,6-(2-benzimidazolyl-κ<i>N</i>^2^)pyridine-κ<i>N</i>]nitrobis(triphenylphosphine-<i>P</i>)ruthenium(II) Perchlorate Ethanol Solvate","Acta Crystallographica Section C","1997","53","10","1405","1407","10.1107/S0108270197006082","","","0.71073","MoKα","","0.0705","0.0661","","0.1639","0.159","","","","1.069","1.073","1.073","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2006597","10.078","0.001","13.7748","0.0009","24.167","0.003","92.048","0.008","90.67","0.01","100.186","0.009","3299.4","0.6","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Acetatobis(triphenylphosphine)silver(I)","","- C38 H33 Ag O2 P2 -","- C38 H33 Ag O2 P2 -","- C152 H132 Ag4 O8 P8 -","4","2","KH1148","Ng, Seik Weng; Othman, A. Hamid","Silver Acetate‒Triphenylphosphine Complexes. Acetatobis(triphenylphosphine)silver(I) and its Sesquihydrate, and Bis[acetato(triphenylphosphine)silver(I)] Hydrate and its Hemihydrate","Acta Crystallographica Section C","1997","53","10","1396","1400","10.1107/S0108270197006690","","","0.71073","MoKα","","0.0478","0.0378","","0.1009","0.0937","","","","1.071","1.099","1.099","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2006598","44.318","0.006","13.2622","0.0008","25.06","0.003","90","","105.492","0.005","90","","14194","3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Acetatobis(triphenylphosphine)silver(I) sesquihydrate","","- C38 H36 Ag O3.5 P2 -","- C38 H36 Ag O3.5 P2 -","- C608 H576 Ag16 O56 P32 -","16","2","KH1148","Ng, Seik Weng; Othman, A. Hamid","Silver Acetate‒Triphenylphosphine Complexes. Acetatobis(triphenylphosphine)silver(I) and its Sesquihydrate, and Bis[acetato(triphenylphosphine)silver(I)] Hydrate and its Hemihydrate","Acta Crystallographica Section C","1997","53","10","1396","1400","10.1107/S0108270197006690","","","0.71073","MoKα","","0.0822","0.0482","","0.1348","0.1162","","","","1.059","1.118","1.118","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006599","15.85","0.001","12.4271","0.0006","19.935","0.002","90","","103.96","0.004","90","","3810.6","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(acetatotriphenylphosphinesilver(I)] hydrate","","- C40 H38 Ag2 O5 P2 -","- C40 H38 Ag2 O5 P2 -","- C160 H152 Ag8 O20 P8 -","4","1","KH1148","Ng, Seik Weng; Othman, A. Hamid","Silver Acetate‒Triphenylphosphine Complexes. Acetatobis(triphenylphosphine)silver(I) and its Sesquihydrate, and Bis[acetato(triphenylphosphine)silver(I)] Hydrate and its Hemihydrate","Acta Crystallographica Section C","1997","53","10","1396","1400","10.1107/S0108270197006690","","","0.71073","MoKα","","0.0551","0.0449","","0.1178","0.1107","","","","1.138","1.18","1.18","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006600","12.1443","0.0006","19.2794","0.0008","15.8815","0.0009","90","","90","","90","","3718.4","0.3","298","2","298","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","Bis[acetatotriphenylphosphinesilver(I)] hemihydrate","","- C40 H37 Ag2 O4.5 P2 -","- C40 H37 Ag2 O4.5 P2 -","- C160 H148 Ag8 O18 P8 -","4","1","KH1148","Ng, Seik Weng; Othman, A. Hamid","Silver Acetate‒Triphenylphosphine Complexes. Acetatobis(triphenylphosphine)silver(I) and its Sesquihydrate, and Bis[acetato(triphenylphosphine)silver(I)] Hydrate and its Hemihydrate","Acta Crystallographica Section C","1997","53","10","1396","1400","10.1107/S0108270197006690","","","0.71073","MoKα","","0.0418","0.033","","0.08","0.0755","","","","1.048","1.065","1.065","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006601","5.2894","0.0005","8.6106","0.0008","9.1884","0.0009","101.801","0.007","97.055","0.009","96.293","0.008","402.61","0.07","300","2","300","2","","","","","","","","5","P -1","-P 1","2","","Bis-4,4'pyridiniumdiazomethane diperchlorate","","- C12 H12 Cl2 N4 O8 -","- C12 H12 Cl2 N4 O8 -","- C12 H12 Cl2 N4 O8 -","1","0.5","KH1150","Chen, Wei; Liu, Cai-ming; Li, Da-guang; You, Xiao-zeng","4,4'-Azinodimethyldipyridinium Diperchlorate, C~12~H~12~N~4~^2+^.2ClO~4~^{-^}","Acta Crystallographica Section C","1997","53","10","1499","1501","10.1107/S0108270197005970","","","0.71073","MoKα","","0.0584","0.0411","","0.1099","0.1024","","","","1.019","1.107","1.107","","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2006602","6.193","0.001","9.077","0.001","15.882","0.0002","90.69","0.01","96.39","0.01","101.75","0.01","868.1","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tris(3-chlorophenyl)phosphine oxide.","","- C18 H12 Cl3 O P -","- C18 H12 Cl3 O P -","- C36 H24 Cl6 O2 P2 -","2","1","MU1324","Shawkataly, Omar bin; Ramalingam, Kuppukkannu; Selvakumar, Suppramanian; Fun, Hoong-Kun; Ibrahim, Abdul Razak","Tris(3-chlorophenyl)phosphine Oxide","Acta Crystallographica Section C","1997","53","10","1451","1452","10.1107/S0108270197006045","","","0.71073","MoKα","","0.0958","0.0612","","0.1746","0.159","","","","0.908","1.084","1.084","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006603","7.957","0.001","10.677","0.001","14.909","0.002","90","","100.51","0.01","90","","1245.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 N4 O3 -","- C13 H10 N4 O3 -","- C52 H40 N16 O12 -","4","1","MU1325","Hoong-Kun Fun; Zhong-Lin Lu; Chun-Ying Duan; Yu-Peng Tian; Xiao-Zeng You; Yu-Mei Guo; Xiao-Yang Gong","<i>p</i>-Nitrobenzaldehyde Isonicotinoylhydrazone","Acta Crystallographica Section C","1997","53","10","1452","1454","10.1107/S0108270197008135","","","0.71073","MoKα","","0.0719","0.0407","","0.1135","0.1034","","","","0.903","1.079","1.079","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006604","13.531","0.001","11.766","0.001","10.272","0.003","90","","106.71","0.01","90","","1566.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 N3 O2 -","- C16 H19 N3 O2 -","- C64 H76 N12 O8 -","4","1","MU1326","Hoong-Kun Fun; Zhong-Lin Lu; Chun-Ying Duan; Yu-Peng Tian; Xiao-Zeng You; Xiao-Yang Gong; Yu-Mei Guo","<i>p</i>-(Dimethylamino)benzaldehyde Benzoylhydrazone Monohydrate","Acta Crystallographica Section C","1997","53","10","1454","1455","10.1107/S0108270197008147","","","0.71073","MoKα","","0.1472","0.0456","","0.1258","0.0973","","","","0.788","1.092","1.092","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006605","9.035","0.001","12.501","0.001","6.9634","0.0005","96.62","0.01","102.08","0.01","73.56","0.01","736.31","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-chloro-3-methoxycarbonyl-2-dimethoxyphosphoryl-2H-1-benzopyran","","- C13 H14 Cl O6 P -","- C13 H14 Cl O8 P -","- C26 H28 Cl2 O16 P2 -","2","1","NA1207","Olszak, Tomasz A.; Grabowski, Mieczysław J.; Stępień, Andrzej; Modranka, R.; Kostka, K.","2H-1-Benzopyrans. 4-Chloro-3-methoxycarbonyl-2-dimethoxyphosphoryl-2H-1-benzopyran, (I) and 4-Chloro-2-dimethoxyphosphoryl-2H-1-benzopyran, (II)","Acta Crystallographica Section C","1997","53","","1514","1516","10.1107/S010827019700735X","","","1.54178","CuKα","","0.0444","0.0328","","0.0931","0.0901","","","","1.038","1.195","1.195","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006606","7.8864","0.0005","11.3138","0.001","7.2675","0.0006","108.444","0.007","92.736","0.007","82.8","0.007","610.26","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-chloro-2-dimethoxyphosphoryl-2H-1-benzopyran","","- C11 H12 Cl O4 P -","- C11 H12 Cl O4 P -","- C22 H24 Cl2 O8 P2 -","2","1","NA1207","Olszak, Tomasz A.; Grabowski, Mieczysław J.; Stępień, Andrzej; Modranka, R.; Kostka, K.","2H-1-Benzopyrans. 4-Chloro-3-methoxycarbonyl-2-dimethoxyphosphoryl-2H-1-benzopyran, (I) and 4-Chloro-2-dimethoxyphosphoryl-2H-1-benzopyran, (II)","Acta Crystallographica Section C","1997","53","","1514","1516","10.1107/S010827019700735X","","","1.54178","CuKα","","0.0469","0.0325","","0.091","0.0881","","","","0.966","1.082","1.082","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006607","16.657","0.001","7.351","0.002","18.4","0.002","90","","108.3","0.01","90","","2139.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(2-phenylethyl)-3,3,6,6 tetramethyl-3,4,6,7,910-hexahydro-1,8(2H,5H) acridine dione","","- C25 H31 N O2 -","- C25 H31 N O2 -","- C100 H124 N4 O8 -","4","1","NA1284","K. Gunasekaran; D. Velmurugan; P. Murugan","3,3,6,6-Tetramethyl-9-(2-phenylethyl)-3,4,6,7,9,10-hexahydro-1,8(2<i>H</i>,5<i>H</i>)-acridinedione","Acta Crystallographica Section C","1997","53","10","1512","1514","10.1107/S0108270197006987","","","0.71073","MoKα","","0.0583","0.0515","","0.1604","0.1386","","","","1.066","1.096","1.096","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006608","10.497","0.002","13.332","0.003","19.369","0.004","90","","90","","90","","2710.6","1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2S)-(+)-Dicarbonyl[h5-(2,6,6-trimethyl-cyclohepta-2,4-diene-1-on)] triphenylphosphan-iron","","- C30 H29 Fe O3 P -","- C30 H29 Fe O3 P -","- C120 H116 Fe4 O12 P4 -","4","1","NA1298","Petrowitsch, Tanja; Grosser, Rolf; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","(2<i>S</i>)-(+)-Dicarbonyl(η^4^-2,6,6-trimethylcyclohepta-2,4-dienone)(triphenylphosphine-<i>P</i>)iron","Acta Crystallographica Section C","1997","53","10","1383","1384","10.1107/S010827019700718X","","","0.71069","MoKα","","0.087","0.034","","0.05","0.044","","","","0.825","0.952","0.952","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006609","7.642","0.004","19.928","0.008","8.388","0.004","90","","113.23","0.02","90","","1173.8","1","291","1","291","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Dimethyl 2-iodobenzoylphosphonate","2-iodobenzoylphosphonic acid dimethyl ester","","- C9 H10 I O4 P -","- C9 H10 I O4 P -","- C36 H40 I4 O16 P4 -","4","1","NA1305","Griffiths, D. Vaughan; Harris, Jayne E.; Miller, John R.","Dimethyl 2-Iodobenzoylphosphonate, an Unusual Example of a Crystalline α-Ketophosphonate","Acta Crystallographica Section C","1997","53","10","1462","1464","10.1107/S0108270197006252","","","0.71073","MoKα","","0.0424","0.0335","","0.0966","0.0906","","","","1.147","1.173","1.173","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006610","9.097","0.002","13.94","0.002","8.933","0.003","98.89","0.02","114.81","0.02","83.16","0.02","1014","0.5","296","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C10 H26 K N2 O15 Yb -","- C10 H26 K N2 O15 Yb -","- C20 H52 K2 N4 O30 Yb2 -","2","1","OA1022","Sakagami, Narumi; Homma, Jun-ichi; Konno, Takumi; Okamoto, Ken-ichi","Potassium Diaqua(ethylenediaminetetraacetato)ytterbate(III) Pentahydrate","Acta Crystallographica Section C","1997","53","10","1376","1378","10.1107/S0108270197006094","","","0.7107","MoKα","","","0.0262","","","0.038","","","","","1.007","1.007","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006611","14.531","0.004","15.867","0.005","13.481","0.004","90","","90","","90","","3108.2","1.6","293.2","","293.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H21 I N2 O -","- C14 H21 I N2 O -","- C112 H168 I8 N16 O8 -","8","1","OA1026","Mikata, Yuji","Out-of-Plane Orientation of the Carbamoyl Group in an NAD Model Compound: Preferred 1,3-Diaxial Methyl Configuration","Acta Crystallographica Section C","1997","53","10","1486","1488","10.1107/S0108270197006926","","","0.7107","MoKα","","0.129","0.051","","0.096","0.071","","","","0.988","1","1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006612","9.974","0.0002","6.752","0.0001","12.4097","0.0002","90","","110.34","0.001","90","","783.61","0.02","133","","133","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5,5-dimethyl-1,3-cyclohexanedione","","- C8 H12 O2 -","- C8 H12 O2 -","- C32 H48 O8 -","4","1","QA0018","Bolte, Michael; Scholtyssik, Maria","Dimedone at 133K","Acta Crystallographica Section C","1997","53","10","IUC9700013","","10.1107/S0108270197099423","","","0.71073","MoKα","","0.0402","0.0335","","0.091","0.0872","","","","1.066","1.107","1.107","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006613","9.489","0.001","12.728","0.002","21.415","0.002","90","","90","","90","","2586.4","0.5","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-Ethyl-3-(4-methyl-benzolsulfonyl)-2-(4-hydroxy-5- ((1'-hydroxy)-propyl)-2-phenyl-cyclohex-2-ene)-1,3-oxazolidine","","- C27 H35 N O5 S -","- C27 H35 N O5 S -","- C108 H140 N4 O20 S4 -","4","1","QA0020","Bolte, Michael; Monz, Sabine","4-Ethyl-2-[4-hydroxy-5-(1-hydroxypropyl)-2-phenyl-2-cyclohexenyl]-3-tosyl-1,3-oxazolidine","Acta Crystallographica Section C","1997","53","10","IUC9700014","","10.1107/S0108270197099411","","","1.5418","CuKα","","0.046","0.045","","0.1188","0.1169","","","","1.07","1.068","1.068","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006614","5.7263","0.001","6.5517","0.0012","8.8001","0.0007","92.647","0.011","95.889","0.01","105.474","0.014","315.57","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Ethylene diammonium monohydrogenmaleate","","","- C10 H16 N2 O8 -","- C10 H16 N2 O8 -","- C10 H16 N2 O8 -","1","0.5","QB0015","Barnes, John C.; Weakley, Timothy J.R.","Hydrogen Bond Network in Ethylenediammonium Bis(hydrogenmaleate)","Acta Crystallographica Section C","1997","53","10","IUC9700018","","10.1107/S0108270197099381","","","0.71069","MoKα","","0.0355","0.0323","","","","0.1025","","","","","","1.124","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006615","25.4066","0.0003","20.9992","0.0001","15.2026","0.0002","90","","109.024","0.001","90","","7667.87","0.15","133","","133","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,3-Bis-(2,4,6-Triphenyl-pyrimidin-5-yl)-urea","","- C48 H38 N6 O2 -","- C48 H38 N6 O2 -","- C384 H304 N48 O16 -","8","1","QB0016","Bolte, Michael","1,3-Bis(2,4,6-triphenylpyrimidin-5-yl)urea‒Acetone (1/1) at 133K","Acta Crystallographica Section C","1997","53","10","IUC9700015","","10.1107/S010827019709940X","","","0.71073","MoKα","","0.0504","0.0397","","0.1036","0.0954","","","","1.046","1.057","1.057","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006616","31.441","0.005","8.3824","0.0011","15.409","0.002","90","","102.09","0.012","90","","3971","1","288","2","288","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(N,N-dimethyl-2-pyridin-1H-iumamine) Tetrachlorocobaltate(II)","","- C14 H22 Cl4 Co N4 -","- C14 H22 Cl4 Co N4 -","- C112 H176 Cl32 Co8 N32 -","8","1","QB0019","Land, John M.; Baughman, Russell G.; Hester, Colin A.","Bis[2-(dimethylamino)pyridinium] Tetrachlorocobaltate(II)","Acta Crystallographica Section C","1997","53","10","IUC9700016","","10.1107/S0108270197099435","","","0.71073","MoKα","","0.066","0.04","","0.096","0.083","","","","1.045","1.095","1.095","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006617","22.874","0.006","5.101","0.001","18.261","0.004","90","","122.87","0.01","90","","1789.6","0.7","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","(S,S)-2-methyl-4-phenyl-N-[(methoxycarbonyl)phenylmethyl]butanamide","","- C20 H23 N O3 -","- C20 H23 N O3 -","- C80 H92 N4 O12 -","4","1","QB0020","Yoshinobu Inouye; Tetsuya Yabuuti; Takenori Kusumi","Conformation of (<i>S</i>,<i>S</i>)-Methyl (2-Methyl-4-phenylbutanamido)(phenyl)acetate","Acta Crystallographica Section C","1997","53","10","IUC9700017","","10.1107/S0108270197099393","","","0.71073","MoKα","","0.0981","0.0466","","0.133","0.1107","","","","1.043","1.092","1.092","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006618","8.493","0.001","11.253","0.002","11.368","0.002","90","","108.46","0.02","90","","1030.6","0.3","153","2","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H33 N O3 -","- C22 H33 N O3 -","- C44 H66 N2 O6 -","2","1","SK1038","Ertan, Mevlût; Yeşi̇lada, Akgül; Tozkoparan, Birsen; Tarimci, Çeli̇k; Krebs, Bernt; Läge, Mechtild","(1<i>R</i>,2<i>S</i>,4<i>S</i>,11<i>S</i>)-4-Isopropyl-1-methyl-2-(α-<i>N</i>-morpholino-3-methoxybenzyl)cyclohexan-3-one","Acta Crystallographica Section C","1997","53","10","1466","1468","10.1107/S0108270197005064","","","0.71073","MoKα","","0.0367","0.0305","","0.0704","0.0686","","","","","0.943","0.943","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006619","8.962","0.003","9.651","0.004","10.009","0.004","68.45","0.03","71.46","0.03","81.52","0.03","762.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl 9-Methyl-11-thioxo-8-oxa-12-acetyl-10,12-diazatricyclo[7.3.1.0^2,7^] trideca-2,4,6-triene-13-carboxylate","","- C15 H16 N2 O4 S -","- C15 H16 N2 O4 S -","- C30 H32 N4 O8 S2 -","2","1","SK1098","Kettmann, Viktor; Svetlík, Ján","Methyl 12-Acetyl-9-methyl-11-thioxo-8-oxa-10,12-diazatricyclo[7.3.1.0^2,7^]trideca-2,4,6-triene-13-carboxylate","Acta Crystallographica Section C","1997","53","10","1493","1495","10.1107/S010827019700557X","","","0.71073","MoKα","","0.0713","0.0505","","0.1453","0.1133","","","","1.041","1.132","1.132","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006620","13.891","0.002","15.426","0.003","11.014","0.002","102.81","0.02","104.94","0.02","102.71","0.02","2125.2","0.8","291","","291","","","","","","","","","5","P -1","-P 1","2","","","","- C48 H34 F6 N2 O7 -","- C48 H34 F6 N2 O7 -","- C96 H68 F12 N4 O14 -","2","1","SX1009","Swenson, Dale C.; Yamamoto, Michiharu; Burton, Donald J.","A <i>trans</i>-1,2-Diarylhexafluorocyclobutane","Acta Crystallographica Section C","1997","53","10","1445","1447","10.1107/S0108270197003764","","","0.71073","MoKα","","0","0.054","","","0.078","","","","","1.469","1.469","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2006621","22.212","0.005","11.646","0.004","19.681","0.004","90","","90","","90","","5091","2","291","","291","","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C28.5 H35.5 Cl1.5 N O -","- C28.518 H35 Cl1.554 N O -","- C228.144 H280 Cl12.432 N8 O8 -","8","1","SX1011","Swenson, Dale C.; TePaske, Mark R.; Baenziger, Norman C.; Gloer, James B.","Tubingensin B, a Cytotoxic Carbazole Alkaloid from the Sclerotia of <i>Aspergillus tubingensis</i>","Acta Crystallographica Section C","1997","53","10","1447","1449","10.1107/S0108270197003776","","","0.71073","MoKα","","0.0496","0.0403","","0.1116","0.1023","","","","1.166","1.144","1.144","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006622","11.871","0.001","21.586","0.002","8.484","0.001","90","0.01","102.58","0.01","90","0.01","2121.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 N4 O7 Si -","- C18 H28 N4 O7 Si -","- C72 H112 N16 O28 Si4 -","4","1","SX1022","White, Jonathan M.; Tham, Wai-Ying","9a-Trimethylsilyloctahydroquinolizinium Picrate","Acta Crystallographica Section C","1997","53","10","1471","1472","10.1107/S0108270197006100","","","0.71069","MoKα","","0.0587","0.05","","0.1392","0.1331","","","","1.034","1.089","1.089","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006623","6.5362","0.0006","12.4737","0.0012","32.056","0.003","90","","90","","90","","2613.5","0.4","122","1","122","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","quininium (S)-mandelate","","- C28 H32 N2 O5 -","- C28 H32 N2 O5 -","- C112 H128 N8 O20 -","4","1","SX1027","Gjerløv, Anne B.; Larsen, Sine","Quininium (<i>S</i>)-Mandelate","Acta Crystallographica Section C","1997","53","10","1505","1508","10.1107/S0108270197006112","","","1.54184","CuKα","","0.0291","0.027","","0.0708","0.07","","","","1.059","1.074","1.074","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006624","9.006","0.002","6.6905","0.0013","10.963","0.002","90","","97.415","0.014","90","","655","0.2","158","","158","","","","","","","","","3","P 1 21 1","P 2yb","4","Aloperine","(6R,7R,9R,11S)‒16,17-Didehydro‒9‒de‒2‒piperidinylormosanine","","- C15 H24 N2 -","- C15 H24 N2 -","- C30 H48 N4 -","2","1","SX1032","Brosius, Arthur D.; Ziller, Joseph W.; Zhang, Qiming","Relative and Absolute Configuration of Aloperine","Acta Crystallographica Section C","1997","53","10","1510","1512","10.1107/S0108270197009244","","","0.71073","MoKα","","0.055","0.0383","","0.1015","0.0931","","","","1.076","1.117","1.117","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006625","9.6442","0.0012","11.2487","0.0012","15.097","0.002","90","","90","","90","","1637.8","0.3","158","","158","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Aloperine dihydrochloride monohydrate","(6R,7R,9R,11S)‒16,17-Didehydro‒9‒de‒2‒piperidinylormosanine dihydrochloride monohydrate","","- C15 H28 Cl2 N2 O -","- C15 H28 Cl2 N2 O -","- C60 H112 Cl8 N8 O4 -","4","1","SX1032","Brosius, Arthur D.; Ziller, Joseph W.; Zhang, Qiming","Relative and Absolute Configuration of Aloperine","Acta Crystallographica Section C","1997","53","10","1510","1512","10.1107/S0108270197009244","","","0.71073","MoKα","","0.0371","0.0295","","0.0727","0.0693","","","","1.04","1.052","1.052","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006626","6.536","0.004","15.626","0.003","10.029","0.002","90","","90","","90","","1024.3","0.7","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","calcium yttrium silicate","tricalcium diyitrium trisilicon oxide","","- Ca3 O12 Si3 Y2 -","- Ca2.998 O12 Si3 Y1.998 -","- Ca11.992 O48 Si12 Y7.992 -","4","0.5","TA1145","Yamane, Hisanori; Nagasawa, Toru; Shimada, Masahiko; Endo, Tadashi","Ca~3~Y~2~(SiO~4~)~3~","Acta Crystallographica Section C","1997","53","10","1367","1369","10.1107/S0108270197005593","","","0.71069","MoKα","","0.0367","0.0347","","0.0998","0.098","","","","1.038","1.053","1.053","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006627","7.377","0.001","18.664","0.003","9.897","0.002","90","","95.314","0.008","90","","1356.8","0.4","298","2","298","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","(1α,2β,3α,6α,7β,8α,9β,13β)-9,13-dibromo-11-methyl-11-aza- 14,15-dioxa-11-pentacyclo [6.5.1.1^3,6^.0^2,7^.0^9,13^] pentadec-4-en-10,12-dione","","- C13 H11 Br2 N O4 -","- C13 H11 Br2 N O4 -","- C52 H44 Br8 N4 O16 -","4","1","TA1163","Warrener, Ronald N.; Maksimovic, L.; Kennard, Colin H. L.","(1α,2β,3α,6α,7β,8α,9β,13β)-9,13-Dibromo-11-methyl-14,15-dioxa-11-azapentacyclo[6.5.1.1^3,6^.0^2,7^.0^9,13^]pentadec-4-ene-10,12-dione","Acta Crystallographica Section C","1997","53","10","1501","1502","10.1107/S0108270197006616","","","0.71073","MoKα","","0.116","0.047","","0.139","0.11","","","","1.025","1.098","1.098","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006628","9.411","0.001","10.427","0.002","7.93","0.002","104.99","0.01","103.74","0.01","92.72","0.01","725.2","0.2","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","(3aα,10aα)11,11 Dibromo-6-methoxy-2,3,9,10-tetrahydro-1H,4H-3a,10a- methano[f]azulene'","","- C16 H16 Br2 O2 -","- C16 H16 Br2 O2 -","- C32 H32 Br4 O4 -","2","1","TA1166","Mackay, Maureen F.; Banwell, Martin G.; Phyland, James R.","A Benzannulated [5.3.1] Propellanone Related to the <i>ABC</i> Ring System of Taxol^TM^","Acta Crystallographica Section C","1997","53","10","1497","1499","10.1107/S0108270197007531","","","1.5418","CuKα","","0.0458","0.044","","0.137","0.1327","","","","1.081","1.086","1.086","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006629","6.474","0.001","11.393","0.001","11.862","0.003","66.16","0.02","89.2","0.04","84.92","0.02","796.9","0.3","295","1","295","1","","","","","","","","3","P -1","-P 1","2","cyclohexene-keto acid","4-(1-Hydroxy-1-phenylmethylene)-3-oxo-5-phenyl-5-cyclohexene carboxylic acid","","- C20 H16 O4 -","- C20 H16 O4 -","- C40 H32 O8 -","2","1","AB1478","Mrvoš-Sermek, Draginja; Tralić-Kulenović, Vesna; Lazarević, Zvjezdana","4-[Hydroxy(phenyl)methylene]-5-oxo-3-phenyl-2-cyclohexenecarboxylic Acid","Acta Crystallographica Section C","1997","53","11","1709","1711","10.1107/S0108270197005465","","","0.71073","MoKα","","0.1827","0.0479","","0.1434","0.0997","","","","0.925","1.105","1.105","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006630","7.567","0.011","9.297","0.013","12.281","0.014","72","0.08","80.21","0.08","81.04","0.08","804.8","1.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Ni(cdsalen)","methyl 2-{N-[2-(2-hydroyphenyl)methylidynenitrilo]ethyl}amino- 1-cyclopentenedithiocarboxilate of nickel(II)","","- C16 H18 N2 Ni O S2 -","- C16 H18 N2 Ni O S2 -","- C32 H36 N4 Ni2 O2 S4 -","2","1","AB1482","de Castro, Baltazar; Pereira, Eulalia; Gomes, Ligia","A Nickel Complex with an Asymmetric N~2~OS Schiff Base Ligand","Acta Crystallographica Section C","1997","53","11","1572","1574","10.1107/S0108270197009219","","","0.71069","MoKα","","0.132","0.0576","","0.2162","0.1415","","","","1.091","1.111","1.111","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006631","8.7507","0.0016","12.5722","0.0013","12.927","0.002","71.248","0.011","70.267","0.014","86.458","0.012","1265.9","0.4","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H22 N2 O3 Pd -","- C30 H22 N2 O3 Pd -","- C60 H44 N4 O6 Pd2 -","2","1","AV1007","Kooijman, Huub; Spek, Anthony L.; van Belzen, Ruud; Elsevier, Cornelis J.","{1,2-Bis[<i>N</i>-(4-methylphenyl)imino-<i>N</i>]acenaph-thene}(η^2^-maleic anhydride)palladium(0)","Acta Crystallographica Section C","1997","53","11","1593","1596","10.1107/S0108270197007865","","","0.71073","MoKα","","0.064","0.064","","0.144","0.144","","","","0.957","0.957","0.957","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006632","5.995","0.001","8.726","0.001","14.535","0.002","90","","90","","90","","760.36","0.19","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Hygric acid","L-1-Methylproline","","- C6 H13 N O3 -","- C6 H13 N O3 -","- C24 H52 N4 O12 -","4","1","BK1308","Toscano, Rubén A.; Enríquez, Raúl G.; Reynolds, William F.; Magos, Gil A.; Gnecco, Dino","<small>L</small>-1-Methylproline Monohydrate","Acta Crystallographica Section C","1997","53","11","1690","1692","10.1107/S0108270197008706","","","0.71073","MoKα","","0.067","0.048","","0.119","0.108","","","","1.05","1.1","1.1","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006633","6.291","0.002","8.259","0.002","18.054","0.003","96.53","0.01","91.39","0.02","112.06","0.02","861.4","0.4","140","","140","","","","","","","","","2","P -1","-P 1","2","","E-2,2,5,5-Tetramethyl-3,4-diphenylhex-3-ene","","- C22 H28 -","- C22 H28 -","- C44 H56 -","2","1","BK1316","Gano, James E.; Kluwe, Constanze; Kirschbaum, Kristin; Pinkerton, A. Alan; Sekher, Padmanabhan; Skrzypczak-Jankun, Ewa; Subramaniam, Girija; Lenoir, Dieter","(<i>E</i>)-2,2,5,5-Tetramethyl-3,4-diphenylhex-3-ene, C~22~H~28~","Acta Crystallographica Section C","1997","53","11","1723","1725","10.1107/S0108270197007117","","","0.71073","MoKα","","0.068","0.049","","","0.066","","","","","2.5","2.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006634","8.2725","0.0007","13.273","0.001","9.5548","0.0007","90","","97.51","0.006","90","","1040.13","0.14","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-Nitroanilino)cyclopent-2-en-1-one","","- C11 H10 N2 O3 -","- C11 H10 N2 O3 -","- C44 H40 N8 O12 -","4","1","BK1319","Huang, Kin-Shan; Stowell, Joseph G.; Byrn, Stephen R.","3-(4-Nitroanilino)-2-cyclopenten-1-one","Acta Crystallographica Section C","1997","53","11","1717","1719","10.1107/S0108270197007622","","","1.54184","CuKα","","","0.045","","","0.117","","","","","1.068","1.068","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006635","8.309","0.005","11.42","0.004","10.766","0.004","90","","95.5","0.4","90","","1016.9","1.1","148","","148","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dicarbonyl(η^5^-cyclopentadienyl)(η^1^-pyrrolyl)iron(II)","","- C11 H9 Fe N O2 -","- C11 H9 Fe N O2 -","- C44 H36 Fe4 N4 O8 -","4","1","BK1322","Powell, Madison; Bailey, Rosa D.; Eagle, Cassandra T.; Schimek, George L.; Hanks, T. W.; Pennington, William T.","Dicarbonyl(η^5^-cyclopentadienyl)(pyrrolyl-<i>N</i>)iron(II)","Acta Crystallographica Section C","1997","53","11","1611","1613","10.1107/S0108270197008718","","","0.71073","MoKα","","0.0592","0.032","","0.0418","0.0383","","","","","1.12","1.12","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2006636","10.031","0.002","10.547","0.002","14.861","0.003","90","","109.09","0.03","90","","1485.8","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Tetraamine-cis-bis(5-nitrotetrazolato)cobalt(III) Perchlorate","tetraamine-cis-bis(5-nitro-2H-tetrazolato-N^2^)cobalt(III) perchlorate","","- C2 H12 Cl Co N14 O8 -","- C2 H12 Cl Co N14 O8 -","- C8 H48 Cl4 Co4 N56 O32 -","4","1","BK1330","Bruno Morosin; Roberto G. Dunn; Roger Assink; Thomas M. Massis; John Fronabarger; Eileen N. Duesler","The Secondary Explosive Tetraammine-<i>cis</i>-bis(5-nitro-2<i>H</i>-tetrazolato-<i>N</i>^2^)cobalt(III) Perchlorate at 293 and 213 K","Acta Crystallographica Section C","1997","53","11","1609","1611","10.1107/S0108270197007634","","","0.71073","MoKα","","0.057","0.05","","0.138","0.1333","","","","1.08","1.118","1.118","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006637","9.946","0.007","10.542","0.005","14.82","0.007","90","","108.68","0.04","90","","1472","1.5","213","2","213","5","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Tetraammine-cis-bis(5-nitrotetrazolato)cobalt(III) Perchlorate","tetraammine-cis-bis(5-nitro-2H-tetrazolato-N^2^)cobalt(III) perchlorate","","- C2 H12 Cl Co N14 O8 -","- C2 H12 Cl Co N14 O8 -","- C8 H48 Cl4 Co4 N56 O32 -","4","1","BK1330","Bruno Morosin; Roberto G. Dunn; Roger Assink; Thomas M. Massis; John Fronabarger; Eileen N. Duesler","The Secondary Explosive Tetraammine-<i>cis</i>-bis(5-nitro-2<i>H</i>-tetrazolato-<i>N</i>^2^)cobalt(III) Perchlorate at 293 and 213 K","Acta Crystallographica Section C","1997","53","11","1609","1611","10.1107/S0108270197007634","","","0.71073","MoKα","","0.052","0.041","","0.116","0.1093","","","","1.03","1.094","1.094","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006638","5.72","0.001","7.081","0.001","14.121","0.003","90","","101.06","0.03","90","","561.32","0.18","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Cadmium thiosulfate, hydrate","","","- Cd H4 O5 S2 -","- Cd H4 O5 S2 -","- Cd4 H16 O20 S8 -","4","1","BK1331","Sergio Baggio; María I. Pardo; Ricardo Baggio; Oscar González","Cadmium Thiosulfate Dihydrate","Acta Crystallographica Section C","1997","53","11","1521","1523","10.1107/S0108270197006446","","","0.71073","MoKα","","0.032","0.03","","0.089","0.088","","","","1.23","1.253","1.253","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006639","8.5236","0.0008","8.9284","0.0007","9.9279","0.0008","90","","98.955","0.007","90","","746.32","0.11","150","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 Cu N6 O6 -","- C12 H16 Cu N6 O6 -","- C24 H32 Cu2 N12 O12 -","2","0.5","BM1138","Kooijman, Huub; Spek, Anthony L.; Daniëlle Rehorst; Driessen, Willem L.; Jan Reedijk","Bis(2-aminomethylpyridine-<i>N</i>,<i>N</i>')bis(nitrato-<i>O</i>)copper(II)","Acta Crystallographica Section C","1997","53","11","1596","1598","10.1107/S0108270197005118","","","0.71073","MoKα","","0.028","0.028","","0.078","0.078","","","","1.032","1.032","1.032","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006640","6.9518","0.0005","17.699","0.0013","13.5035","0.0011","90","","100.52","0.006","90","","1633.5","0.2","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Ni(tsalphen)]","[N,N'-Bis(2-thiobenzylidene)-1,2-phenylenediaminato]nickel(II)","","- C20 H14 N2 Ni S2 -","- C20 H14 N2 Ni S2 -","- C80 H56 N8 Ni4 S8 -","4","1","BM1141","Smeets, Wilberth J.J.; Spek, Anthony L.; Henderson, Richard K.; Bouwman, Elisabeth; Reedijk, Jan","[<i>N</i>,<i>N</i>'-Bis(2-thiobenzylidene)-1,2-phenylenediaminato]nickel(II)","Acta Crystallographica Section C","1997","53","11","1564","1566","10.1107/S0108270197009232","","","0.71073","MoKα","","0.038","0.029","","","","0.071","","","","","","1.066","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006641","11.056","0.004","8.34","0.002","15.5461","0.0012","90","","104.829","0.013","90","","1385.7","0.6","296","","296.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 N6 O2 -","- C13 H14 N6 O2 -","- C52 H56 N24 O8 -","4","1","BM1143","Helliwell, Madeleine; Dinsmore, Andrew; Garner, C. David; Joule, John A.","<i>N</i>-3-Allylation of 2-(<i>N</i>,<i>N</i>-Dimethylaminomethyleneamino)-6-formylpteridin-4-one","Acta Crystallographica Section C","1997","53","11","1667","1669","10.1107/S0108270197009116","","","0.71069","MoKα","","0.0746","0.05","","0.1472","0.1276","","","","1.045","1.088","1.088","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006642","12.4924","0.0002","9.8064","0.0002","30.4234","0.0003","90","","98.944","0.005","90","","3681.72","0.11","295","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H22 O3 Sn -","- C19 H22 O3 Sn -","- C152 H176 O24 Sn8 -","8","1","BM1153","Tahir, M. Nawaz; Ülkü, Dinçer; Ali, Saqib; Masood, Tariq; Danish, Mohammad; Mazhar, Mohammad","(Ketoprofenato)trimethyltin(IV)","Acta Crystallographica Section C","1997","53","11","1574","1576","10.1107/S0108270197007348","","","0.71073","MoKα","","","0.029","","","0.046","","","","","1.17","1.17","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006643","15.309","0.0007","10.553","0.0011","6.973","0.0014","90","","90","","90","","1126.5","0.3","153","2","153","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C12 H11 N3 O3 -","- C12 H11 N3 O3 -","- C48 H44 N12 O12 -","4","1","BM1160","Lydon, Kevin M.; McKee, Vickie; McKervey, M. Anthony","3-Diazo-1-benzyloxycarbonylpyrrolidin-2-one","Acta Crystallographica Section C","1997","53","11","1675","1676","10.1107/S0108270197007877","","","0.71073","MoKα","","0.031","0.0269","","0.0715","0.0686","","","","1.121","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006644","8.9047","0.0007","9.6102","0.0013","12.9962","0.0015","110.332","0.012","104.167","0.008","97.458","0.008","982.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","9,10-dihydrophenanthrene","","","- C23 H19 Cl O4 -","- C23 H19 Cl O4 -","- C46 H38 Cl2 O8 -","2","1","","Sarkhel, Sanjay; Goel, Atul; Ram, Vishnu J.; Chaudhuri, Siddhartha; Maulik, Prakas R.","Unusual Substitution of -SCH~3~ by -OH in 9,10-Dihydrophenanthrene","Acta Crystallographica Section C","1997","","","1713","1714","10.1107/S010827019700869X","","","","","","","0.0646","","","0.2228","","","","","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006645","17.674","0.003","17.674","0.003","12.516","0.003","90","","90","","120","","3385.8","1.1","298","","","","","","","","","","","3","P 63","P 6c","173","","","","- Al14.4 Cr3.4 Ni1.1 -","- Al14.6873 Cr3.175 -","- Al176.248 Cr38.1 -","12","2","BR1150","Sato, A.; Yamamoto, A.; Li, X. Z.; Hiraga, K.; Haibach, T.; Steurer, W.","A New Hexagonal κ Phase of Al‒Cr‒Ni","Acta Crystallographica Section C","1997","53","11","1531","1533","10.1107/S0108270197003430","","","0.71073","MoKα","","","0.052","","","0.057","","","","","2.5","2.5","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006646","10.8883","0.0004","6.3877","0.0001","8.4404","0.0003","90","","112.448","0.002","90","","542.56","0.03","300","","300","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Tricaesiumhydrogendiselenide","","- Cs3 H O8 Se2 -","- Cs3 H O8 Se2 -","- Cs6 H2 O16 Se4 -","2","0.25","BR1168","Sonntag, Rainer; Melzer, Rolf; Wessels, Thomas; Radaelli, Pablo G.","Cs~3~H(SeO~4~)~2~ at 300K by High-Resolution Neutron Powder Diffraction","Acta Crystallographica Section C","1997","53","11","1529","1531","10.1107/S0108270197007749","","neutron","1.5946","neutron","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006647","11.9931","0.0001","11.9931","0.0001","11.9931","0.0001","90","","90","","90","","1725.02","0.02","293","2","293","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","Hexasodium trizinc phosphate trihydrate","","- H6 Na6 O19 P4 Zn3 -","- H6 Na6 O19 P4 Zn3 -","- H24 Na24 O76 P16 Zn12 -","4","0.333333","BR1187","Xianhui Bu; Thurman E. Gier; William T. A. Harrison; Galen D. Stucky","A Cubic Hydrated Sodium Zinc Phosphate with a Tetrahedral-Triangular Framework Topology, Na~6~Zn~3~(PO~4~)~4~.3H~2~O","Acta Crystallographica Section C","1997","53","11","1517","1519","10.1107/S0108270197007889","","","0.71073","MoKα","","0.0209","0.0201","","0.0466","0.0463","","","","1.016","1.017","1.017","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006648","3.9241","0.0003","13.0404","0.0008","12.4181","0.0005","90","","92.21","0.01","90","","634.98","0.07","295","","295","","","","","","","","","5","P 1 n 1","","","","","","- C13 H12 Cl N O3 -","- C13 H12 Cl N O3 -","- C26 H24 Cl2 N2 O6 -","2","1","BS1020","Moreno-Fuquen, Rodolfo; Grajales-Tamayo, Mario; Gambardella, Maria Teresa do Prado","The 1:1 Complex Formed by 2-Picoline <i>N</i>-Oxide and 3-Chlorobenzoic Acid","Acta Crystallographica Section C","1997","53","11","1635","1637","10.1107/S0108270197007130","","","0.71073","MoKα","","0.0346","0.0293","","0.1175","0.1057","","","","1.067","1.006","1.006","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006649","9.156","0.003","9.509","0.002","8.701","0.002","99.41","0.02","116.03","0.02","73.95","0.02","653.4","0.3","293","2","293","","","","","","","","","3","P -1","-P 1","2","","","","- C28 H46 Ru -","- C32 H32 Ru -","- C32 H32 Ru -","1","0.5","BS1021","Overby, Jason S.; Farrar, John M.; Hanusa, Timothy P.","Bis(η^5^-1,2,4-triisopropylcyclopentadienyl)ruthenium","Acta Crystallographica Section C","1997","53","11","1605","1606","10.1107/S0108270197007014","","","1.5418","CuKα","","","0.035","","","0.0462","","","","","2.046","2.046","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006650","10.016","0.004","9.185","0.004","9.105","0.004","102.68","0.04","116.9","0.05","84.62","0.03","728.8","0.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","1,8a-dihydroazulene","1,1-dicyano-2-p-cyanophenyl-1,8a-dihydroazulene","","- C19 H11 N3 -","- C19 H11 N3 -","- C38 H22 N6 -","2","1","BS1031","Kaftory, Menahem; Botoshansky, Mark; Daub, Jörg; Christian Fischer; Alexander Bross","2-<i>p</i>-Cyanophenyl-1,8a-dihydroazulene-1,1-dicarbonitrile and Methyl 1-Cyano-2-<i>p</i>-cyanophenyl-1,8a-dihydroazulene-1-carboxylate","Acta Crystallographica Section C","1997","53","11","1665","1667","10.1107/S0108270197009499","","","0.71069","MoKα","","0.0738","0.0506","","0.1356","0.1201","","","","1.085","1.154","1.154","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006651","17.965","0.002","13.649","0.002","16.987","0.002","90","","129.514","0.005","90","","3213.4","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,8a-dihydroazulene","1-cyano,1-methoxycarbonyl-2-p-cyanophenyl-1,8a-dihydroazulene","","- C20 H14 N2 O2 -","- C20 H14 N2 O2 -","- C160 H112 N16 O16 -","8","1","BS1031","Kaftory, Menahem; Botoshansky, Mark; Daub, Jörg; Christian Fischer; Alexander Bross","2-<i>p</i>-Cyanophenyl-1,8a-dihydroazulene-1,1-dicarbonitrile and Methyl 1-Cyano-2-<i>p</i>-cyanophenyl-1,8a-dihydroazulene-1-carboxylate","Acta Crystallographica Section C","1997","53","11","1665","1667","10.1107/S0108270197009499","","","1.54178","CuKα","","0.0607","0.0378","","0.1192","0.1112","","","","1.099","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006652","17.366","0.003","8.196","0.002","20.999","0.004","90","","90","","90","","2988.8","1.1","291","2","291","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C16 H18 N4 O2 -","- C16 H18 N4 O2 -","- C128 H144 N32 O16 -","8","1","BS1041","De-Chun Zhang; Zheng-Hao Fei; Tian-Zhu Zhang; Yan-Qiu Zhang; Kai-Bei Yu","2-Nitro-4'-(<i>N</i>,<i>N</i>-diethylamino)azobenzene, C~16~H~18~N~4~O~2~","Acta Crystallographica Section C","1997","53","11","1647","1648","10.1107/S0108270197009517","","","0.71073","MoKα","","0.0631","0.0334","","0.0751","0.0694","","","","0.875","1.078","1.078","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006653","8.704","0.001","9.116","0.001","12.968","0.002","84.69","0.01","76.63","0.01","80.35","","985.3","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1-Methyl-4-(2-(2-hydroxy phenyl)vinyl) pyridium 4-tolylsulfonate hydrate Dimer: C14 H14 O2 N2^2+^.(C7 H7 S O3^-^)2. 2(H2 O)","","- C42 H46 N2 O10 S2 -","- C42 H46 N2 O10 S2 -","- C42 H46 N2 O10 S2 -","1","0.5","CF1158","Zhang, De-Chun; Zhang, Tian-Zhu; Zhang, Yan-Qiu; Fei, Zheng-Hao; Yu, Kai-bei","The Hydrated Tosylate of Dimeric 2'-Hydroxy-4-<i>N</i>-methylstilbazolium","Acta Crystallographica Section C","1997","53","11","1649","1650","10.1107/S0108270197008469","","","0.71073","MoKα","","0.0557","0.0378","","0.1124","0.0975","","","","0.981","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006654","8.612","0.002","11.658","0.003","11.914","0.002","79.72","0.02","85.97","0.02","76.73","0.02","1145","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2,6-Diamino-9-(carboxymethyl)purine Ethyl Ester","","- C9 H13 N6 O2.5 -","- C9 H13 N6 O2.5 -","- C36 H52 N24 O10 -","4","2","CF1160","Sood, Geeta; Schwalbe, Carl H.; Fraser, William","2,6-Diamino-9-(carboxymethyl)purine Ethyl Ester","Acta Crystallographica Section C","1997","53","11","1624","1626","10.1107/S0108270197006598","","","1.54178","CuKα","","0.0452","0.0428","","0.1428","0.1192","","","","1.096","1.114","1.114","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2006655","7.7208","0.0009","7.7501","0.0009","9.0531","0.001","90","","94.818","0.01","90","","539.8","0.11","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(+)-Camphorsulfonimine","","- C10 H15 N O2 S -","- C10 H15 N O2 S -","- C20 H30 N2 O4 S2 -","2","1","CF1189","Arindam Chakraborty; Jayanta Kumar Ray; Kandasamy Chinnakali; Ibrahim Abdul Razak; Hoong-Kun Fun","(+)-Camphorsulfonylimine","Acta Crystallographica Section C","1997","53","11","1725","1726","10.1107/S010827019701144X","","","0.71073","MoKα","","0.0569","0.0397","","0.0949","0.0895","","","","0.905","0.997","0.997","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006656","6.892","0.003","19.706","0.005","11.842","0.002","90","","94.24","0.02","90","","1603.9","0.9","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","bis(acetonitrile)tetrakis(N,N-dimethylacetamide)nickel(II) tetrafluoroborate","","- C20 H42 B2 F8 N6 Ni O4 -","- C20 H42 B2 F8 N6 Ni O4 -","- C40 H84 B4 F16 N12 Ni2 O8 -","2","0.5","DE1060","Suzuki, Honoh; Ishiguro, Shin-ichi","Steric Hindrance in a Mixed Solvated Nickel(II) Complex: Bis(acetonitrile-<i>N</i>)tetrakis(<i>N</i>,<i>N</i>-dimethylacetamide-<i>O</i>)nickel(II) Bis(tetrafluoroborate)","Acta Crystallographica Section C","1997","53","11","1602","1605","10.1107/S0108270197009463","","","0.71073","MoKα","","0.0984","0.0614","","0.1825","0.1453","","","","1.152","1.116","1.116","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006657","9.072","0.002","26.855","0.008","8.135","0.002","97.419","0.006","110.8","0.02","83.564","0.013","1832.5","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","n-butyl alpha-cyano-4-[2-(4-pyridyl)ethenyl]cinnamate","","- C21 H20 N2 O2 -","- C21 H20 N2 O2 -","- C84 H80 N8 O8 -","4","2","DE1061","Ohhara, Takashi; Hidehiro Uekusa; Yuji Ohashi; Shigehito Kondo; Masaki Hasegawa","<i>n</i>-Butyl α-Cyano-4-[2-(4-pyridyl)ethenyl]cinnamate","Acta Crystallographica Section C","1997","53","11","1692","1694","10.1107/S0108270197009475","","","0.7107","MoKα","","0.1211","0.0506","","0.156","0.1133","","","","1","1.111","1.111","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006658","5.339","0.001","9.923","0.001","4.488","0.001","90","","97.45","0.02","90","","235.76","0.07","293","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","Diphosphate synthétique de Cobalt: Co~2~P~2~O~7~","","- Co2 O7 P2 -","- Co2 O7 P2 -","- Co4 O14 P4 -","2","0.5","DU1177","Kobashi, Dilshat; Kohara, Shizuo; Yamakawa, Junji; Kawahara, Akira","Structure d'un Diphosphate Synthétique de Cobalt: Co~2~P~2~O~7~","Acta Crystallographica Section C","1997","53","11","1523","1525","10.1107/S0108270197006689","","","0.71069","MoKα","","","0.04","","","","0.052","","","","1.31","1.31","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006659","9.4881","0.001","10.3231","0.0011","16.3226","0.0011","90","","90.423","0.006","90","","1598.7","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H50 Ga2 N8 O20 P4 -","- C12 H42 Ga2 N8 O20 P4 -","- C24 H84 Ga4 N16 O40 P8 -","2","0.5","DU1179","Serpaggi, Fabien; Loiseau, Thierry; Férey, Gérard","A New Gallium Phosphate Templated by Tris(2-aminoethyl)amine: [Ga(HPO~4~)(PO~4~)(OH)].[(C~2~H~7~ N)~3~N].H~2~O","Acta Crystallographica Section C","1997","53","11","1568","1570","10.1107/S0108270197006458","","","0.71069","MoKα","","0.078","0.042","","0.133","0.12","","","","0.955","1.056","1.056","","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2006660","11.667","0.002","7.182","0.004","14.337","0.003","90","","97.61","0.02","90","","1190.8","0.7","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(25R)-5β-hydroxy-spirost-2-en-6-one","","- C27 H40 O4 -","- C27 H40 O4 -","- C54 H80 O8 -","2","1","FG1242","Angel Dago Morales; Ramón Pomés Hernández; Francisco Coll Manchado; María Teresa Hechavarría Fonseca; Graciela Punte; Gustavo Echeverría","(25<i>R</i>)-5β-Hydroxyspirost-2-en-6-one","Acta Crystallographica Section C","1997","53","11","1705","1706","10.1107/S0108270197006501","","","0.71069","MoKα","","0.2286","0.0703","","0.3332","0.1754","","","","0.986","0.901","0.901","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006661","6.393","0.002","7.433","0.001","21.067","0.003","90","","90.97","0.02","90","","1000.9","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","trans-Dichlorocyclamcobalt(III) chloride, tetrahydrate, 0.47(HCl)","trans-Dichloro-(1,4,8,11-tetraazacyclotetradecane)cobalt(III) chloride, tetrahydrate, 0.47 HCl","","- C10 H32.47 Cl3.47 Co N4 O4 -","- C10 H32.44 Cl3.468 Co N4 O4 -","- C20 H64.88 Cl6.936 Co2 N8 O8 -","2","0.5","FG1254","Sosa-Torres, Martha E.; Toscano, Rubén A.","<i>trans</i>-Dichloro(1,4,8,11-tetrazacyclotetradecane)cobalt(III) Chloride Tetrahydrate 0.47-Hydrochloride","Acta Crystallographica Section C","1997","53","11","1585","1588","10.1107/S0108270197007440","","","0.71069","MoKα","","0.0586","0.0413","","0.1101","0.0948","","","","1.072","1.098","1.098","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006662","9.724","0.001","11.055","0.001","16.361","0.002","79.79","0.01","79.19","0.01","73.7","0.01","1643.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H30 Cl2 N10 Ni -","- C32 H30 Cl2 N10 Ni -","- C64 H60 Cl4 N20 Ni2 -","2","1","FG1270","Thangarasu, Pandiyan; Bernès, Sylvain; Durán de Bazúa, Carmen","Bis[bis(benzimidazol-2-ylmethyl-<i>N</i>^3^)amine-<i>N</i>]nickel(II) Dichloride","Acta Crystallographica Section C","1997","53","11","1607","1609","10.1107/S0108270197006513","","","0.71073","MoKα","","0.1083","0.0547","","0.1305","0.1042","","","","1.072","1.12","1.12","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006663","23.756","0.002","6.9151","0.0005","28.381","0.002","90","","95.457","0.006","90","","4641.2","0.6","293","","293","","","","","","","","","3","A 1 2/a 1","-A 2ya","15","","","","- C24 H32 O7 -","- C24 H32 O7 -","- C192 H256 O56 -","8","1","FG1287","Drouin, Marc; Couturier, Michel; Pierre Deslongchamps","Diastereoselectivity in the Transannular Diels‒Alder Reaction of a <i>trans</i>-<i>trans</i>-<i>trans</i> 14-Membered Macrocycle Leading to Steroids","Acta Crystallographica Section C","1997","53","11","1698","1701","10.1107/S0108270197009578","","","1.54184","CopperKα","","0.096","0.06","","0.1764","0.1571","","","","1.071","1.255","1.255","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2006664","7.278","0.004","12.199","0.002","24.494","0.007","90","","91.89","0.03","90","","2173.5","1.4","293","2","193","","","","","","","","","3","P 1 21 1","P 2yb","4","","rac-3,3-bis(carbomethoxy)-18-methoxy-18-oxo-5β,9β,10α-androst-6-en-17-one","","- C24 H32 O7 -","- C24 H32 O7 -","- C96 H128 O28 -","4","2","FG1287","Drouin, Marc; Couturier, Michel; Pierre Deslongchamps","Diastereoselectivity in the Transannular Diels‒Alder Reaction of a <i>trans</i>-<i>trans</i>-<i>trans</i> 14-Membered Macrocycle Leading to Steroids","Acta Crystallographica Section C","1997","53","11","1698","1701","10.1107/S0108270197009578","","","1.54184","CopperKα","","0.0626","0.0599","","0.179","0.1749","","","","1.062","1.068","1.068","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006665","10.158","0.0002","10.158","0.0002","39.7543","0.0005","90","","90","","90","","4102.05","0.13","180","","180","","","","","","","","","6","P 41","P 4w","76","","","","- C48 H44 B F4 P2 Rh -","- C48 H44 B F4 P2 Rh -","- C192 H176 B4 F16 P8 Rh4 -","4","1","FG1294","Fu, Tai Y.; Liu, Zhaoqing; Rettig, Steven J.; Scheffer, John R.; Trotter, James","[(1,2,5,6-η)-1,5-Cyclooctadiene][(11<i>R</i>,12<i>R</i>)-9,10-dihydro-9,10-ethanoanthracene-11,12-bis(diphenylphosphino-<i>P</i>)]rhodium(I) Tetrafluoroborate","Acta Crystallographica Section C","1997","53","11","1577","1579","10.1107/S0108270197005271","","","0.7107","MoKα","","0.08","0.043","","0.086","","0.086","","","2.51","","","2.51","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006666","13.6819","0.0009","7.2379","0.0003","14.0407","0.0007","90","","111","0.01","90","","1298.07","0.15","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 N O3 -","- C14 H15 N O3 -","- C56 H60 N4 O12 -","4","1","FG1302","Moreno-Fuquen, Rodolfo; De Almeida Santos, Regina Helena; Gambardella, Maria Teresa do Prado","The 1:1 Complex Formed by 3-Picoline <i>N</i>-Oxide and <i>p</i>-Toluic Acid","Acta Crystallographica Section C","1997","53","11","1634","1635","10.1107/S0108270197007890","","","0.71073","MoKα","","0.0761","0.046","","0.1688","0.1324","","","","1.121","1.067","1.067","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006667","5.1318","0.0002","6.9156","0.0003","14.9166","0.0006","83.3087","0.0014","88.388","0.002","71.835","0.002","499.55","0.04","293","2","293","2","","","","","","","","4","P 1","P 1","1","Pseudouridine","2,4(1H,3H)-Pyrimidinedione,5-β-D-ribofuranosyl","","- C9 H12 N2 O6 -","- C9 H12 N2 O6 -","- C18 H24 N4 O12 -","2","2","FG1303","Hempel, Andrew; Lane, Byron G.; Camerman, Norman","Pseudouridine","Acta Crystallographica Section C","1997","53","11","1707","1709","10.1107/S0108270197009323","","","0.71013","MoKα","","0.2477","0.0918","","0.2851","0.1898","","","","0.927","1.044","1.044","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006668","16.921","0.002","4.5252","0.0004","17.898","0.002","90","","112.655","0.011","90","","1264.7","0.3","293","2","293","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","perilo(1,12-b,c,d)thiophene","","- C20 H10 S -","- C20 H10 S -","- C80 H40 S4 -","4","1","FG1306","Santos, Isabel C.; Almeida, Manuel; Morgado, Jorge; Duarte, M. Teresa; Alcácer, Luís","Perylo[1,12-<i>b</i>,<i>c</i>,<i>d</i>]thiophene","Acta Crystallographica Section C","1997","53","11","1640","1642","10.1107/S0108270197007907","","","0.71069","MoKα","","0.0873","0.04","","0.124","0.0901","","","","1.129","1.037","1.037","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006669","5.1928","0.0005","20.405","0.002","29.517","0.003","90","","90","","90","","3127.6","0.5","183","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2,6-Dibenzoyl-1,4-benzoquinone","","- C20 H12 O4 -","- C20 H12 O4 -","- C160 H96 O32 -","8","1","FG1318","Kumar Biradha; Michael J. Zaworotko; Ashwini Nangia; Gautam R. Desiraju","2,6-Dibenzoyl-1,4-benzoquinone","Acta Crystallographica Section C","1997","53","11","1653","1655","10.1107/S0108270197007579","","","0.71073","MoKα","","0.1025","0.0517","","0.1448","","0.1448","","","1.04","1.023","1.023","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006670","8.0485","0.0009","14.301","0.002","13.2703","0.0014","90","","91.769","0.007","90","","1526.7","0.3","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3aR*,4S*,5S*,7aR*)-4-nitrobenzoic acid 5-methyl-1,3,3,4,5,7a-hexahydroisobenzofuran-4-yl ester","","- C16 H17 N O5 -","- C16 H17 N O5 -","- C64 H68 N4 O20 -","4","1","FG1329","Batey, Robert A.; Lin, Denny; Lough, Alan J.","(3a<i>R</i>*,4<i>S</i>*,5<i>S</i>*,7a<i>R</i>*)-4-Nitrobenzoic Acid 5-Methyl-1,3,3a,4,5,7a-hexahydroisobenzofuran-4-yl Ester","Acta Crystallographica Section C","1997","53","11","1721","1723","10.1107/S0108270197007026","","","0.71073","MoKα","","0.0607","0.0433","","0.1288","0.1212","","","","1.045","1.165","1.165","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006671","16.889","0.001","9.2407","0.0005","6.2644","0.0006","90","","90","","90","","977.66","0.12","296","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","cyclohexanespiro-5'-hydantoin monohydrate","","- C8 H14 N2 O3 -","- C8 H14 N2 O3 -","- C32 H56 N8 O12 -","4","1","FG1332","Gauthier, Ted J.; Yokum, T. Scott; Morales, Guillermo A.; McLaughlin, Mark L.; Liu, Yen-Hsiang; Fronczek, Frank R.","Two Cyclohexanespiro-5'-hydantoin Monohydrates","Acta Crystallographica Section C","1997","53","11","1659","1661","10.1107/S0108270197007488","","","1.54184","CuKα","","","0.038","","","0.039","","","","","1.466","1.466","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006672","11.991","0.001","8.3535","0.0007","15.159","0.001","90","","94.731","0.008","90","","1513.3","0.2","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(3-Indolyl)cyclohexanespiro-5'-hydantoin","","- C16 H19 N3 O3 -","- C16 H19 N3 O3 -","- C64 H76 N12 O12 -","4","1","FG1332","Gauthier, Ted J.; Yokum, T. Scott; Morales, Guillermo A.; McLaughlin, Mark L.; Liu, Yen-Hsiang; Fronczek, Frank R.","Two Cyclohexanespiro-5'-hydantoin Monohydrates","Acta Crystallographica Section C","1997","53","11","1659","1661","10.1107/S0108270197007488","","","1.54184","CuKα","","","0.054","","","0.088","","","","","1.533","1.533","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006673","9.8918","0.001","11.6789","0.0012","12.6536","0.0012","90","","95.819","0.008","90","","1454.3","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Benzylselenolato(η^5^-cyclopentadienyl)(tricarbonyl)molybdenum(II)","","- C15 H12 Mo O3 Se -","- C15 H12 Mo O3 Se -","- C60 H48 Mo4 O12 Se4 -","4","1","FG1338","Thöne, Carsten; Jones, Peter G.; Laube, Jörg","Organometallic Selenolates. VII. (Benzylselenolato-<i>Se</i>)tricarbonyl(η^5^-cyclopentadienyl)molybdenum(II) and Bis[1,2(η^5^)-cyclopentadienyl]-di-μ-ethylselenolato-di-μ-selenido-dimolybdenum(IV)(<i>Mo</i>—<i>Mo</i>)","Acta Crystallographica Section C","1997","53","11","1539","1542","10.1107/S0108270197007592","","","0.71073","MoKα","","0.0261","0.019","","0.0415","0.0404","","","","0.976","1.036","1.036","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006674","8.4036","0.0015","15.376","0.003","6.9712","0.0012","90","","99.092","0.008","90","","889.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis[(η^5^-cyclopentadienyl)(μ-selenido)(μ-ethylselenolato)]- dimolybdenum(IV)(Mo=Mo)","","- C14 H20 Mo2 Se4 -","- C14 H20 Mo2 Se4 -","- C28 H40 Mo4 Se8 -","2","0.5","FG1338","Thöne, Carsten; Jones, Peter G.; Laube, Jörg","Organometallic Selenolates. VII. (Benzylselenolato-<i>Se</i>)tricarbonyl(η^5^-cyclopentadienyl)molybdenum(II) and Bis[1,2(η^5^)-cyclopentadienyl]-di-μ-ethylselenolato-di-μ-selenido-dimolybdenum(IV)(<i>Mo</i>—<i>Mo</i>)","Acta Crystallographica Section C","1997","53","11","1539","1542","10.1107/S0108270197007592","","","0.71073","MoKα","","0.0207","0.0192","","0.047","0.0461","","","","1.093","1.102","1.102","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006675","12.702","0.003","14.653","0.003","17.715","0.002","88.722","0.012","77.38","0.02","66.64","0.02","2946.1","1.1","293","","","","","","","","","","","4","P -1","-P 1","2","","5,11,17,23-Tetra-tert-butyl-25, 27-bis[2-(p-nitrobenzalamino)ethoxy]-26,28-dihydroxycalix[4]arene","","- C62 H72 N4 O8 -","- C62 H72 N4 O8 -","- C124 H144 N8 O16 -","2","1","","Zhang, Wen-Chun; Chen, Xue-An; Zhao, Ling; Huang, Zhi-Tang","5,11,17,23-Tetra-tert-butyl-26,28-dihydroxy-25,27-bis[2-(p-nitrobenzylidene-amino)ethoxy]calix[4]arene","Acta Crystallographica Section C","1997","53","11","1644","1647","10.1107/S010827019700961X","","","0.71073","MoKα","","","0.0626","","0.1862","0.1527","","","","0.852","1.146","1.146","","","","","has coordinates,has disorder","175018","2020-10-21","18:00:00",""
"2006676","9.1708","0.0014","10.696","0.0003","7.4317","0.0015","92.08","0.02","107.8","0.01","92.57","0.02","692.43","0.18","296","","296","","","","","","","","","3","P -1","-P 1","2","","cis-3,5a-Dimethyl-6-formyloxy-1H-5a,6,7,8,9-pentahydro-1- oxopyrano[4,3-b][1]benzopyran","","- C15 H16 O5 -","- C15 H16 O5 -","- C30 H32 O10 -","2","1","FG1343","Robinson, Paul D.; Hua, Duy H.; Chen, Yi; Meyers, Cal Y.","<i>cis</i>-3,5a-Dimethyl-1-oxo-5a,6,8,9-tetrahydro-1<i>H</i>,7<i>H</i>-pyrano[4,3-<i>b</i>][1]benzopyran-6-yl Formate","Acta Crystallographica Section C","1997","53","11","1642","1644","10.1107/S0108270197008603","","","0.71069","MoKα","","0.0701","0.0382","","0.1209","","0.1027","","","1.031","1.093","1.093","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006677","8.3369","0.001","9.506","0.0012","29.565","0.003","90","","90","","90","","2343","0.5","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-Benzyldi(methanesulfonyl)amine","","- C9 H13 N O4 S2 -","- C9 H13 N O4 S2 -","- C72 H104 N8 O32 S16 -","8","2","FG1348","Henschel, Dagmar; Blaschette, Armand; Jones, Peter G.","Polysulfonylamines. LXXXIX. <i>N</i>,<i>N</i>-Bis(methylsulfonyl)benzylamine","Acta Crystallographica Section C","1997","53","11","1669","1671","10.1107/S0108270197009177","","","0.71073","MoKα","","0.0386","0.0315","","0.0769","0.0745","","","","1.046","1.086","1.086","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006678","9.368","0.002","10.627","0.002","12.219","0.002","76.67","0.03","73.94","0.03","66.93","0.03","1065.2","0.4","298","","298","","","","","","","","","6","P -1","-P 1","2","","Bis(N, N'-di-2-pyridyl ketone oximato)chlorogold(III) hydrate","","- C22 H18 Au Cl N6 O3 -","- C22 H18 Au Cl N6 O3 -","- C44 H36 Au2 Cl2 N12 O6 -","2","1","FR1030","Sommerer, Shaun O.; MacBeth, Cora E.; Jircitano, Alan J.; Abboud, Khalil A.","Chlorobis(<i>N</i>,<i>N</i>'-di-2-pyridyl ketone oximato)gold(III) Hydrate","Acta Crystallographica Section C","1997","53","11","1551","1553","10.1107/S0108270197008925","","","0.71073","MoKα","","0.0337","0.0271","","0.0605","0.0579","","","","1.066","1.085","1.085","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006679","13.8946","0.0008","16.513","0.0001","6.4276","0.0004","90","","90","","90","","1474.76","0.13","293","2","293","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","N,N'-(dimethylthiourea)gold(I) perchlorate","","- C6 H16 Au Cl N4 O4 S2 -","- C6 H16 Au Cl N4 O4 S2 -","- C24 H64 Au4 Cl4 N16 O16 S8 -","4","0.5","FR1036","Richard J. Staples; John P. Fackler Jr; Juan Costamagna","Bis(<i>N</i>,<i>N</i>'-dimethylthiourea-<i>S</i>)gold(I) Perchlorate and Bis(<i>N</i>,<i>N</i>'-diethylthiourea-<i>S</i>)gold(I) Perchlorate","Acta Crystallographica Section C","1997","53","11","1555","1558","10.1107/S0108270197008317","","","0.71073","MoKα","","0.0325","0.0324","","0.1097","0.1096","","","","1.252","1.255","1.255","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006680","7.278","0.001","12.127","0.003","21.118","0.006","90","","90","","90","","1863.9","0.7","193","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Bis(diethylthiourea)gold(I) percholorate","","- C10 H24 Au Cl N4 O4 S2 -","- C10 H24 Au Cl N4 O4 S2 -","- C40 H96 Au4 Cl4 N16 O16 S8 -","4","1","FR1036","Richard J. Staples; John P. Fackler Jr; Juan Costamagna","Bis(<i>N</i>,<i>N</i>'-dimethylthiourea-<i>S</i>)gold(I) Perchlorate and Bis(<i>N</i>,<i>N</i>'-diethylthiourea-<i>S</i>)gold(I) Perchlorate","Acta Crystallographica Section C","1997","53","11","1555","1558","10.1107/S0108270197008317","","","0.71073","MoKα","","0.1383","0.0915","","0.1714","0.1505","","","","1.116","1.196","1.196","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006681","7.698","0.002","16.647","0.002","15.3084","0.0015","90","","102.271","0.012","90","","1916.9","0.6","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cyanobis(tricyclohexyl)phosphino)gold(I)","","- C19 H33 Au N P -","- C19 H33 Au N P -","- C76 H132 Au4 N4 P4 -","4","1","FR1044","Al-Arfaj, A.R.; Reibenspies, J.H.; Hussain, M. Sakhawat; Darensbourg, M.Y.; Akhtar, N.; Isab, A.A.","Cyano[tri(cyclohexyl)phosphino]gold(I), [Au(CN){(C~6~H~11~)~3~P}]","Acta Crystallographica Section C","1997","53","11","1553","1555","10.1107/S0108270197008937","","","0.71073","MoKα","","0.0834","0.0472","","0.1085","0.0944","","","","1.018","1.069","1.069","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006682","22.94","0.007","13.611","0.005","25.178","0.007","90","","116","0.01","90","","7066","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Tris(2,2'-Bipyridyl)-zinc(ii) thiosulfate, heptahydrate","","","- C30 H38 N6 O10 S2 Zn -","- C30 H36.68 N6 O9.34 S2 Zn -","- C240 H293.44 N48 O74.72 S16 Zn8 -","8","1","HA1190","Baggio, Sergio; Pardo, Maria I.; Baggio, Ricardo; Garland, Maria Teresa","Tris(2,2'-bipyridyl-<i>N</i>,<i>N</i>')zinc(II) Thiosulfate Heptahydrate","Acta Crystallographica Section C","1997","53","11","1570","1572","10.1107/S0108270197008615","","","0.71073","MoKα","","0.092","0.069","","0.204","0.144","","","","1.328","1.284","1.284","","","","","has coordinates,has disorder","203567","2020-10-21","18:00:00",""
"2006683","6.681","0.003","8.362","0.001","16.707","0.002","90","","97.01","0.05","90","","926.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-(o-Carboxyphenyl)-1- methyltriazene 1- oxide","3-(o-Carboxyphenyl)-1- methyltriazene 1- oxide","","- C8 H9 N3 O3 -","- C8 H9 N3 O3 -","- C32 H36 N12 O12 -","4","1","HA1193","Chitra Samanta; Sailesh C. Saha; Alok Kumar Mukherjee","3-(<i>o</i>-Carboxyphenyl)-1-methyltriazene 1-Oxide","Acta Crystallographica Section C","1997","53","11","1657","1658","10.1107/S0108270197006537","","","0.71073","MoKα","","0.0466","0.039","","0.1127","0.109","","","","1.042","1.123","1.123","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006684","11.192","0.002","9.96","0.001","18.282","0.002","90.33","0.03","97.03","0.02","90.19","0.02","2022.6","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Diantimony - molybdenum - hexaoxide","","- Mo O6 Sb2 -","- Mo O6 Sb2 -","- Mo16 O96 Sb32 -","16","8","JZ1184","Castro, Alicia; Enjalbert, Renée; Galy, Jean","Sb~2~MoO~6~, a Re-examination","Acta Crystallographica Section C","1997","53","11","1526","1529","10.1107/S0108270197006239","","","0.71069","MoKα","","0.0502","0.0298","","0.1067","0.0967","","","","1.01","1.614","1.614","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006685","12.381","0.01","9.185","0.005","9.221","0.005","90","","90","","90","","1048.6","1.2","293","","","","","","","","","","","2","C m c a","-C 2ac 2","64","","","","- Ni10 Zr7 -","- Ni10 Zr7 -","- Ni40 Zr28 -","4","","JZ1204","Joubert, Jean-Marc; Černý, R.; Yvon, K.; Latroche, M.; Percheron-Guégan, A.","Zirconium‒Nickel, Zr~7~Ni~10~: Space Group Revision for the Stoichiometric Phase","Acta Crystallographica Section C","1997","53","11","1536","1538","10.1107/S0108270197007142","","","0.71073","MoKα","","","0.0605","","","","0.0376","","","","","","1.2892","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006686","7.712","0.001","11.52","0.001","12.721","0.001","90","","94.86","0.01","90","","1126.1","0.2","223","2","223","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(E)-2-Buten-1-yl-(S)-N-(2'-methoxy-[1,1']binaphthalenyl-2-yl)propanimidate","","- C28 H27 N O2 -","- C28 H27 N O2 -","- C56 H54 N2 O4 -","2","1","JZ1211","Fröhlich, Roland; Hungerhoff, Benno; Metz, Peter","(<i>E</i>)-2-Buten-1-yl (<i>S</i>)-<i>N</i>-(2'-Methoxy-[1,1']binaphthalen-2-yl)propanimidate and (<i>E</i>)-2-Buten-1-yl (<i>S</i>)-<i>N</i>-(2'-Methoxy-3-methyl-[1,1']binaphthalen-2-yl)propanimidate","Acta Crystallographica Section C","1997","53","11","1655","1657","10.1107/S0108270197006756","","","1.54178","CuKα","","0.0398","0.0364","","0.1093","0.1054","","","","1.049","1.044","1.044","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006687","7.786","0.001","17.431","0.001","8.749","0.001","90","","98.24","0.01","90","","1175.1","0.2","223","2","223","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(E)-2-Buten-1-yl-(S)-N-(2'-methoxy-3-methyl-[1,1']binaphthalenyl-2-yl)- propanimidate","","- C29 H29 N O2 -","- C29 H29 N O2 -","- C58 H58 N2 O4 -","2","1","JZ1211","Fröhlich, Roland; Hungerhoff, Benno; Metz, Peter","(<i>E</i>)-2-Buten-1-yl (<i>S</i>)-<i>N</i>-(2'-Methoxy-[1,1']binaphthalen-2-yl)propanimidate and (<i>E</i>)-2-Buten-1-yl (<i>S</i>)-<i>N</i>-(2'-Methoxy-3-methyl-[1,1']binaphthalen-2-yl)propanimidate","Acta Crystallographica Section C","1997","53","11","1655","1657","10.1107/S0108270197006756","","","1.54178","CuKα","","0.0325","0.0314","","0.095","0.0904","","","","1.066","1.069","1.069","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006688","11.0647","0.0005","11.52","0.0004","9.6867","0.0004","90","","103.199","0.004","90","","1202.1","0.09","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Imidazole) (N-salicylideneglycinato)-Copper(II) Polymer","","- C12 H11 Cu N3 O3 -","- C12 H11 Cu N3 O3 -","- C48 H44 Cu4 N12 O12 -","4","1","JZ1215","Warda, Salam A.","The Chain Polymers (Imidazole)(<i>N</i>-salicylideneglycinato)copper(II) and (2-Ethylimidazole)(<i>N</i>-salicylideneglycinato)copper(II)","Acta Crystallographica Section C","1997","53","11","1590","1593","10.1107/S0108270197008056","","","1.54178","CuKα","","0.0465","0.0419","","0.1189","0.1143","","","","1.053","1.069","1.069","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006689","11.2152","0.0005","9.3864","0.0005","26.2788","0.0009","90","","90","","90","","2766.4","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(2-Ethylimidazole) (N-salicylideneglycinato)-Copper(II) Polymer","","- C14 H15 Cu N3 O3 -","- C14 H15 Cu N3 O3 -","- C112 H120 Cu8 N24 O24 -","8","1","JZ1215","Warda, Salam A.","The Chain Polymers (Imidazole)(<i>N</i>-salicylideneglycinato)copper(II) and (2-Ethylimidazole)(<i>N</i>-salicylideneglycinato)copper(II)","Acta Crystallographica Section C","1997","53","11","1590","1593","10.1107/S0108270197008056","","","1.54178","CuKα","","0.0498","0.0368","","0.1067","0.0996","","","","1.031","1.063","1.063","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006690","9.1844","0.0004","16.9279","0.0007","9.3097","0.0004","90","","94.489","0.006","90","","1442.96","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Imidazole) (N-Salicylidene-α-aminoisobutyrato)-Copper(II) Dimer","","- C14 H15 Cu N3 O3 -","- C14 H15 Cu N3 O3 -","- C56 H60 Cu4 N12 O12 -","4","1","JZ1216","Warda, Salam A.","(Imidazole-<i>N</i>^3^)(<i>N</i>-salicylidene-α-aminoisobutyrato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II) Dimer","Acta Crystallographica Section C","1997","53","11","1588","1590","10.1107/S0108270197008275","","","1.54178","CuKα","","0.035","0.0338","","0.0932","0.0924","","","","1.087","1.098","1.098","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006691","9.2511","0.001","13.513","0.003","6.1542","0.0003","90","","90","","90","","769.34","0.19","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","6-Nitrophthalide","1,3-Dihydro-6-nitrobenzo[c]furan-1-one","","- C8 H5 N O4 -","- C8 H5 N O4 -","- C32 H20 N4 O16 -","4","1","JZ1219","Bradley, Richard F.; Schwalbe, Carl H.; Ross, Kenneth C.; Fraser, William; Freeman, Sally","6-Nitrophthalide","Acta Crystallographica Section C","1997","53","11","1626","1628","10.1107/S0108270197008494","","","1.54178","CuKα","","0.0376","0.0361","","0.0993","0.0968","","","","1.072","1.064","1.064","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006692","34.05","0.005","11.3","0.003","8.347","0.002","90","","90","","90","","3211.6","1.2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","2-(4-chlorophenyl)-2-(N-acetylthiocarbamato)-ethanoic acid acetonitrile (1:1)","","- C13 H13 Cl N2 O4 S -","- C13 H13 Cl N2 O4 S -","- C104 H104 Cl8 N16 O32 S8 -","8","1","JZ1220","Leban, Ivan; Majcen Le Maréchal, Alenka; Robert, Albert","2-(4-Chlorophenyl)-2-(<i>N</i>-acetylcarbamoylthio)ethanoic Acid‒Acetonitrile (1/1)","Acta Crystallographica Section C","1997","53","11","1677","1679","10.1107/S0108270197008627","","","0.71073","MoKα","","0.0973","0.049","","0.122","0.0976","","","","1.038","1.124","1.124","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006693","13.603","0.001","8.383","0.001","12.198","0.001","90","","97.66","0.01","90","","1378.6","0.2","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","Bis-(4-benzylpiperidinium) Tetrachloromercurate","","- C24 H36 Cl4 Hg N2 -","- C24 H36 Cl4 Hg N2 -","- C48 H72 Cl8 Hg2 N4 -","2","1","JZ1221","Spengler, Roland; Zouari, Fatma; Ben Salah, Abdelhamid; Burzlaff, Hans","Bis(4-benzylpiperidinium) Tetrachloromercurate","Acta Crystallographica Section C","1997","53","11","1566","1568","10.1107/S0108270197008500","","","0.7107","MoKα","","0.047","0.04","","0.042","","0.04","","","1.42","","","1.45","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006694","10.1144","0.0009","13.4212","0.0011","30.576","0.003","90","","98.919","0.009","90","","4100.4","0.6","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1,3-Tris(2-methyl-4-hydroxy-5-tert-butylphenyl)butane‒ hexamethylenetetramine (1/1).","","- C43 H64 N4 O3 -","- C43 H64 N4 O3 -","- C172 H256 N16 O12 -","4","1","JZ1228","Meehan, Paul R.; Gregson, Richard M.; Glidewell, Christopher; Ferguson, George","Steric Inhibition of Molecular Weaving: Non-Woven Nets of <i>R</i>^6^~6~(40) and <i>R</i>^6^~6~(60) Rings in 1,1,3-Tris(2-methyl-4-hydroxy-5-<i>tert</i>-butylphenyl)butane‒Hexamethylenetetramine (1/1)","Acta Crystallographica Section C","1997","53","11","1637","1640","10.1107/S0108270197009293","","","0.7107","MolybdenumKα","","0.2502","0.0622","","0.1374","","0.106","","","0.815","","","1.229","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006695","8.39","0.0009","13.27","0.002","23.258","0.0015","90","","90","","90","","2589.4","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Dimethyl N,N-(Endo-himmoyl)-(R,R)-cysteine","Dimethyl N,N-(Endo-himmoyl)-(R,R)-cysteine","","- C26 H28 N2 O8 S2 -","- C26 H28 N2 O8 S2 -","- C104 H112 N8 O32 S8 -","4","1","KA1223","Hibbs, David E.; Hursthouse, Michael B.; Malik, K. M. Abdul; North, Michael","Dimethyl <i>N</i>,<i>N</i>'-Bis(<i>endo</i>-himmoyl)-(<i>R</i>,<i>R</i>)-cystine","Acta Crystallographica Section C","1997","53","11","1701","1703","10.1107/S0108270197007154","","","0.71069","MoKα","","0.0875","0.0725","","0.1939","0.1851","","","","1.088","1.199","1.199","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006696","8.352","0.001","10.664","0.001","12.65","0.001","90","","90","","90","","1126.68","0.19","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C5 H5 N O S -","- C5 H5 N O S -","- C40 H40 N8 O8 S8 -","8","1","KA1236","Hartung, Jens; Svoboda, Ingrid; Duarte, Maria Teresa","Hydrogen Bonding in 1-Hydroxy-4(1<i>H</i>)-pyridinethione","Acta Crystallographica Section C","1997","53","11","1631","1634","10.1107/S0108270197008834","","","0.71093","MoKα","","0.0414","0.0294","","0.0744","0.0679","","","","1.083","1.115","1.115","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006697","14.486","0.002","11.1562","0.0007","6.373","0.002","90","","90","","90","","1029.9","0.4","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C11 H15 N O2 -","- C11 H15 N O2 -","- C44 H60 N4 O8 -","4","1","KA1240","Hartung, Jens; Svoboda, Ingrid; Fuess, Hartmut; Duarte, Maria Teresa","Lone-Pair Repulsion in Cyclic Hydroxamic Acid <i>O</i>-Esters: <i>N</i>-Cyclohexyloxy-2(1<i>H</i>)-pyridone","Acta Crystallographica Section C","1997","53","11","1629","1631","10.1107/S0108270197008846","","","0.71093","MoKα","","0.0434","0.038","","0.0917","0.0873","","","","1.114","1.118","1.118","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006698","5.8295","0.0007","5.5407","0.0007","16.345","0.002","90","","94.607","0.002","90","","526.23","0.11","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4'-dinitro-2,2'-bipyridine","","- C10 H6 N4 O4 -","- C10 H6 N4 O4 -","- C20 H12 N8 O8 -","2","0.5","KA1243","Pilkington, Melanie; Capelli, Silvia; Hauser, Jürg; Hoffmann, Christina; Bürgi, Hans-Beat","4,4'-Dinitro-2,2'-bipyridine","Acta Crystallographica Section C","1997","53","11","1719","1721","10.1107/S0108270197006586","","","0.71073","MoKα","","0.0456","0.0359","","0.0888","0.0852","","","","2.688","2.841","2.841","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006699","11.4923","0.0005","14.3227","0.0007","8.1715","0.0004","95.655","0.001","94.838","0.001","89.567","0.001","1333.72","0.11","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","Copper(II) (N,N-bis(3,5-dimethylpyrazolyl-1-ylmethyl)-1-hydroxy- 2-aminoethane)(3,5-dimethyl-pyrazol) bis(perchlorate)","","- C19 H31 Cl2 Cu N7 O9 -","- C19 H31 Cl2 Cu N7 O9 -","- C38 H62 Cl4 Cu2 N14 O18 -","2","1","KH1152","Boyd, Peter D. W.; Burrell, Anthony K.; Rickard, Clifton E. F.","[<i>N</i>,<i>N</i>-Bis(3,5-dimethylpyrazol-1-ylmethyl)-1-hydroxy-2-aminoethane](3,5-dimethylpyrazole)copper(II) Diperchlorate","Acta Crystallographica Section C","1997","53","11","1549","1551","10.1107/S0108270197007932","","","0.71073","MoKα","","0.0442","0.0398","","0.1161","0.1125","","","","1.042","1.064","1.064","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006700","8.196","0.005","9.315","0.003","7.306","0.002","107.5","0.03","112.93","0.04","98.51","0.03","467.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N,N-dimethyl-1,3-propanediamine nickel(II) thiocyanate","","- C12 H28 N6 Ni S2 -","- C12 H28 N6 Ni S2 -","- C12 H28 N6 Ni S2 -","1","0.5","LI1152","Soma Ghosh; Monika Mukherjee; Alok K. Mukherjee; Nirmalendu Ray Chaudhuri","Bis(<i>N</i>,<i>N</i>-dimethyl-1,3-propanediamine)bis(thiocyanato-<i>N</i>)nickel(II), Ni<i>L</i>~2~(NCS)~2~, and its Solid-State Isomer [<i>L</i> = NH~2~(CH~2~)~3~N(CH~3~)~2~]","Acta Crystallographica Section C","1997","53","11","1561","1564","10.1107/S010827019700588X","","","0.71073","MoKα","","0.026","0.024","","0.062","0.061","","","","0.988","1.003","1.003","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006701","7.354","0.001","8.477","0.001","25.511","0.003","90","","90","","90","","1590.4","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-(4-chlorophenyl)amino-6,7,8,9-tetrahydrobenzo(b)thieno[3,2-e]- 1,2,4-triazolo[1,5-c]-pyrimidine.","","- C17 H14 Cl N5 S -","- C17 H13.872 Cl N5 S -","- C68 H55.488 Cl4 N20 S4 -","4","1","MU1295","Velavan, Ramasamy; Sivakumar, Kandasamy; Fun, Hoong-Kun; Pathak, Urvish S.; Jain, Kishor S.; Singh, Sanjay","Two Substituted [1,2,4]Triazole Derivatives","Acta Crystallographica Section C","1997","53","11","1615","1617","10.1107/S0108270197004812","","","0.71073","MoKα","","0.0675","0.0563","","0.1836","0.1461","","","","1.046","1.058","1.058","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006702","8.814","0.001","8.718","0.001","22.125","0.002","90","","90.8","0.01","90","","1699.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-chlorophenyl)amino-4-methyl-6,7,8,9-tetrahydrobenzo(b)thieno[3,2-e]- 1,2,4-triazolo[1,5-c]-pyrimidine.","","- C18 H16 Cl N5 S -","- C18 H15.664 Cl N5 S -","- C72 H62.656 Cl4 N20 S4 -","4","1","MU1295","Velavan, Ramasamy; Sivakumar, Kandasamy; Fun, Hoong-Kun; Pathak, Urvish S.; Jain, Kishor S.; Singh, Sanjay","Two Substituted [1,2,4]Triazole Derivatives","Acta Crystallographica Section C","1997","53","11","1615","1617","10.1107/S0108270197004812","","","0.71073","MoKα","","0.0529","0.0391","","0.1109","0.1048","","","","0.962","1.065","1.065","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006703","10.131","0.003","12.711","0.005","23.594","0.007","87.27","0.03","101.59","0.03","109.05","0.03","2812.8","1.7","293","","","","","","","","","","","8","P -1","-P 1","2","","","","- C59 H49 Cu3 Mo N O P3 S4 -","- C59 H49 Cu3 Mo N O P3 S4 -","- C118 H98 Cu6 Mo2 N2 O2 P6 S8 -","2","1","MU1304","Wang, Quanming; Wu, Xintao; Huang, Qun; Sheng, Tianlu; Lin, Ping","Oxo-1κ<i>O</i>-μ~3~-(pyridine-2-thiolato-2κ<i>N</i>,3:4κ^2^<i>S</i>)-tri-μ~3~-sulfido-1:2:3κ^3^<i>S</i>;1:2:4κ^3^<i>S</i>;2:3:4κ^3^<i>S</i>-tris(triphenylphosphine)-2κ<i>P</i>;3κ<i>P</i>;4κ<i>P</i>-tricoppermolybdenum","Acta Crystallographica Section C","1997","53","11","1542","1543","10.1107/S010827019700382X","","","0.71073","MoKα","","","0.054","","","0.06","","","","","1.16","1.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006704","9.728","0.003","19.856","0.011","12.939","0.004","90","","103.75","0.03","90","","2427.7","1.7","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tris(di-μ-chloro-dichloroaluminium-1κ^2^Cl:2κ^2^Cl)(η^6^-toluene)neodymium","","- C7 H8 Al3 Cl12 Nd -","- C7 H8 Al3 Cl12 Nd -","- C28 H32 Al12 Cl48 Nd4 -","4","1","MU1314","Liu, Qiancai; Lin, Yong-Hua; Shen, Qi","An η^6^-Toluene Complex of Neodymium: [Nd(η^6^-C~6~H~5~CH~3~)(AlCl~4~)~3~]","Acta Crystallographica Section C","1997","53","11","1579","1580","10.1107/S0108270197004964","","","0.71069","MoKα","","","0.039","","","0.038","","","","","1.464","1.464","","","","","has coordinates","278316","2022-10-03","11:25:04",""
"2006705","10.725","0.001","11.126","0.002","18.368","0.003","93.41","0.01","90.05","0.01","112.61","0.01","2019.1","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","trans-Tetracarbonylbis[tris(4-chlorophenyl)phosphine]molybdenum(0)","","- C40 H24 Cl6 Mo O4 P2 -","- C40 H24 Cl6 Mo O4 P2 -","- C80 H48 Cl12 Mo2 O8 P4 -","2","1","MU1322","Shawkataly, Omar bin; Umathavan, Arumugam; Ramalingam, Kuppukkannu; Fun, Hoong-Kun; Ibrahim, Abdul Razak","<i>trans</i>-Tetracarbonylbis[tris(4-chlorophenyl)phosphine-<i>P</i>]molybdenum(0)","Acta Crystallographica Section C","1997","53","11","1543","1545","10.1107/S0108270197009384","","","0.71073","MoKα","","0.109","0.048","","0.121","0.102","","","","0.81","0.968","0.968","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006706","8.028","0.001","12.349","0.002","14.922","0.003","90","","92.2","0.01","90","","1478.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H11 Cl N4 -","- C18 H11 Cl N4 -","- C72 H44 Cl4 N16 -","4","1","MU1327","Zhong-Lin Lu; Zhen-Wei Bian; Chun-Ying Duan; Yu-Peng Tian; Xiao-Zeng You; Kandasamy Chinnakali; Ibrahim Abdul Razak; Hoong-Kun Fun","<i>o</i>-Chlorobenzaldehyde 4,5-Diaza-9-fluorenylidenehydrazone","Acta Crystallographica Section C","1997","53","11","1614","1615","10.1107/S0108270197008159","","","0.71073","MoKα","","0.1089","0.0414","","0.1017","0.0864","","","","0.808","1.051","1.051","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006707","14.922","0.002","15.157","0.002","23.606","0.003","90","","90","","90","","5339","1.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","9-[2-(Ethoxycarbonyl)phenyl]-3,6-bis(ethylamino)-2,7-dimethyl- xanthylium Iodide Monohydrate","","- C28 H33 I N2 O4 -","- C28 H33 I N2 O4 -","- C224 H264 I8 N16 O32 -","8","1","MU1330","Hoong-Kun Fun; Kandasamy Chinnakali; Kandasamy Sivakumar; Cai-Ming Lu; Ren-Gen Xiong; Xiao-zeng You","<i>N</i>-[9-(2-Ethoxycarbonylphenyl)-6-(ethylamino)-2,7-dimethyl-3-xanthenylidene]ethylammonium Iodide Monohydrate","Acta Crystallographica Section C","1997","53","11","1619","1620","10.1107/S0108270197009360","","","0.71073","MoKα","","0.1016","0.0596","","0.2024","0.1788","","","","0.984","1.199","1.199","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006708","18.262","0.002","7.096","0.001","26.315","0.002","90","","105.09","0.01","90","","3292.5","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,12-dibromo-5,6-dihydrodibenz[c,h]acridine","","- C21 H13 Br2 N -","- C21 H13 Br2 N -","- C168 H104 Br16 N8 -","8","1","MU1331","Jayanta Kumar Ray; Manash Kumar Haldar; Kandasamy Chinnakali; Hoong-Kun Fun","2,12-Dibromo-5,6-dihydrodibenz[<i>c</i>,<i>h</i>]acridine","Acta Crystallographica Section C","1997","53","11","1617","1619","10.1107/S0108270197009372","","","0.71073","MoKα","","0.1051","0.041","","0.1033","0.0857","","","","0.865","1.067","1.067","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006709","10.758","0.001","23.899","0.002","5.9","0.001","90","","90","","90","","1516.9","0.3","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","1-(p-Chlorophenyl)-4(2-thienyl)pyrrolidin-2-one-5-carboxylic acid","","- C15 H12 Cl N O3 S -","- C15 H12 Cl N O3 S -","- C60 H48 Cl4 N4 O12 S4 -","4","1","MU1332","Jayanta Kumar Ray; Bidhan Chandra Roy; Kandasamy Chinnakali; Ibrahim Abdul Razak; Hoong-Kun Fun","1-(<i>p</i>-Chlorophenyl)-5-oxo-3-(2-thienyl)pyrrolidine-2-carboxylic Acid","Acta Crystallographica Section C","1997","53","11","1622","1624","10.1107/S0108270197009396","","","0.71073","MoKα","","0.085","0.0384","","0.0817","0.0714","","","","0.816","1.021","1.021","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006710","8.836","0.001","10.065","0.001","19.071","0.005","90","","90","","90","","1696.1","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-Acetoylphenylhydrazone","","- C8 H10 N2 O -","- C8 H10 N2 O -","- C64 H80 N16 O8 -","8","1","MU1336","Jayanta Kumar Ray; Tapan Kumar Mahato; Kandasamy Chinnakali; Hoong-Kun Fun","<i>N</i>-Acetoylphenylhydrazone","Acta Crystallographica Section C","1997","53","11","1621","1622","10.1107/S0108270197009402","","","0.71073","MoKα","","0.0624","0.0477","","0.1409","0.1308","","","","0.987","1.1","1.1","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006711","6.61","0.002","11.371","0.001","14.683","0.001","90","","91.73","0.01","90","","1103.1","0.4","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","trihydrate 1/1 salt between ((R)-3-Hydroxy-4-trimethylammonio)butiramide and ((1R,3S)-1,2,2-Trimethyl-1,3-cyclopentane dicarboxylic acid)","","- C17 H38 N2 O9 -","- C17 H31 N2 O9 -","- C34 H62 N4 O18 -","2","1","NA1264","De Santis, Pasquale; Camalli, Mercedes; Spagna, Riccardo; Gallo, G.; Giorgi, F.; Tinti, M.O.","Trihydrate 1/1 Salt Between (<i>R</i>)-Carnitine Amide and (1<i>R</i>,3<i>S</i>)-Camphoric Acid","Acta Crystallographica Section C","1997","53","11","1679","1682","10.1107/S0108270197007178","","","1.54178","CuKα","","","0.059","","","0.081","","","","","0.995","0.995","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006712","4.0367","0.001","14.956","0.003","18.404","0.003","90","","90","","90","","1111.1","0.4","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","Guanidinium bis[dichloromercury(II)]chloride,","","- C H6 Cl5 Hg2 N3 -","- C H6 Cl5 Hg2 N3 -","- C4 H24 Cl20 Hg8 N12 -","4","0.5","NA1294","Kubicki, Maciej; Szafrański, Marek","Poly{guanidinium bis[dichloromercury(II)]-μ~4~-chloro}","Acta Crystallographica Section C","1997","53","11","1558","1561","10.1107/S0108270197007944","","","0.71073","MoKα","","0.077","0.062","","0.188","0.165","","","","1.087","1.134","1.134","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006713","8.123","0.001","10.58","0.002","10.981","0.002","98.52","0.01","101.76","0.01","105.97","0.01","867.1","0.3","190","2","190","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H18 O8 Pb -","- C14 H18 O8 Pb -","- C28 H36 O16 Pb2 -","2","1","NA1300","John Fawcett; Paul Jenkins; David R. Russell; Andrew J. Wood; Jan Wolters; Dick de Vos","Tris(acetato-<i>O</i>,<i>O</i>')(2,4-dimethoxyphenyl)lead(IV)","Acta Crystallographica Section C","1997","53","11","1600","1602","10.1107/S010827019700574X","","","0.71073","MoKα","","0.056","0.043","","0.102","0.095","","","","1.013","1.045","1.045","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006714","10.501","0.002","14.235","0.003","12.485","0.002","90","","91.1","0.1","90","","1865.9","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans-[bis(N-methylpiperazine)Platinum(II)] dichloride tetrahydrate.","","- C10 H32 Cl2 N4 O4 Pt -","- C10 H24 N4 Pt -","- C40 H96 N16 Pt4 -","4","0.5","NA1302","Marzotto, Armando; Clemente, Dore Augusto; Valle, Giovanni","Piperazine (and Derivatives) Platinum(II) Complexes: <i>trans</i>-Bis(<i>N</i>-methylpiperazine-<i>N</i>,<i>N</i>')platinum(II) Dichloride Tetrahydrate","Acta Crystallographica Section C","1997","53","11","1580","1583","10.1107/S0108270197007506","","","1.5418","CuKα","","0.081","0.073","","0.213","0.202","","","","1.055","1.136","1.136","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006715","6.7832","0.0009","18.325","0.0003","27.751","0.0004","90","","90","","90","","3449.5","0.5","289","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(R,R)-Jacobsen Ligand","(1R,2R)-(-)-1,2-Cyclohexanediamino-N,N'-bis(3,5-di-t-butyl-salicylidene)","","- C36 H54 N2 O2 -","- C36 H54 N2 O2 -","- C144 H216 N8 O8 -","4","1","NA1304","Yoon, Jae Woong; Yoon, Tae-Sung; Shin, Whanchul","(1<i>R</i>,2<i>R</i>)-({-})-<i>N</i>,<i>N</i>'-Bis(3,5-di-<i>tert</i>-butylsalicylidene)-1,2-cyclohexanediamine: a Salen Ligand of Jacobsen's Catalyst","Acta Crystallographica Section C","1997","53","11","1685","1687","10.1107/S0108270197006379","","","0.71069","MoKα","","0.1362","0.0592","","0.2022","0.1356","","","","1.065","1.021","1.021","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006716","5.47","0.001","18.31","0.004","18.88","0.004","90","","90","","90","","1890.9","0.7","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Benzyl-1-(hydroxyamino)-2:3;4:5-di-O-isopropylidene-α-D-mannofuranose","","- C19 H27 N O6 -","- C19 H27 N O6 -","- C76 H108 N4 O24 -","4","1","NA1319","Merino, Pedro; Merchan, Francisco L.; Tejero, Tomas; Franco, Santiago","Chiral Hydroxylamines. IV. 1-(<i>N</i>-Benzyl-<i>N</i>-hydroxyamino)-2:3;4:5-di-<i>O</i>-isopropylidene-α-<small>D</small>-mannofuranose","Acta Crystallographica Section C","1997","53","11","1703","1705","10.1107/S010827019700913X","","","0.71073","MoKα","","0.102","0.069","","0.34","","0.174","","","1.078","","","1.08","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006717","6.398","0.002","23.965","0.001","14.687","0.005","90","","95.3","0.03","90","","2242.3","1","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","6,6'-di-t-butylcarbonyloxy-2-carbométhoxy-4-méthylènecyclooctanone.","","- C21 H32 O7 -","- C21 H32 O7 -","- C84 H128 O28 -","4","2","PA1250","Ginderow, Daria; Louis Fensterbank; Catherine Jorand-Lebrun; Max Malacria","Deux Composés Trisubstitués de la 4-Méthylènecyclooctanone","Acta Crystallographica Section C","1997","53","11","1661","1665","10.1107/S0108270197008391","","","1.5418","CuKα","","0.0447","0.0403","","0.1175","0.1128","","","","1.027","1.043","1.043","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006718","9.678","0.003","11.042","0.009","13.668","0.005","66.2","0.05","74.26","0.03","77.26","0.04","1276","1.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","6,6'-di-t-butylcarbonyloxy-2-phénylsulfonyl-4-méthylènecyclooctanone","","- C25 H34 O7 S -","- C25 H34 O7 S -","- C50 H68 O14 S2 -","2","1","PA1250","Ginderow, Daria; Louis Fensterbank; Catherine Jorand-Lebrun; Max Malacria","Deux Composés Trisubstitués de la 4-Méthylènecyclooctanone","Acta Crystallographica Section C","1997","53","11","1661","1665","10.1107/S0108270197008391","","","1.5418","CuKα","","0.0457","0.0432","","0.1178","0.116","","","","1.059","1.059","1.059","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006719","9.481","0.001","12.592","0.001","14.322","0.001","114.559","0.001","95.919","0.001","95.249","0.001","1529.7","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dicarbonyl[η^4^-((E)-(2,6,6-Trimethyl-cyclohepta-2,4-dienylidene)-ethyl acetat)]triphenylphosphine-iron","","- C34 H35 Fe O4 P -","- C34 H35 Fe O4 P -","- C68 H70 Fe2 O8 P2 -","2","1","QA0015","Petrowitsch, Tanja; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","Dicarbonyl[η^4^-(<i>E</i>)-(2,6,6-trimethylcyclohepta-2,4-dienylidene)ethyl acetate](triphenylphosphine)iron","Acta Crystallographica Section C","1997","53","11","IUC9700023","","10.1107/S0108270197099356","","","0.71069","MoKα","","0.087","0.0389","","0.1088","0.0906","","","","0.74","0.824","0.824","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006720","24.778","0.009","9.442","0.003","9.537","0.006","90","","91.27","0.04","90","","2230.7","1.8","296","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(1-Adamantyl)acetamide","","- C12 H19 N O -","- C12 H19 N O -","- C96 H152 N8 O8 -","8","1","QA0021","Mizoguchi, Jun-ichi; Miyaki Takayuki; Kashino, Setsuo","<i>N</i>-(1-Adamantyl)acetamide","Acta Crystallographica Section C","1997","53","11","IUC9700024","","10.1107/S0108270197099319","","","0.71073","MoKα","","","0.057","","","","0.054","","","","","","1.25","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006721","12.331","0.002","21.349","0.002","15.849","0.002","90","","92.079","0.01","90","","4169.6","0.9","295.2","","295.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- As2 Co4 H50 K10 O93 W18 -","- As2 Co4 K10 O92 W18 -","- As4 Co8 K20 O184 W36 -","2","0.5","QA0022","Timothy J.R. Weakley","Potassium Bis(α-nonatungstoarsenato)diaquatetracobaltate(II) 23-Hydrate, K~10~[Co~4~(H~2~O)~2~(AsW~9~O~34~)~2~].23H~2~O","Acta Crystallographica Section C","1997","53","11","IUC9700025","","10.1107/S010827019709937X","","","0.71073","MoKα","","","0.0367","","","0.0402","","","","","1.825","1.825","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006722","6.967","0.005","18.876","0.009","10.157","0.006","90","","92.9","0.2","90","","1334","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1-diethyl-3-(4-methylbenzoyl)thiourea","","- C13 H18 N2 O S -","- C13 H18 N2 O S -","- C52 H72 N8 O4 S4 -","4","1","QB0010","Angel Dago Morales; Santiago García-Granda; Yolanda Rodríguez Esteva; Ana Plutín Stevens; Gerardo Alexis Acosta Crespo","1,1-Diethyl-3-(4-methylbenzoyl)thiourea","Acta Crystallographica Section C","1997","53","11","IUC9700019","","10.1107/S0108270197099344","","","0.71073","MoKα","","0.1165","0.0429","","0.122","0.0987","","","","1.026","1.132","1.132","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006723","9.4775","0.0001","11.1589","0.0002","10.7089","0.0002","90","","111.505","0.001","90","","1053.71","0.03","173","","173","","","","","","","","","4","P 1 21 1","P 2yb","4","","2,4,6-Triphenyl-1,2,5,6-tetrahydro-pyrimidine-5-carboxylic acid ethyl ester","","- C25 H24 N2 O2 -","- C25 H24 N2 O2 -","- C50 H48 N4 O4 -","2","1","QB0017","Bolte, Michael","Ethyl 2,4,6-Triphenyl-1,2,5,6-tetrahydropyrimidine-5-carboxylate at 173K","Acta Crystallographica Section C","1997","53","11","IUC9700020","","10.1107/S0108270197099332","","","0.71073","MoKα","","0.0352","0.0349","","0.0888","0.0885","","","","1.076","1.078","1.078","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006724","7.446","0.006","11.41","0.007","6.44","0.01","103.83","0.08","92.3","0.1","82.07","0.06","526.2","1","295","","","","","","","","","","","5","P -1","-P 1","2","","Rubidium hydrogen bis(dichloroacetate)","","- C4 H3 Cl4 O4 Rb -","- C4 H3 Cl4 O4 Rb -","- C8 H6 Cl8 O8 Rb2 -","2","1","QB0023","Yoshida, Tadanori; Kashino, Setsuo","Rubidium Hydrogen Bis(dichloroacetate)","Acta Crystallographica Section C","1997","53","11","IUC9700021","","10.1107/S0108270197099368","","","0.71073","MoKα","","","0.031","","","","0.033","","","","","","1.22","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006725","5.2107","0.0008","9.91","0.001","13.065","0.002","90","","98.1","0.01","90","","667.92","0.16","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","t-butyl carbamate","","- C5 H11 N O2 -","- C5 H11 N O2 -","- C20 H44 N4 O8 -","4","1","QB0024","Bursavich, Matthew G.; Fronczek, Frank R.","<i>tert</i>-Butyl Carbamate at 100K","Acta Crystallographica Section C","1997","53","11","IUC9700022","","10.1107/S0108270197099320","","","0.71073","Mo-Kα","","0.065","0.045","","0.042","0.041","","","","1.612","1.602","1.602","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006726","8.05","0.001","12.49","0.002","20.193","0.004","90","","95.97","0.01","90","","2019.3","0.6","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H48 Ca Cu2 N14 O4 S6 -","- C22 H48 Ca Cu2 N14 O4 S6 -","- C44 H96 Ca2 Cu4 N28 O8 S12 -","2","0.5","SK1074","Lu, Tian-Huey; Lin, Jyh-Liong; Lan, Wei-Jen; Chung, Chung-Sun","Bis[(1,4,7,10-tetraazacyclododecane-κ^4^<i>N</i>)(thiocyanato-<i>S</i>)copper(II)] Diaquatetrakis(isothiocyanato-<i>N</i>)calcate(2‒) Dihydrate","Acta Crystallographica Section C","1997","53","11","1598","1600","10.1107/S0108270197008639","","","0.71073","MolybdenumKα","","0.026","0.026","","0.028","0.028","","","","","1.12","1.12","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006727","22.806","0.007","6.45","0.002","5.813","0.002","90","","90","","90","","855.1","0.5","213","0.2","213","0.2","","","","","","","","3","C m c 21","C 2c -2","36","heptamethylenediamine","1,7-diaminoheptane","","- C7 H18 N2 -","- C7 H18 N2 -","- C28 H72 N8 -","4","0.5","SK1075","Gotthardt, Roger; Fuhrhop, Jürgen-Hinrich; Buschmann, Jürgen; Luger, Peter","Heptamethylenediamine at 213K","Acta Crystallographica Section C","1997","53","11","1715","1717","10.1107/S0108270197006471","","","1.5418","CuKα,Nifilter","","0.057","0.0493","","0.156","0.1471","","","","1.069","1.109","1.109","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006728","10.305","0.003","22.511","0.007","9.641","0.003","90","","83.25","0.02","90","","2221","1.2","293","2","190","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2,2'-bipyridine)flavonolatocopper(II) perchlorate","","- C25 H17 Cl Cu N2 O7 -","- C25 H17 Cl Cu N2 O7 -","- C100 H68 Cl4 Cu4 N8 O28 -","4","1","SK1079","Lippai, István; Speier, Gábor; Huttner, Gottfried; Zsolnai, László","(2,2'-Bipyridine)(flavonolato)copper(II) Perchlorate, [Cu(bpy)(fla)]ClO~4~","Acta Crystallographica Section C","1997","53","11","1547","1549","10.1107/S0108270197005568","","","0.71073","MoKα","","0.0591","0.0534","","0.1666","0.1624","","","","1.852","1.911","1.911","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006729","10.211","0.002","8.285","0.001","19.539","0.003","90","","99.32","0.01","90","","1631.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","8-Amino-7-(4-morpholinobutyl)-1,3-dimethyl-3,7-dihydro-1H-purine- 2,6-dione","","- C15 H24 N6 O3 -","- C15 H24 N6 O3 -","- C60 H96 N24 O12 -","4","1","SK1110","Karczmarzyk, Zbigniew; Pawłowski, Maciej","8-Amino-7-(4-morpholinobutyl)theophylline","Acta Crystallographica Section C","1997","53","11","1650","1653","10.1107/S0108270197006483","","","1.54184","CuKα","","0.0565","0.0486","","0.1514","","0.1457","","","1.007","","","1.039","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006730","9.157","0.003","10.815","0.003","10.855","0.004","75.78","0.01","85.9","0.01","84.42","0.01","1035.9","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(1-Amino-2-diphenylphosphinobenzene)tetracarbonylmolybdenum(0)","","- C22 H16 Mo N O4 P -","- C22 H16 Mo N O4 P -","- C44 H32 Mo2 N2 O8 P2 -","2","1","SK1116","Dahlenburg, Lutz; Herbst, Konrad; Liehr, Günter","Tetracarbonyl[2-(diphenylphosphino)aniline-<i>N</i>,<i>P</i>]molybdenum(0)","Acta Crystallographica Section C","1997","53","11","1545","1547","10.1107/S0108270197007518","","","0.7107","MoKα","","0.034","0.029","","0.058","0.056","","","","1.129","1.156","1.156","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006731","7.1807","0.0001","10.8165","0.0002","12.6864","0.0002","90","","90","","90","","985.35","0.03","143","","143","","","","","","","","","5","P m n 21","P 2ac -2","31","","N-Hydro-4-methylpyridinium Pentachloro(4-methylpyridino)titanate(IV) Acetonitrile at 143K","","- C14 H18 Cl5 N3 Ti -","- C14 H18 Cl5 N3 Ti -","- C28 H36 Cl10 N6 Ti2 -","2","0.5","SK1120","Hensen, Karl; Pickel, Peter; Lemke, Alexander; Bolte, Michael","4-Methylpyridinium Pentachloro(4-methylpyridine-<i>N</i>)titanate(IV) Acetonitrile Solvate at 143K","Acta Crystallographica Section C","1997","53","11","1583","1585","10.1107/S0108270197008949","","","0.71073","MoKα","","0.0548","0.0379","","0.0735","0.0681","","","","1.072","1.094","1.094","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006732","13.303","0.001","13.365","0.001","15.493","0.001","90","","90","","90","","2754.6","0.3","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Acetyl-ΔPhe-L-Ala-ΔPhe-D-Ala-Methylester","","- C27 H30 N4 O6 -","- C27 H30 N4 O6 -","- C108 H120 N16 O24 -","4","1","SX1026","Tuzi, Angela; Fissi, Adriano; Pieroni, Osvaldo","Acetyl-ΔPhe-<small>L</small>-Ala-ΔPhe-<small>D</small>-Ala Methyl Ester","Acta Crystallographica Section C","1997","53","11","1696","1698","10.1107/S0108270197007051","","","1.5418","CuKα","","0.054","0.046","","","0.063","","","","","1.87","1.87","","","","","has coordinates","208453","2020-10-21","18:00:00",""
"2006733","6.6176","0.0009","8.38","0.0005","47.742","0.0005","89.99","0.02","90.497","0.01","90.02","0.03","2647.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-myristic acid 3-tert-butoxycarbonylamino-2-oxo-piperidin-5-yl ester","","- C24 H44 N2 O5 -","- C24 H44 N2 O5 -","- C96 H176 N8 O20 -","4","1","SX1028","Leopoldo Suescun P.; Raúl A. Mariezcurrena; Álvaro W. Mombrú; Oscar A. González; Eduardo Manta; Sandra Gordon","<i>trans</i>-Myristic Acid 3-<i>tert</i>-Butoxycarbonylamino-2-oxopiperidin-5-yl Ester, a New Anthelmintic Compound","Acta Crystallographica Section C","1997","53","11","1682","1685","10.1107/S0108270197008329","","","0.7107","MoKα","","0.1298","0.0474","","0.1764","0.1366","","","","1.044","1.226","1.226","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006734","8.892","0.002","11.261","0.003","16.681","0.005","90","","93.7","0.02","90","","1666.8","0.8","293","2","","","","","","","","","","3","P 1 21 1","","","1-Hydroxybaccatin I","","","- C32 H44 O14 -","- C32 H44 O14 -","- C64 H88 O28 -","2","1","SX1035","Davide Viterbo; Marco Milanesio; Giovanni Appendino; Sunil K. Chattopadhyay; Gour C. Saha","1-Hydroxybaccatin I, C~32~H~44~O~14~, and 2-Deacetoxydecinnamoyltaxinine J, C~28~H~40~O~9~","Acta Crystallographica Section C","1997","53","11","1687","1690","10.1107/S0108270197009256","","","0.71069","MoKα","","","0.0577","","","0.1507","","","","","1.067","1.067","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006735","10.723","0.003","14.354","0.003","18.592","0.004","90","","90","","90","","2861.6","1.2","293","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2-deacetoxydecinnamoyltaxinine J","","","- C28 H40 O9 -","- C28 H40 O9 -","- C112 H160 O36 -","4","1","SX1035","Davide Viterbo; Marco Milanesio; Giovanni Appendino; Sunil K. Chattopadhyay; Gour C. Saha","1-Hydroxybaccatin I, C~32~H~44~O~14~, and 2-Deacetoxydecinnamoyltaxinine J, C~28~H~40~O~9~","Acta Crystallographica Section C","1997","53","11","1687","1690","10.1107/S0108270197009256","","","0.71069","MoKα","","","0.0553","","","0.1289","","","","","1.125","1.125","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2006736","13.497","0.005","4.5178","0.0011","13.211","0.004","90","","118.8","0.02","90","","705.9","0.4","133","2","133","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H10 O2 -","- C8 H10 O2 -","- C32 H40 O8 -","4","1","TA1089","Gainsford, Graeme J.; Miller, Ian J.; Yorke, Selwyn C.; Rae, A. David","Pseudosymmetry in 2,5-Dimethyl-1,4-benzenediol","Acta Crystallographica Section C","1997","53","11","1673","1675","10.1107/S0108270197007191","","","0.71069","MoKα","","0.056","0.037","","0.094","0.086","","","","0.975","1.075","1.075","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006737","10.923","0.004","11.114","0.001","13.548","0.004","90","","99.52","0.01","90","","1622.1","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Calcium Potassium Tris(oxalato)chromate(III) Pentahydrate","","- C6 H10 Ca Cr K O17 -","- C6 H10 Ca Cr K O17 -","- C24 H40 Ca4 Cr4 K4 O68 -","4","1","TA1140","Masters, Vanessa; Gahan, Lawrence R.; Kennard, Colin H. L.","Calcium Potassium Tris(oxalato-<i>O</i>^1^,<i>O</i>^2^)chromate(III) Pentahydrate","Acta Crystallographica Section C","1997","53","11","1576","1577","10.1107/S0108270197007762","","","0.71073","MoKα","","0.038","0.032","","0.091","0.087","","","","1.072","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006738","9.3529","0.0008","9.3529","0.0008","29.292","0.004","90","","90","","120","","2219.1","0.4","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Cs5 Mo21 S23 -","- Cs5 Mo21 S23 -","- Cs10 Mo42 S46 -","2","0.166667","TA1146","Picard, S.; Gougeon, P.; Potel, M.","Cs~5~Mo~21~S~23~","Acta Crystallographica Section C","1997","53","11","1519","1521","10.1107/S010827019700752X","","","0.71073","MoKα","","0.0669","0.0284","","0.0912","0.0881","","","","1.107","1.278","1.278","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006739","13.32","0.003","7.729","0.002","14.785","0.002","90","","90.256","0.014","90","","1522.1","0.6","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","calcium yttrium silicate","","","- Ca3 O18 Si6 Y2 -","- Ca2.997 O18 Si6 Y1.999 -","- Ca11.988 O72 Si24 Y7.996 -","4","0.5","TA1157","Yamane, Hisanori; Nagasawa, Toru; Shimada, Masahiko; Endo, Tadashi","Ca~3~Y~2~(Si~3~O~9~)~2~","Acta Crystallographica Section C","1997","53","11","1533","1536","10.1107/S010827019700721X","","","0.71069","MoKα","","0.0327","0.0212","","0.0629","0.0577","","","","1.063","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006740","5.3907","0.0011","12.68","0.002","29.152","0.005","90","","90","","90","","1992.7","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H23 Cl N2 O8 -","- C18 H23 Cl N2 O8 -","- C72 H92 Cl4 N8 O32 -","4","1","VJ1040","N. Srinivasan; R.K. Rajaram","<small>L</small>-Phenylalanine <small>L</small>-Phenylalaninium Perchlorate","Acta Crystallographica Section C","1997","53","11","1711","1713","10.1107/S0108270197000577","","","0.71073","MoKα","","0.0789","0.0463","","0.2354","0.1016","","","","1.074","1.151","1.151","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006741","10.231","0.004","22.752","0.007","4.817","0.002","90","","90","","90","","1121.3","0.7","293","2","293","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C10 H13 N5 O3 -","- C10 H13 N5 O3 -","- C40 H52 N20 O12 -","4","1","VJ1055","P. Karthe; N. Gautham; Anil Kumar; S.B. Katti","β-<small>D</small>-3'-Deoxyadenosine (Cordycepin)","Acta Crystallographica Section C","1997","53","11","1694","1696","10.1107/S0108270197007361","","","0.7107","MoKα","","0.1311","0.0539","","0.1281","0.091","","","","0.844","0.841","0.841","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006742","16.001","0.001","11.821","0.003","9.641","0.001","90","","98.53","0.03","90","","1803.4","0.5","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","trans-(±)-N,N'-Bis(salicylidene)-1,2-cyclohexane-diamine","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C80 H88 N8 O8 -","4","1","VJ1061","Qiancai Liu; Mengxian Ding; Yonghua Lin; Yan Xing","<i>trans</i>-(±)-<i>N</i>,<i>N</i>'-Bis(salicylidene)-1,2-cyclohexanediamine","Acta Crystallographica Section C","1997","53","11","1671","1673","10.1107/S0108270197008640","","","0.71073","MoKα","","0.0638","0.037","","0.0845","0.0765","","","","0.869","1.014","1.014","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006743","14.762","0.003","5.832","0.002","4.039","0.002","90","","112.78","0.02","90","","320.6","0.2","293","2","293","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","p-dichlorobenzene","","- C6 H4 Cl2 -","- C6 H4 Cl2 -","- C12 H8 Cl4 -","2","0.5","AB1477","Estop, Eugènia; Alvarez-Larena, Angel; Belaaraj, Abdesselam; Solans, Xavier; Labrador, Manuel","α-Phase <i>p</i>-Dichlorobenzene at 293K","Acta Crystallographica Section C","1997","53","12","1932","1935","10.1107/S0108270197007737","","","0.71069","MoKα","","0.0498","0.0495","","0.1361","0.1355","","","","1.069","1.068","1.068","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006744","14.341","0.001","15.206","0.001","17.716","0.002","90","","90","","90","","3863.3","0.6","213","","213","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","11S,12S-trans-N,N'-dicyclohexyl-9,10-dihydro-9,10-ethanoanthracene- 11,12-dicarboxamide.cyclohexylamine.dimethylformamide. hydrogen chloride (1:1:1:1)","","- C39 H57 Cl N4 O3 -","- C39 H57 Cl N4 O3 -","- C156 H228 Cl4 N16 O12 -","4","1","AB1479","Helmle, Olga Formerly Olga Gallardo.; Csöregh, Ingeborg; Hens, Thomas; Weber, Edwin","Solid Inclusion Compounds of Chiral Roof-Shaped Diamide Hosts","Acta Crystallographica Section C","1997","53","12","1892","1895","10.1107/S0108270197011335","","","0.71073","MoKα","","0.167","0.084","","0.108","","0.095","","","","","","1.69","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006745","10.004","0.003","9.966","0.003","32.06","0.01","90","","90","","90","","3196.4","1.7","298","","298","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","11S,12S-trans-N,N'-di-t-butyl-9,10-dihydro-9,10- ethanoanthracene-11,12-dicarboxamide. dimethyl sulfuroxide.hydrogen oxide (1:2:1)","","- C30 H46 N2 O5 S2 -","- C30 H46 N2 O5 S2 -","- C120 H184 N8 O20 S8 -","4","1","AB1479","Helmle, Olga Formerly Olga Gallardo.; Csöregh, Ingeborg; Hens, Thomas; Weber, Edwin","Solid Inclusion Compounds of Chiral Roof-Shaped Diamide Hosts","Acta Crystallographica Section C","1997","53","12","1892","1895","10.1107/S0108270197011335","","","0.71073","MoKα","","0.163","0.088","","0.153","","0.108","","","0","","","2.193","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006746","13.972","0.006","10.557","0.004","18.596","0.014","90","","107.16","0.02","90","","2621","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(8R/8S)-8-Phenyl-6-[trans-(1R/1S,2S/2R)-2-phenylcyclohexoxy]-5,8-dihydro-2H- [1,2,4]-triazolo-[1,2-a]-pyridazin-1,3-dione-water(1/1).","","- C30 H31 N3 O4 -","- C30 H31 N3 O4 -","- C120 H124 N12 O16 -","4","1","AB1480","Santiago García-Granda; Rafael Santiago-García; Angel Suárez-Sobrino; Luis Angel López","(5<i>R</i>/5<i>S</i>)-2,5-Diphenyl-7-[<i>trans</i>-(1<i>R</i>/1<i>S</i>,2<i>S</i>/2<i>R</i>)-2-phenylcyclohexyloxy]-2,3,5,8-tetrahydro-1<i>H</i>-1,2,4-triazolo[1,2-<i>a</i>]pyridazine-1,3-dione‒Water (1/1): a Face-Selective Diels‒Alder Reaction of 2-Alkoxy-1,3-butadiene","Acta Crystallographica Section C","1997","53","12","1941","1943","10.1107/S0108270197007853","","","0.71073","MoKα","","0.19","0.0548","","0.1855","0.134","","","","1.011","1.175","1.175","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006747","12.4501","0.0009","18.6708","0.0011","7.984","0.0009","90","","90","","90","","1855.9","0.3","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H28 N2 O4 Pt -","- C16 H28 N2 O4 Pt -","- C64 H112 N8 O16 Pt4 -","4","1","AB1481","Yuge, Hidetaka; Miyamoto, Takeshi Ken","Dual Behaviour of Acetylacetonate Anions in the Hydrogen-Bonded Supramolecular Structure (Acetylacetonato-<i>O</i>,<i>O</i>')[<i>trans</i>-(1<i>R</i>,2<i>R</i>)-diaminocyclohexane-<i>N</i>,<i>N</i>']platinum(II) Acetylacetonate","Acta Crystallographica Section C","1997","53","12","1816","1819","10.1107/S0108270197010792","","","0.71069","MoKα","","","0.0309","","","0.0615","0.0657","","","","1.028","1.028","1.024","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006748","7.634","0.004","8.243","0.009","8.507","0.007","69.1","0.08","64.97","0.05","72.96","0.07","446.7","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(Acetyl)-3-(5-cyano-2-furyl)propenenitrile","","- C10 H6 N2 O2 -","- C10 H6 N2 O2 -","- C20 H12 N4 O4 -","2","1","AB1486","Viktor Vrábel; Július Sivý; Štefan Marchalín","2-Acetyl-3-(5-cyano-2-furyl)propenenitrile","Acta Crystallographica Section C","1997","53","12","1926","1927","10.1107/S0108270197010809","","","0.71069","MoKα","","0.0882","0.0384","","0.0973","0.09","","","","0.941","1.196","1.196","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006749","7.552","0.003","8.172","0.001","15.624","0.003","90","","99.29","0.02","90","","951.6","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-methyl-5,8-dioxo-5,8-dihydro-furo[3,2-g]chromone","","- C12 H6 O5 -","- C12 H6 O5 -","- C48 H24 O20 -","4","1","AB1487","Yakoubi, Abderrahman; Jalel Eddine Hila; Habib, Boughzala; Bizid, Abdelmalek","The Khellin Quinone","Acta Crystallographica Section C","1997","53","12","1949","1950","10.1107/S0108270197010160","","","0.71069","MoKα","","0.0799","0.0464","","0.1205","0.1035","","","","1.093","1.19","1.19","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006750","10.64","0.002","5.987","0.002","12.726","0.003","90","","104.556","0.003","90","","784.6","0.4","294","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C8 H12 O2 -","- C8 H12 O2 -","- C32 H48 O8 -","4","1","AB1495","Ülkü, Dinçer; Tahir, M. Nawaz; Tanyeli, Cihangir; Demir, Ayhan S.; Dikici, Emre","2-Hydroxy-5,5-dimethylcyclohex-2-en-1-one","Acta Crystallographica Section C","1997","53","12","1998","1999","10.1107/S0108270197012079","","","0.71069","MoKα","","","0.048","","","0.054","","","","","0.85","0.85","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006751","10.903","0.002","8.603","0.002","26.175","0.005","90","","90","","90","","2455.2","0.9","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","N^1^, N^2^-Diphenylacetamidine","","","- C14 H14 N2 -","- C14 H14 N2 -","- C112 H112 N16 -","8","1","AB1499","Phillips, Paul R.; Barker, James; Errington, William; Wallbridge, Malcolm G.H.","<i>N</i>^1^,<i>N</i>^2^-Diphenylacetamidine","Acta Crystallographica Section C","1997","53","12","1968","1971","10.1107/S0108270197011347","","","0.71073","MoKα","","0.1382","0.0453","","0.1079","0.0926","","","","0.672","1.117","1.117","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006752","18.676","0.005","12.553","0.004","16.657","0.003","90","","130.134","0.008","90","","2985.6","1.4","293","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-poly[cadmium(II)-[bis-μ-(1,3-di-(4-pyridyl)propane-N:N') -μ-cyano-C,N-silver(I)-μ-cyano-C,N]]","","- C30 H28 Ag2 Cd N8 -","- C30 H28 Ag2 Cd N8 -","- C120 H112 Ag8 Cd4 N32 -","4","0.5","AV1010","Soma, Takayoshi; Iwamoto, Toschitake","Doubly Interpenetrating Three-Dimensional Framework Structure of <i>trans</i>-[Cd(dppn)~2~{Ag(CN)~2~}~2~]~<i>n~</i> [dppn = 1,3-Di(4-pyridyl)propane]","Acta Crystallographica Section C","1997","53","12","1819","1821","10.1107/S0108270197010196","","","0.71069","MoKα","","","0.0574","","","0.0488","","","","","0.93","0.93","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006753","22.5535","0.0001","10.4998","0.0001","12.1717","0.0002","90","","96.116","0.001","90","","2865.94","0.06","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1'-Bis(diphenylphosphine oxide)ferrocene Monohydrate at 173 K","","- C34 H30 Fe O3 P2 -","- C34 H30 Fe O3 P2 -","- C136 H120 Fe4 O12 P8 -","4","1","AV1015","Bolte, Michael; Naumann, Frank; Hashmi, A. Stephen K.","A New Modification of 1,1'-Bis(diphenylphosphine oxide)ferrocene at 173K","Acta Crystallographica Section C","1997","53","12","1785","1786","10.1107/S0108270197011207","","","0.71073","MoKα","","0.109","0.074","","0.142","0.13","","","","1.123","1.203","1.203","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2006754","10.5075","0.0015","10.6251","0.0015","23.407","0.003","90","","90","","90","","2613.2","0.6","296","","296","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","[8S-[7[R*(R*)],8R*]]-7-[2-[[1-(ethoxycarbonyl)-3- phenylpropyl]-amino]-1-oxopropyl]-1,4-dithia-7- azaspiro[4.4]nonane-8-carboxylic acid hydrochloride","","- C22 H33 Cl N2 O6 S2 -","- C22 H33 Cl N2 O6 S2 -","- C88 H132 Cl4 N8 O24 S8 -","4","1","BK1260","Xu, Wei; Wahle, Mark C.; Stowell, Joseph G.; Byrn, Stephen R.","Spirapril Hydrochloride Hydrate","Acta Crystallographica Section C","1997","53","12","1917","1919","10.1107/S0108270197008287","","","0.71073","MoKα","","0.061","0.04","","0.108","0.092","","","","1.09","1.052","1.052","","","","","has coordinates,has disorder","208466","2020-10-21","18:00:00",""
"2006755","14.493","0.002","14.493","0.002","10.191","0.002","90","","90","","120","","1853.8","0.5","130","2","130","2","","","","","","","","5","P 32","P 32","145","pyridinium trifluoroacetate","","","- C7 H6 F3 N O2 -","- C7 H6 F3 N O2 -","- C63 H54 F27 N9 O18 -","9","3","BK1317","Palmore, G. Tayhas R.; McBride-Wieser, Mary T.","Pyridinium Trifluoroacetate: Spoked Columns of Hydrogen-Bonded Cyclic Dimers","Acta Crystallographica Section C","1997","53","12","1904","1907","10.1107/S0108270197009414","","","0.71073","MoKα","","0.0303","0.028","","0.126","0.0734","","","","1.057","1.069","1.069","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006756","15.018","0.007","17.517","0.004","8.226","0.004","90","","90","","90","","2164","1.5","150","","150","","","","","","","","","4","F m m 2","F 2 -2","42","","Bis[pentamethylcyclopentadiene]dibromothorium(IV)","","- C20 H30 Br2 Th -","- C20 H30 Br2 Th -","- C80 H120 Br8 Th4 -","4","0.25","BK1342","Rabinovich, Daniel; Schimek, George L.; Pennington, William T.; Nielsen, Jon B.; Abney, Kent D.","Dibromobis(η^5^-pentamethylcyclopentadienyl)thorium(IV)","Acta Crystallographica Section C","1997","53","12","1794","1797","10.1107/S0108270197010056","","","0.71073","MoKα","","0.0313","0.031","","0.0342","0.034","","","","","2.28","2.28","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006757","11.5747","0.0013","10.7639","0.0007","7.2556","0.0007","90","","90","","90","","903.97","0.15","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","cadmium glutamate dihydrate","","- C5 H11 Cd N O6 -","- C5 H11 Cd N O6 -","- C20 H44 Cd4 N4 O24 -","4","1","BK1343","Tomlin, David W.; Cooper, Thomas M.; Cline, Stephen M.; Hughes, John M.; Adams, W. Wade","Cadmium Glutamate Dihydrate","Acta Crystallographica Section C","1997","53","12","1815","1816","10.1107/S0108270197009426","","","0.71073","Mo","","","0.014","","","","0.02","","","","","","0.91","","","","has coordinates","192027","2020-10-21","18:00:00",""
"2006758","7.027","0.004","12.436","0.003","14.39","0.004","90","","93.95","0.04","90","","1254.5","0.9","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2,4-Dinitro-N,N-methylphenylamine","","- C13 H11 N3 O4 -","- C13 H11 N3 O4 -","- C52 H44 N12 O16 -","4","1","BM1140","Ellena, Javier; Punte, Graciela; Norma S. Nudelman","2,4-Dinitro-<i>N</i>,<i>N</i>-methylphenylaniline","Acta Crystallographica Section C","1997","53","12","1930","1932","10.1107/S0108270197007403","","","0.71073","MoKα","","0.1037","0.0449","","0.1574","0.107","","","","1.102","1.079","1.079","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006759","5.717","0.01","10.051","0.013","29.07","0.03","90","","90","","90","","1670","4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,2-O-isopropylidene-5-O-p-tosyl-α-D-xylofuranose","","- C15 H20 O7 S -","- C15 H20 O7 S -","- C60 H80 O28 S4 -","4","1","BM1152","Philip J. Cox; R. Alan Howie; Helena Rufino; James L. Wardell","Two Tosylated 1,2-<i>O</i>-Isopropylidene-α-<small>D</small>-xylofuranoses","Acta Crystallographica Section C","1997","53","12","1939","1941","10.1107/S0108270197010810","","","0.71073","MoKα","","0.106","0.0568","","0.1484","0.1061","","","","1.014","1.153","1.153","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006760","6.391","0.006","13.795","0.006","13.967","0.008","90","","100.17","0.06","90","","1212","1.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1,2-O-isopropylidene-3,5-di-O-p-tosyl-α-D-xylofuranose","","- C22 H26 O9 S2 -","- C22 H26 O9 S2 -","- C44 H52 O18 S4 -","2","1","BM1152","Philip J. Cox; R. Alan Howie; Helena Rufino; James L. Wardell","Two Tosylated 1,2-<i>O</i>-Isopropylidene-α-<small>D</small>-xylofuranoses","Acta Crystallographica Section C","1997","53","12","1939","1941","10.1107/S0108270197010810","","","0.71069","MoKα","","0.1396","0.0605","","0.1149","0.098","","","","0.968","1.23","1.23","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006761","4.965","0.004","9.728","0.005","18.168","0.012","90","","94.38","0.08","90","","874.9","1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","8-hydroxyquinoline-O-sulfuric acid","8-hydroxyquinoline-O-sulfuric acid","","- C9 H7 N O4 S -","- C9 H7 N O4 S -","- C36 H28 N4 O16 S4 -","4","1","BM1154","Popek, Tomasz; Lis, Tadeusz","8-Hydroxyquinoline-<i>O</i>-sulfuric Acid and its Monohydrate","Acta Crystallographica Section C","1997","53","12","1983","1986","10.1107/S0108270197011219","","","0.71069","MoKα","","0.118","0.047","","0.134","0.11","","","","1.021","1.11","1.11","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006762","7.572","0.004","8.475","0.004","8.567","0.004","111.6","0.05","97.05","0.04","99.53","0.04","493.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","8-hydroxyquinoline-O-sulfuric acid monohydrate","8-hydroxyquinoline-O-sulfuric acid monohydrate","","- C9 H9 N O5 S -","- C9 H9 N O5 S -","- C18 H18 N2 O10 S2 -","2","1","BM1154","Popek, Tomasz; Lis, Tadeusz","8-Hydroxyquinoline-<i>O</i>-sulfuric Acid and its Monohydrate","Acta Crystallographica Section C","1997","53","12","1983","1986","10.1107/S0108270197011219","","","0.71069","MoKα","","0.059","0.035","","0.105","0.092","","","","1.032","1.046","1.046","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006763","16.876","0.003","14.756","0.002","13.541","0.002","90","","90","","90","","3372","0.9","173","2","173","","","","","","","","","6","P n m a","-P 2ac 2n","62","","Tetrachlorocatecholatochlorotripyridyl indium(III) diethylether solvate","","- C29 H35 Cl5 In N3 O4 -","- C29 H35 Cl5 In N3 O4 -","- C116 H140 Cl20 In4 N12 O16 -","4","0.5","BM1155","Lawson, Yvonne G.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.","Mononuclear Indium and Gallium Tetrachlorocatecholate Complexes","Acta Crystallographica Section C","1997","53","12","1805","1809","10.1107/S0108270197010901","","","0.71073","MoKα","","0.0655","0.0456","","0.1213","0.1062","","","","1.169","1.167","1.167","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006764","25.504","0.007","17.64","0.007","18.572","0.004","90","","106.99","0.02","90","","7991","4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetrachlorocatecholatochloropyridyl(1,10-phenanthroline) gallium (III) pyridine solvate","","- C40.5 H30.5 Cl5 Ga N6.5 O2 -","- C40.5 H30.5 Cl5 Ga N6.5 O2 -","- C324 H244 Cl40 Ga8 N52 O16 -","8","1","BM1155","Lawson, Yvonne G.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.","Mononuclear Indium and Gallium Tetrachlorocatecholate Complexes","Acta Crystallographica Section C","1997","53","12","1805","1809","10.1107/S0108270197010901","","","0.71073","MoKα","","0.1085","0.0589","","0.1812","0.1528","","","","0.973","1.068","1.068","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2006765","8.967","0.001","9.16","0.002","15.71","0.007","90","","90","","90","","1290.4","0.7","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-methyl Benzhydrylamine Hydrochloride","","- C14 H16 Cl N -","- C14 H16 Cl N -","- C56 H64 Cl4 N4 -","4","1","BM1158","Andres E. Goeta; Graciela Punte; Blas E. Rivero; Luis Bruno Blanch","<i>N</i>-Methyl- and <i>N</i>-Ethylbenzhydrylamine Hydrochloride","Acta Crystallographica Section C","1997","53","12","1913","1916","10.1107/S0108270197011359","","","0.71073","MoKα","","0.0645","0.0367","","0.0996","0.0818","","","","1.081","1.048","1.048","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006766","9.615","0.002","9.102","0.002","15.933","0.003","90","","91.13","0.03","90","","1394.1","0.5","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N-ethyl Benzhydrylamine Hydrochloride","","- C15 H18 Cl N -","- C15 H18 Cl N -","- C60 H72 Cl4 N4 -","4","2","BM1158","Andres E. Goeta; Graciela Punte; Blas E. Rivero; Luis Bruno Blanch","<i>N</i>-Methyl- and <i>N</i>-Ethylbenzhydrylamine Hydrochloride","Acta Crystallographica Section C","1997","53","12","1913","1916","10.1107/S0108270197011359","","","0.71073","MoKα","","0.1071","0.0523","","0.1163","0.0913","","","","1.033","1.062","1.062","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006767","7.3223","0.0007","7.6708","0.0006","13.216","0.001","105.062","0.009","92.139","0.008","110.002","0.009","667.03","0.11","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H24 N10 O2 -","- C30 H24 N10 O2 -","- C30 H24 N10 O2 -","1","0.5","BM1161","Nieuwenhuyzen, M.; Keyes, T. E.; Gallagher, J. F.; Vos, J. G.","A 2:1 Co-Crystal of Hydroquinone and 3,5-Bis(2-pyridyl)-1,2,4-triazole","Acta Crystallographica Section C","1997","53","12","1873","1875","10.1107/S0108270197009670","","","0.71073","MoKα","","0.076","0.048","","0.123","0.107","","","","1.036","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006768","18.703","0.002","9.955","0.001","15.016","0.001","90","","122.3","0.01","90","","2363.2","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-4-Nitrophenyl-trans-2-aminocyclohexanol","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C96 H128 N16 O24 -","8","1","BM1172","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vaylakkavoor T.Ramakrishnan","<i>N</i>-(4-Nitrophenyl)-<i>trans</i>-2-aminocyclohexanol","Acta Crystallographica Section C","1997","53","12","1865","1867","10.1107/S0108270197010159","","","0.71073","MoKα","","0.0971","0.0387","","0.0956","0.08","","","","0.817","1.035","1.035","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006769","9.233","0.001","15.283","0.001","7.448","0.001","90","","98.08","0.01","90","","1040.54","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Amino-1,6-dimethyl-quinol-2-one Monohydrate","","- C11 H14 N2 O2 -","- C11 H14 N2 O2 -","- C44 H56 N8 O8 -","4","1","BM1174","Kandasamy Chinnakali; Ibrahim Abdul Razak; Hoong-Kun Fun; Kamaraj Sriraghavan; Vaylakkavoor T.Ramakrishnan","5-Amino-1,6-dimethyl-1,2-dihydroquinolin-2-one Monohydrate","Acta Crystallographica Section C","1997","53","12","1855","1857","10.1107/S0108270197010767","","","0.71073","MoKα","","0.0502","0.039","","0.1267","0.1208","","","","1.07","1.18","1.18","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006770","6.7468","0.0007","7.4849","0.0008","10.1537","0.001","84.349","0.002","76.61","0.001","74.816","0.002","481.01","0.09","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","catena-aquatri(μ-chloro)tetrahydrofuranlanthanum(III)","","- C4 H10 Cl3 La O2 -","- C4 H9 Cl3 La O2 -","- C8 H18 Cl6 La2 O4 -","2","1","BM1180","Woodman, Timothy J.; Errington, William; Willey, Gerald R.","Polymeric Aquatri-μ-chloro-(tetrahydrofuran-<i>O</i>)lanthanum(III)","Acta Crystallographica Section C","1997","53","12","1801","1803","10.1107/S0108270197011165","","","0.71073","MoKα","","0.0562","0.045","","","","0.1085","","","","","","1.042","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006771","29.896","0.002","4.1678","0.0004","28.487","0.002","90","","117.742","0.002","90","","3141.5","0.4","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[3-(4-Bromophenyl)-1-(4-methoxyphenyl)pyrazol-5-yl]acetonitrile","","- C18 H14 Br N3 O -","- C18 H14 Br N3 O -","- C144 H112 Br8 N24 O8 -","8","1","BM1183","Malhotra, Sanjay; Parmar, Virinder S.; Errington, William","[3-(4-Bromophenyl)-1-(4-methoxyphenyl)pyrazol-5-yl]acetonitrile","Acta Crystallographica Section C","1997","53","12","1885","1887","10.1107/S0108270197011384","","","0.71073","MoKα","","0.081","0.05","","","","0.112","","","","","","1.156","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006772","7.2909","0.0008","8.8019","0.001","9.5696","0.0011","66.754","0.002","73.835","0.002","77.082","0.002","537.44","0.11","180","2","180","2","","","","","","","","3","P -1","-P 1","2","","5,7-Dimethoxy-6-hydroxy-4-methylcoumarin","","- C12 H12 O5 -","- C12 H12 O5 -","- C24 H24 O10 -","2","1","BM1185","Singh, Amarjit; Kumar, Rajesh; Parmar, Virinder S.; Errington, William","6-Hydroxy-5,7-dimethoxy-4-methylcoumarin","Acta Crystallographica Section C","1997","53","12","1966","1968","10.1107/S0108270197011785","","","0.71073","MoKα","","0.079","0.057","","0.119","0.138","","","","1.15","1.15","1.15","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006773","5.8346","0.0003","12.0877","0.0008","15.0908","0.0009","90","","90","","90","","1064.31","0.11","293","","300","","","","","","","","","4","I m m m","-I 2 2","71","","strontium doped hexa barium hepta magnesium fluoride","","- Ba5.24 F26 Mg7 Sr0.76 -","- Ba5.26 F26 Mg7 Sr0.74 -","- Ba10.52 F52 Mg14 Sr1.48 -","2","0.125","BR1171","Kubel, Frank; Hagemann, Hans; Bill, Hans","Mixed Ba~5.24~Sr~0.76~Mg~7~F~26~","Acta Crystallographica Section C","1997","53","12","1735","1738","10.1107/S0108270197009931","","","1.54183","CuKα","","0.032","0.031","","0.028","0.028","","","","3.756","3.787","3.787","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006774","9.332","0.003","9.332","","11.264","0.002","90","","90","","120","","849.5","0.3","296.2","","296.2","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","tetra calcium platinum(IV) oxide","","- Ca4 O6 Pt -","- Ca4 O6 Pt -","- Ca24 O36 Pt6 -","6","0.166667","BR1172","Claridge, John Bleddyn; Layland, Ralph Charles; zur Loye, Hans-Conrad","Ca~4~PtO~6~","Acta Crystallographica Section C","1997","53","12","1740","1741","10.1107/S0108270197011700","","","0.7107","MoKα","","","0.0424","","","0.0494","","","","","3.282","3.282","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006775","11.1104","0.0002","11.1104","0.0002","11.1104","0.0002","90","","90","","90","","1371.48","0.04","293","","293","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","iron tungsten nitride","","- Fe3 N W3 -","- Fe2.5 N0.5 W6 -","- Fe40 N8 W96 -","16","0.0833333","BR1183","Weil, Kenneth S.; Kumta, Prashant N.","Fe~3~W~3~N: a Rietveld Refinement Using X-ray Powder Diffraction","Acta Crystallographica Section C","1997","53","12","1745","1748","10.1107/S0108270197008305","","","","Cu","","","","","","","","","","1.3907","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006776","6.05098","0.00005","6.05098","0.00005","7.19498","0.00009","90","","90","","120","","228.145","0.004","295","","295","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","zinc dihydroxide divanadate dihydrate","","- H6 O11 V2 Zn3 -","- H2 O10.9998 V2 Zn3 -","- H2 O10.9998 V2 Zn3 -","1","0.0833333","BR1188","Zavalij, Peter Y.; Zhang, Fan; Whittingham, M. Stanley","A New Zinc Pyrovanadate, Zn~3~(OH)~2~V~2~O~7~.2H~2~O, from X-ray Powder Data","Acta Crystallographica Section C","1997","53","12","1738","1739","10.1107/S0108270197009700","","","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006777","9.515","0.001","12.782","0.001","16.467","0.002","83.94","0.01","88.95","0.01","80.68","0.01","1965.2","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","Tricyclohexylphosphinecarbondisulfide Tricyclohexylphosphinodithioformate, tricyclohexylphosphoniodithiocarboxylate, tricyclohexylphosphinemethanedithiolate, tricyclohexylphosphinodithiocarbamate, tricyclohexylphosphoniocarbodithioate,","Tricyclohexylphosphinodithioformate","","- C19 H33 P S2 -","- C19 H33 P S2 -","- C76 H132 P4 S8 -","4","2","BS1026","Vittal, Jagadese J.; Dean, Philip A.W.","Tricyclohexylphosphoniodithioformate","Acta Crystallographica Section C","1997","53","12","1879","1881","10.1107/S0108270197008755","","","0.71073","MoKα","","0.0586","0.0436","","0.1206","0.1139","","","","0.978","1.068","1.068","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006778","8.91","0.002","3.973","0.004","37.261","0.002","90","","92.9","0.01","90","","1317.3","1.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1-cyano-2-p-bromophenyl-1,8a-azulene","1-cyano-2-p-bromophenyl-1,8a-azulene","","- C17 H10 Br N -","- C17 H10 Br N -","- C68 H40 Br4 N4 -","4","1","BS1032","Kaftory, Menahem; Botoshansky, Mark; Daub, Jörg; Mirlach, Albert","1-Cyano-2-<i>p</i>-bromophenylazulene and 2-Azulenylmethyl 2-Anthraquinoate","Acta Crystallographica Section C","1997","53","12","1907","1909","10.1107/S0108270197009839","","","1.54178","CuKα","","0.0579","0.0376","","0.1215","0.1088","","","","1.141","1.191","1.191","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006779","7.441","0.006","41.869","0.006","5.934","0.007","90","","90","","90","","1849","3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2-azulene-methano-2-anthraquinoate","2-azulene-methano-2-anthraquinoate","","- C26 H16 O4 -","- C26 H16 O4 -","- C104 H64 O16 -","4","1","BS1032","Kaftory, Menahem; Botoshansky, Mark; Daub, Jörg; Mirlach, Albert","1-Cyano-2-<i>p</i>-bromophenylazulene and 2-Azulenylmethyl 2-Anthraquinoate","Acta Crystallographica Section C","1997","53","12","1907","1909","10.1107/S0108270197009839","","","0.71069","MoKα","","0.0836","0.0384","","0.1234","0.0834","","","","1.255","1.045","1.045","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006780","21.3183","0.0005","5.6751","0.0002","22.505","0.0004","90","","90","","90","","2722.73","0.13","173","2","173","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C17 H16 O2 -","- C17 H16 O2 -","- C136 H128 O16 -","8","2","BS1033","Abboud, Khalil A.; Ocampo, Rogelio; Dolbier Jr, William R.","α,α-Difluoro-β-lactone and its Non-Fluorinated Analog","Acta Crystallographica Section C","1997","53","12","1923","1926","10.1107/S0108270197010020","","","0.71073","MoKα","","0.059","0.048","","0.113","0.104","","","","1.08","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006781","6.154","0.001","13.484","0.002","17.732","0.003","90","","90","","90","","1471.4","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H14 F2 O2 -","- C17 H14 F2 O2 -","- C68 H56 F8 O8 -","4","1","BS1033","Abboud, Khalil A.; Ocampo, Rogelio; Dolbier Jr, William R.","α,α-Difluoro-β-lactone and its Non-Fluorinated Analog","Acta Crystallographica Section C","1997","53","12","1923","1926","10.1107/S0108270197010020","","","0.71073","MoKα","","0.072","0.034","","0.07","0.06","","","","1.05","1.24","1.24","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006782","8.87","0.002","11.956","0.003","13.699","0.003","90","","103.48","0.02","90","","1412.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C20 H26 Cr N9 S4 -","- C20 H26 Cr N9 S4 -","- C40 H52 Cr2 N18 S8 -","2","0.5","BS1039","María Teresa Garland; Ricardo F. Baggio; Florence Berezovsky; Jean Sala Pala","A Chromium(III) 2,2'-Bipyrimidine (bipym) Complex, (Et~4~N)[Cr(NCS)~4~(bipym)]","Acta Crystallographica Section C","1997","53","12","1803","1805","10.1107/S0108270197010858","","","0.71073","MoKα","","0.0809","0.046","","0.1467","0.1062","","","","0.982","0.999","0.999","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006783","11.578","0.005","22.385","0.01","13.062","0.006","90","","104.21","0.04","90","","3282","3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,3-di-(ethoxy-ethoxy-methoxy)calix[4]arene","","- C38 H44 O8 -","- C38 H44 O8 -","- C152 H176 O32 -","4","1","CF1134","Guelzim, Abdelhalim; Khrifi, Saâd; Baert, Francois; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques","1,3-Di(ethoxy-ethoxy-methoxy)calix[4]arene","Acta Crystallographica Section C","1997","53","12","1958","1960","10.1107/S0108270197007105","","","0.7107","MoKα","","0.1157","0.0679","","0.0636","0.0591","","","","1.897","2.295","2.295","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006784","7.288","0.002","10.287","0.007","5.071","0.003","90","","90","","90","","380.2","0.4","103","","103","","","","","","","","","3","P n m a","-P 2ac 2n","62","pyrrole","1-aza-cyclopentadiene","","- C4 H5 N -","- C4 H5 N -","- C16 H20 N4 -","4","0.5","CF1172","Richard Goddard; Oliver Heinemann; Carl Krüger","Pyrrole and a Co-crystal of 1<i>H</i>- and 2<i>H</i>-1,2,3-Triazole","Acta Crystallographica Section C","1997","53","12","1846","1850","10.1107/S0108270197009682","","","0.71069","MoKα","","0.0815","0.0584","","0.1509","0.1436","","","","0.97","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006785","9.3307","0.0001","19.372","0.003","3.6982","0.0009","90","","90","","90","","668.47","0.19","193","","193","","","","","","","","","3","A m a 2","A 2 -2a","40","1,2,3-triazole","1H-1,2,3-triazole 2H-1,2,3-triazole cocrystal","","- C4 H6 N6 -","- C4 H6 N6 -","- C16 H24 N24 -","4","0.5","CF1172","Richard Goddard; Oliver Heinemann; Carl Krüger","Pyrrole and a Co-crystal of 1<i>H</i>- and 2<i>H</i>-1,2,3-Triazole","Acta Crystallographica Section C","1997","53","12","1846","1850","10.1107/S0108270197009682","","","0.71069","MoKα","","0.0637","0.0588","","0.1681","0.1624","","","","1.14","1.157","1.157","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006786","8.779","0.001","9.942","0.002","12.385","0.002","71.84","0.01","74.2","0.01","87.29","0.01","987.5","0.3","110","3","110","3","","","","","","","","5","P -1","-P 1","2","1,4,8,11-(tetra-2-carboxyethyl)-1,4,8,11-tetraazacyclotetradecane (H~2~TETP)^2-^, 2Na^+^.16H~2~O","H2TETP","","- C22 H70 N4 Na2 O24 -","- C22 H70 N4 Na2 O24 -","- C22 H70 N4 Na2 O24 -","1","0.5","CF1178","Valérie Dahaoui-Gindrey; Slimane Dahaoui; Claude Lecomte; Frédéric Barbette; Roger Guilard","Disodium Hexadecahydrate Diprotonated Form of 1,4,8,11-Tetra(2-carboxy)ethyl-1,4,8,11-tetraazacyclotetradecane (H~2~TETP)^2{-^} at 110 K","Acta Crystallographica Section C","1997","53","12","1797","1799","10.1107/S0108270197009694","","","0.7107","MoKα","","","0.03","","","0.036","","","","","1.59","1.59","","","","","has coordinates","191095","2020-10-21","18:00:00",""
"2006787","6.286","0.002","7.698","0.002","18.144","0.005","90.65","0.02","91.92","0.03","96.51","0.03","871.7","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","α-Cyclohexyl-β-Methoxycarbonyl-γ-Lactame","","- C19 H25 N O3 -","- C19 H25 N O3 -","- C38 H50 N2 O6 -","2","1","CF1182","Ben Amor, Fatma; Beltaif, Imen; Besbes, Rafâa; Amri, Hassen","Methyl 1-Benzyl-3-cyclohexyl-2-oxopyrrolidine-2-carboxylate","Acta Crystallographica Section C","1997","53","12","1919","1921","10.1107/S0108270197010287","","","0.7107","MoKα","","0.1045","0.0532","","0.1503","0.1219","","","","1.055","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006788","15.005","0.005","6.829","0.005","17.749","0.005","90","0.005","102.25","0.005","90","0.005","1777.3","1.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H19 F3 N O3 P -","- C15 H19 F6 N O3 P -","- C60 H76 F24 N4 O12 P4 -","4","1","CF1184","Benniston, Andrew C.; Yufit, Dmitrii S.; Mackie, Philip R.","A π-Stacked Complex Between 4,4'-Dimethyl-4,4'-bipyridinium Bis(hexafluorophosphate) and 1,5-Bis[(hydroxyethoxy)ethoxy]naphthalene","Acta Crystallographica Section C","1997","53","12","1899","1901","10.1107/S0108270197011438","","","0.71069","MoKα","","0.19","0.0761","","0.2796","0.2026","","","","1.032","1.178","1.178","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006789","5.3861","0.0006","11.141","0.0011","27.411","0.003","90","","93.433","0.008","90","","1641.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Methyl-8-hydroxy-9-phenylthio-7,8,9,10-tetrahydro-7,8-benzocoumarin","","- C20 H18 O3 S -","- C20 H18 O3 S -","- C80 H72 O12 S4 -","4","1","CF1193","Senthil Kumar; Kandasamy Chinnakali; Kandasamy Sivakumar; Hoong-Kun Fun; Kamaraj Sriraghavan","8-Hydroxy-4-methyl-9-phenylthio-7,8,9,10-tetrahydro-7,8-benzocoumarin","Acta Crystallographica Section C","1997","53","12","1854","1855","10.1107/S0108270197011451","","","0.71073","MoKα","","0.055","0.038","","0.118","0.102","","","","1.032","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006790","10.092","0.011","10.514","0.011","12.415","0.014","70.53","0.08","71.81","0.08","61.85","0.07","1076","2","293","","293","","","","","","","","","7","P -1","-P 1","2","","Chloro-bis(2,6-dimethyl piperidino)phosphoramide trichloroantimonate","","- C14 H28 Cl4 N2 O P Sb -","- C14 H28 Cl4 N2 O P Sb -","- C28 H56 Cl8 N4 O2 P2 Sb2 -","2","1","DE1057","Vijjulatha, M.; Kumara Swamy, K. C.; Huch, Volker; Veith, Michael","The 1:1 Antimony Trichloride Adduct of Chlorobis(2,6-dimethylpiperidin-1-yl)phosphine Oxide","Acta Crystallographica Section C","1997","53","12","1789","1791","10.1107/S0108270197009487","","","0.71073","MoKα","","0.0342","0.0322","","0.0867","0.0853","","","","","1.147","1.147","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006791","8.819","0.001","15.244","0.002","6.828","0.002","90","","90","","90","","917.9","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Structure d'un Monophosphate synthétique de Magnésium et de Sodium: MgNaPO~4~","","- Mg3 Na3 O12 P3 -","- Mg3 Na3 O12 P3 -","- Mg12 Na12 O48 P12 -","4","1","DU1170","Imura, Hiroshi; Kawahara, Akira","Structure d'un Monophosphate Synthétique de Magnésium et de Sodium: Mg~3~Na~3~(PO~4~)~3~","Acta Crystallographica Section C","1997","53","12","1733","1735","10.1107/S0108270197003211","","","0.7107","MoKα","","","0.055","","","0.046","","","","","1.26","1.26","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006792","14.2087","0.0001","20.3168","0.0003","19.8322","0.0002","90","","110.085","0.0001","90","","5376.89","0.1","300","2","300","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexa[2,4,6-tri(isopropyl)thiophenolatogold(I)] Diethyl Ether Solvate","","- C94 H148 Au6 O S6 -","- C90 H138 Au6 S6 -","- C180 H276 Au12 S12 -","2","0.5","FG1278","LeBlanc, Daren J.; Lock, Colin J.L.","<i>cyclo</i>-Hexakis[(2,4,6-triisopropylthiophenolato-<i>S</i>:<i>S</i>)gold(I)] Diethyl Ether Solvate","Acta Crystallographica Section C","1997","53","12","1765","1768","10.1107/S010827019700930X","","","0.71073","MoKα","","0.1142","0.0533","","0.1049","0.09","","","","1.006","1.173","1.173","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006793","16.907","0.006","12.543","0.004","20.86","0.007","90","","117.89","0.03","90","","3910","3","296","2","296","2","","","","","","","","6","C 1 c 1","C -2yc","9","","36,37,38-Trimethoxy-5,10,15-trimethyl-22,25,30,33-tetraoxa-1,19-diazapentacyclo [17.8.8.1^3,7^.1^8,12^.1^13,17^]octatriaconta-3,5,7(36),8,10,12(37),13,15, 17(38)-nonaene sodium thiocyanate clathrate","","- C39 H52 N3 Na O7 S -","- C39 H52 N3 Na O7 S -","- C156 H208 N12 Na4 O28 S4 -","4","1","FG1279","Maverick, Emily F.; Knobler, Carolyn B.; Trueblood, Kenneth N.; Ho, Siew Peng","Three Complexes of a [2.2]Cryptahemispherand","Acta Crystallographica Section C","1997","53","12","1822","1827","10.1107/S0108270197009530","","","0.71073","MoKα","","0.0951","0.0548","","0.1516","0.1354","","","","1.064","1.201","1.201","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006794","13.921","0.012","11.397","0.011","25.53","0.02","90","","101.74","0.02","90","","3966","6","156","","156","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","36,37,38-Trimethoxy-5,10,15-trimethyl-22,25,30,33-tetraoxa-1,19-diazapentacyclo [17.8.8.1^3,7^.1^8,12^.1^13,17^]octatriaconta-3,5,7(36),8,10,12(37),13,15, 17(38)-nonaene potassium thiocyanate monohydrate","","- C39 H54 K N3 O8 S -","- C39 H54 K N3 O8 S -","- C156 H216 K4 N12 O32 S4 -","4","1","FG1279","Maverick, Emily F.; Knobler, Carolyn B.; Trueblood, Kenneth N.; Ho, Siew Peng","Three Complexes of a [2.2]Cryptahemispherand","Acta Crystallographica Section C","1997","53","12","1822","1827","10.1107/S0108270197009530","","","0.71073","MoKα","","0.2244","0.0642","","0.2179","0.13","","","","1.056","1.108","1.108","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006795","11.252","0.01","14.272","0.013","25.99","0.02","90","","104.72","0.02","90","","4037","6","156","","156","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","36,37,38-Trimethoxy-5,10,15-trimethyl-22,25,30,33-tetraoxa-1,19-diazapentacyclo [17.8.8.1^3,7^.1^8,12^.1^13,17^]octatriaconta-3,5,7(36),8,10,12(37),13,15, 17(38)-nonaene cesium perchlorate monohydrate C38 H52 Cs1 N2 O7 1+,Cl1 O4 1-,H2 O1","","- C38 H54 Cl Cs N2 O12 -","- C38 H54 Cl Cs N2 O12 -","- C152 H216 Cl4 Cs4 N8 O48 -","4","1","FG1279","Maverick, Emily F.; Knobler, Carolyn B.; Trueblood, Kenneth N.; Ho, Siew Peng","Three Complexes of a [2.2]Cryptahemispherand","Acta Crystallographica Section C","1997","53","12","1822","1827","10.1107/S0108270197009530","","","0.71073","MoKα","","0.164","0.0686","","0.2265","0.1648","","","","1.04","1.068","1.068","","","","","has coordinates,has disorder","194538","2020-10-21","18:00:00",""
"2006796","21.21","0.009","14.745","0.006","11.807","0.005","90","","90","","90","","3693","3","295","2","295","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","(33,34,35-Trimethoxy-5,10,15-trimethyl-22,25,30-trioxa-1,19-diazapentacyclo [17.5.5.1^3,7^,1^8,12^.1^13,17^] pentatriaconta-3,5,7(35),8,10,12(34),13,15,17(33)-nonaene potassium thiocyanate","","- C37 H48 K N3 O6 S -","- C37 H48 K N3 O6 S -","- C148 H192 K4 N12 O24 S4 -","4","0.5","FG1280","Knobler, Carolyn B.; Maverick, Emily F.; Trueblood, Kenneth N.; Ho, Siew Peng","A K^+^ Complex of a [2.1]Cryptahemispherand at 295K","Acta Crystallographica Section C","1997","53","12","1832","1834","10.1107/S0108270197009542","","","0.7107","MoKα","","0.1167","0.0755","","0.2207","0.2016","","","","1.071","1.228","1.228","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006797","7.835","0.0014","37.23","0.008","11.318","0.003","90","0.02","90","0.02","90","0.02","3301.4","1.3","117","2","117","2","","","","","","","","4","P n a 21","P 2c -2n","33","","33,34,35-Trimethoxy-5,10,15-trimethyl-22,25,30-trioxa-1,19-diazapentacyclo(17.8 .5.1^3,7^,1^8,12^.1^13,17^)pentatriaconta-3,5,7(35),8,10,12(34),13,15,17(3 3)-nonaene-2,18-dione C36 H44 N2 O8","","- C36 H44 N2 O8 -","- C36 H44 N2 O8 -","- C144 H176 N8 O32 -","4","1","FG1281","Maverick, Emily F.; Knobler, Carolyn B.; Trueblood, Kenneth N.; Ho, Siew Peng","Two Isomeric [2.1]Cryptahemispherand Diamides","Acta Crystallographica Section C","1997","53","12","1835","1838","10.1107/S0108270197009554","","","0.71073","MoKα","","0.0781","0.061","","0.1616","0.1462","","","","1.05","1.086","1.086","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006798","16.055","0.004","15.37","0.004","14.64","0.003","90","0.02","90","0.02","90","0.02","3612.6","1.5","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","33,34,35-Trimethoxy-5,10,15-trimethyl-22,25,30-trioxa-1,19-diazapentacyclo [17.8.5.1^3,7^,1^8,12^.1^13,17^] pentatriaconta-3,5,7(35),8,10,12(34),13,15,17(33)-nonaene-2,18-dione)","","- C36 H44 N2 O8 -","- C36 H44 N2 O8 -","- C144 H176 N8 O32 -","4","0.5","FG1281","Maverick, Emily F.; Knobler, Carolyn B.; Trueblood, Kenneth N.; Ho, Siew Peng","Two Isomeric [2.1]Cryptahemispherand Diamides","Acta Crystallographica Section C","1997","53","12","1835","1838","10.1107/S0108270197009554","","","1.54184","CuKα","","0.0687","0.0601","","0.1724","0.1616","","","","1.056","1.101","1.101","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006799","19.919","0.002","14.725","0.002","21.387","0.002","90","","111.85","0.003","90","","5822.3","1.1","295","","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","30,31,32-trimethoxy-5,10,15- trimethyl-22,27-dioxa-1,19-diazapentacyclo[17.5.5.1^3,7^.1^8,12^.1^13,17^]do triaconta-3,5,7(32),8,10,12(31),13,15,17(30)-nonaene sodium tetraphenylborate C34 H44 N2 Na1 O5 1+,C24 H20 B1 1-","","- C58 H64 B N2 Na O5 -","- C58.8 H64 B Cl0.6 N2 Na O5.5 -","- C235.2 H256 B4 Cl2.4 N8 Na4 O22 -","4","1","FG1282","Knobler, Carolyn B.; Maverick, Emily F.; Trueblood, Kenneth N.; Ho, Siew Peng","An Na^+^ Complex and a Bis-BH~3~ Complex of a [1.1]Cryptahemispherand","Acta Crystallographica Section C","1997","53","12","1827","1832","10.1107/S0108270197009566","","","0.71073","MoKα","","0.272","0.117","","0.388","0.324","","","","1.016","1.446","1.446","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006800","15.605","0.011","15.799","0.007","15.023","0.007","90","0.04","94.43","0.05","90","0.05","3693","4","115","2","115","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","hexahydro-{(30,31,32-trimethoxy-5,10,15- trimethyl-22,27-dioxa-1,19-diazapentacyclo[17.5.5.1^3,7^.1^8,12^.1^13,17^] dotriaconta-3,5,7(32),8,10,12(31),13,15,17(30)-nonaene-N^1^:N^19^)} -di-boron (CH~2~Cl~2~ solvate)","","- C34.5 H51 B2 Cl N2 O5 -","- C34.51 H49.74 B2 Cl1.02 N2 O5 -","- C138.04 H198.96 B8 Cl4.08 N8 O20 -","4","1","FG1282","Knobler, Carolyn B.; Maverick, Emily F.; Trueblood, Kenneth N.; Ho, Siew Peng","An Na^+^ Complex and a Bis-BH~3~ Complex of a [1.1]Cryptahemispherand","Acta Crystallographica Section C","1997","53","12","1827","1832","10.1107/S0108270197009566","","","0.71073","MoKα","","0.135","0.077","","0.183","0.158","","","","1.034","1.193","1.193","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006801","11.5345","0.0001","13.7765","0.0002","15.1022","0.0001","90","","90","","90","","2399.82","0.04","300","2","300","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Piperidinium Bis(azido)triphenylstannates","","- C23 H27 N7 Sn -","- C23 H27 N7 Sn -","- C92 H108 N28 Sn4 -","4","1","FG1297","Wharf, Ivor; Wojtowski, Ryszard; Onyszchuk, Mario; Simard, Michel G.","Piperidinium Diazidotriphenylstannate and Quinuclidinium Diazidotriphenylstannate","Acta Crystallographica Section C","1997","53","12","1791","1794","10.1107/S010827019700958X","","","0.71073","MoKα","","0.0321","0.0247","","0.0514","","0.0484","","","1.069","","","1.066","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006802","27.1533","0.0004","9.9162","0.0002","19.0714","0.0001","90","","98.284","0.001","90","","5081.54","0.13","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Quinuclidinium bis(azido)triphenylstannates","","- C25 H29 N7 Sn -","- C25 H29 N7 Sn -","- C200 H232 N56 Sn8 -","8","2","FG1297","Wharf, Ivor; Wojtowski, Ryszard; Onyszchuk, Mario; Simard, Michel G.","Piperidinium Diazidotriphenylstannate and Quinuclidinium Diazidotriphenylstannate","Acta Crystallographica Section C","1997","53","12","1791","1794","10.1107/S010827019700958X","","","0.71073","MoKα","","0.0696","0.0402","","0.1101","","0.088","","","1.091","","","1.047","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006803","6.437","0.0007","9.3798","0.0012","12.0427","0.0009","90","","90","","90","","727.11","0.13","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3-Deoxy-D-fructose","3-Deoxy-D-erythro-hexulose","","- C6 H12 O5 -","- C6 H12 O5 -","- C24 H48 O20 -","4","1","FG1300","Szarek, Walter A.; Roszak, Aleksander W.; Crone, Giselle M.; Martin, Olivier R.","3-Deoxy-<small>D</small>-fructose","Acta Crystallographica Section C","1997","53","12","1921","1923","10.1107/S0108270197009311","","","0.71069","MoKα","","0.045","0.036","","0.092","0.082","","","","0.919","0.919","0.919","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006804","7.641","0.003","16.534","0.001","18.569","0.002","90","","90","","90","","2345.9","1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 3β-bromine-7α-hydroxy-5β-cholan-24-oate","","- C25 H41 Br O3 -","- C25 H41 Br O3 -","- C100 H164 Br4 O12 -","4","1","FG1305","Dago Morales, Angel; Pomés Hernández, Ramón; Coll Manchado, Francisco; Pérez Gil, Roxana; Punte, Graciela; Echeverría, Gustavo","Methyl 3β-Bromine-7α-hydroxy-5β-cholan-24-oate","Acta Crystallographica Section C","1997","53","12","1881","1883","10.1107/S0108270197007464","","","0.71069","MoKα","","0.2017","0.0501","","0.1271","0.0771","","","","1.169","1.169","1.169","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006805","11.1451","0.0012","12.5674","0.0008","15.5207","0.0012","95.374","0.008","105.384","0.008","92.095","0.009","2082.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","diperylenium(1+) bis[1,4-dihydro-2,3-quinoxalinedithionato(2)S,S^'^]cuprate(III)","","- C56 H32 Cu N4 S4 -","- C56 H32 Cu N4 S4 -","- C112 H64 Cu2 N8 S8 -","2","1","FG1309","Santos, Isabel C.; Ayllon, José A.; Henriques, Rui T.; Almeida, Manuel; Alcácer, Luís; Duarte, M. Teresa","A New Perylene Salt: Diperylenium(1+) Bis[quinoxaline-2,3-dithiolato(2 ‒)-<i>S</i>,<i>S</i>']cuprate(III)","Acta Crystallographica Section C","1997","53","12","1768","1770","10.1107/S0108270197007919","","","0.71069","MoKα","","0.2108","0.0549","","0.147","0.0861","","","","1.128","1.095","1.095","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006806","12.786","0.002","10.29","0.002","13.095","0.002","90","","118.7","0.01","90","","1511.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Famphur","O,O-Dimethyl-O-(p-(N,N-dimethylsulfamoyl)phenyl)phosphorothioate","","- C10 H16 N O5 P S2 -","- C10 H16 N O5 P S2 -","- C40 H64 N4 O20 P4 S8 -","4","1","FG1316","Baughman, Russell G.","Organophosphorus Insecticides. 18. Famphur: <i>O</i>,<i>O</i>-Dimethyl <i>O</i>-[<i>p</i>-(<i>N</i>,<i>N</i>-Dimethylsulfamoyl)phenyl] Phosphorothioate","Acta Crystallographica Section C","1997","53","12","1928","1929","10.1107/S0108270197011189","","","0.71073","MoKα","","0.068","0.044","","0.125","0.109","","","","1.052","1.099","1.099","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006807","10.955","0.002","11.186","0.002","6.221","0.002","97.13","0.02","100.69","0.02","79.52","0.02","733.4","0.3","170","1","170","1","","","","","","","","4","P -1","-P 1","2","","5(R),7-(1(S)-hydroxybenzyl)-6-methyl-4-oxa-1-thiaspiro[5.4]dec-6-ene","","- C16 H20 O2 S -","- C16 H20 O2 S -","- C32 H40 O4 S2 -","2","1","FG1317","Parvez, Masood; Jeyaraj, Duraiswamy A.; Yadav, Veejendra K.","Oxa-thia-spiro-decene Derivatives","Acta Crystallographica Section C","1997","53","12","1961","1963","10.1107/S0108270197009591","","","0.71069","MoKα","","0.0764","0.0459","","0.1529","0.1219","","","","1.001","1.009","1.009","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006808","6.62","0.003","11.322","0.003","12.297","0.003","90","","103.52","0.03","90","","896.1","0.5","200","1","200","1","","","","","","","","4","P 1 21 1","P 2yb","4","","7-(1'-2-hydroxypropyl)-6-methyl-4-oxa-1-thiaspiro[5.4]dec-6-enyl p-methoxy benzoate","","- C19 H24 O4 S -","- C19 H24 O4 S -","- C38 H48 O8 S2 -","2","1","FG1317","Parvez, Masood; Jeyaraj, Duraiswamy A.; Yadav, Veejendra K.","Oxa-thia-spiro-decene Derivatives","Acta Crystallographica Section C","1997","53","12","1961","1963","10.1107/S0108270197009591","","","0.71069","MoKα","","0.1169","0.0538","","0.232","0.14","","","","1.128","1.192","1.192","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006809","7.065","0.002","7.199","0.001","9.726","0.002","105.61","0.01","103.46","0.01","99.61","0.01","449.21","0.17","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","2,4,5-trimethylbenzoic acid","","- C10 H12 O2 -","- C10 H12 O2 -","- C20 H24 O4 -","2","1","FG1324","Barcon, Alan; Coté, Marie L.; Brunskill, Andrew P. J.; Thompson, Hugh W.; Lalancette, Roger A.","2,4,5-Trimethylbenzoic Acid","Acta Crystallographica Section C","1997","53","12","1842","1845","10.1107/S0108270197009335","","","0.71073","MoKα","","0.092","0.05","","0.149","0.122","","","","1.025","1.106","1.106","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2006810","8.151","0.001","13.426","0.002","8.344","0.002","90","","116.04","0.01","90","","820.4","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(+\-)-3-Oxoindanecarboxylic Acid","(+\-)-2,3-Dihydro-3-oxo-1H-indenecarboxylic Acid","","- C10 H8 O3 -","- C10 H8 O3 -","- C40 H32 O12 -","4","1","FG1331","Lalancette, Roger A.; Brunskill, Andrew P. J.; Thompson, Hugh W.","(±)-2,3-Dihydro-3-oxo-1<i>H</i>-indenecarboxylic Acid: Hydrogen-Bonding Patterns in a γ-Keto Acid and its Monohydrate","Acta Crystallographica Section C","1997","53","12","1838","1842","10.1107/S0108270197009608","","","0.71073","MoKα","","0.098","0.056","","0.147","0.124","","","","1.03","1.12","1.12","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006811","5.984","0.001","7.763","0.001","11.086","0.001","107.29","0.01","105.32","0.01","93.12","0.01","469.27","0.12","293","2","293","2","","","","","","","","3","P -1","-P 1","2","(+\-)-3-Oxoindanecarboxylic Acid Monohydrate","(+\-)-2,3-Dihydro-3-oxo-1H-indenecaboxylic Acid Monohydrate","","- C10 H10 O4 -","- C10 H10 O4 -","- C20 H20 O8 -","2","1","FG1331","Lalancette, Roger A.; Brunskill, Andrew P. J.; Thompson, Hugh W.","(±)-2,3-Dihydro-3-oxo-1<i>H</i>-indenecarboxylic Acid: Hydrogen-Bonding Patterns in a γ-Keto Acid and its Monohydrate","Acta Crystallographica Section C","1997","53","12","1838","1842","10.1107/S0108270197009608","","","0.71073","MoKα","","0.121","0.056","","0.15","0.117","","","","1.03","1.148","1.148","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006812","9.0207","0.0006","10.1127","0.0008","10.5364","0.001","90","","111.809","0.006","90","","892.38","0.13","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Ethyl-3-hydroxy-4,4-dimethyl-pyrrolidone-2","","- C8 H15 N O2 -","- C8 H15 N O2 -","- C32 H60 N4 O8 -","4","1","FG1349","Hollenberg, Niels; Grahn, Walter; Jones, Peter G.","1-Ethyl-3-hydroxy-4,4-dimethyl-2-pyrrolidone","Acta Crystallographica Section C","1997","53","12","1851","1852","10.1107/S0108270197009347","","","0.71073","MoKα","","0.047","0.037","","0.103","0.099","","","","1.05","1.131","1.131","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006813","7.3743","0.0009","6.6684","0.0007","14.1803","0.0011","90","","95.074","0.009","90","","694.58","0.12","296","","296","","","","","","","","","3","P 1 21 1","P 2yb","4","","(5aS,7S)-7-Isopropenyl-3-methyl-1H-5a,6,7,8,9-pentahydro-1- oxopyrano[4,3-b][1]benzopyran","","- C16 H18 O3 -","- C16 H18 O3 -","- C32 H36 O6 -","2","1","FG1352","Hua, Duy H.; Chen, Yi; Robinson, Paul D.; Meyers, Cal Y.","(5a<i>S</i>,7<i>S</i>)-7-Isopropenyl-3-methyl-5a,6,8,9-tetrahydro-1<i>H</i>,7<i>H</i>-pyrano[4,3-<i>b</i>][1]benzopyran-1-one","Acta Crystallographica Section C","1997","53","12","1995","1997","10.1107/S0108270197011220","","","0.71069","MoKα","","0.1022","0.0378","","0.1151","","0.0891","","","1.026","1.128","1.128","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006814","5.3498","0.0011","19.754","0.003","11.665","0.002","90","","93.97","0.02","90","","1229.8","0.4","143","2","143","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-Aza-4-azoniabicyclo[2.2.2]octane Di(methanesulfonyl)amide","","- C8 H19 N3 O4 S2 -","- C8 H19 N3 O4 S2 -","- C32 H76 N12 O16 S8 -","4","1","FG1353","Henschel, Dagmar; Moers, Oliver; Blaschette, Armand; Jones, Peter G.","Polysulfonylamines. XCII. 1-Aza-4-azoniabicyclo[2.2.2]octane Di(methanesulfonyl)amidate","Acta Crystallographica Section C","1997","53","12","1877","1879","10.1107/S0108270197011633","","","0.71073","MoKα","","0.066","0.045","","0.117","0.103","","","","1.033","1.049","1.049","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006815","8.2035","0.0016","15.747","0.003","13.842","0.003","90","","93.638","0.016","90","","1784.5","0.6","143","2","143","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(1,2-Benzenedisulfonylimido-O)(1,4,7,10-tetraoxacyclododecane)lithium","","- C14 H20 Li N O8 S2 -","- C14 H20 Li N O8 S2 -","- C56 H80 Li4 N4 O32 S8 -","4","1","FG1354","Jones, Peter G.; Moers, Oliver; Blaschette, Armand","Polysulfonylamines. XCIII. (1,2-Benzenedisulfonylimido-<i>O</i>)(1,4,7,10-tetraoxacyclododecane-κ^4^<i>O</i>)lithium","Acta Crystallographica Section C","1997","53","12","1809","1811","10.1107/S0108270197011232","","","0.71073","MoKα","","0.045","0.0349","","0.0851","0.0787","","","","1.05","1.063","1.063","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006816","21.903","0.004","10.449","0.0014","10.1168","0.0014","90","","107.298","0.012","90","","2210.7","0.6","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(diphenylphosphino)methane Diselenide","","- C25 H22 P2 Se2 -","- C25 H22 P2 Se2 -","- C100 H88 P8 Se8 -","4","0.5","FG1358","Ahrens, Birte; Jones, Peter G.","A New Modification of Bis(diphenylphosphino)methane Diselenide","Acta Crystallographica Section C","1997","53","12","1852","1854","10.1107/S0108270197011463","","","0.71073","MoKα","","0.0587","0.0369","","0.0936","0.0884","","","","0.925","1.044","1.044","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006817","7.372","0.005","7.688","0.005","10.76","0.008","83.56","0.05","81.6","0.04","67.46","0.04","556.2","0.7","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","1,2-Benzenedisulfonylamine Acetonitrile Solvate (1/1)","","- C8 H8 N2 O4 S2 -","- C8 H8 N2 O4 S2 -","- C16 H16 N4 O8 S4 -","2","1","FG1377","Jones, Peter G.; Wirth, Andreas; Moers, Oliver; Blaschette, Armand","Polysulfonylamines. XCVIII. 1,2-Benzenedisulfonylamine Acetonitrile Solvate (1/1)","Acta Crystallographica Section C","1997","53","12","1897","1899","10.1107/S0108270197012080","","","0.71073","MoKα","","0.0452","0.0358","","0.0901","0.0844","","","","1.071","1.095","1.095","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006818","11.645","0.002","11.645","0.002","38.273","0.008","90","","90","","120","","4494.7","1.4","293","2","293","2","","","","","","","","6","R 3 2 :H","R 3 2""","155","","Monoammonium bis(D-penicillaminato-S)aurate(I) 3.667 hydrate","","- C10 H31.333 Au N3 O7.667 S2 -","- C10 H31.3333 Au N3 O7.66667 S2 -","- C90 H282 Au9 N27 O69 S18 -","9","0.5","FR1038","LeBlanc, Daren J.; Britten, James F.; Wang, Zhixian; Howard-Lock, Helen E.; Lock, Colin J.L.","Monoammonium Bis(<small>D</small>-penicillaminato-<i>S</i>)aurate(I) 3.667-Hydrate","Acta Crystallographica Section C","1997","53","12","1763","1765","10.1107/S0108270197009724","","","0.56086","AgKα","","0.0347","0.0277","","0.0598","0.0581","","","","0.995","1.031","1.031","","","","","has coordinates,has disorder","187340","2020-10-21","18:00:00",""
"2006819","7.996","0.001","20.776","0.002","9.761","0.001","90","","101.32","0.01","90","","1590","0.3","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2'-hydroxy-4-N-methylstilbazonium iodide methanol solvate","1-methyl-4-(2-(2-hydroxyphenyl)vinyl)pyridium iodide methanol solvate","","- C15 H18 I N O2 -","- C15 H18 I N O2 -","- C60 H72 I4 N4 O8 -","4","1","FR1059","Zhang, De-Chun; Zhang, Tian-Zhu; Zhang, Yan-Qiu; Fei, Zheng-Hao; Yu, Kai-Bei","2'-Hydroxy-4-<i>N</i>-methylstilbazonium Iodide Methanol Solvate, C~14~H~14~NO^+^.I^{-^}.CH~3~OH","Acta Crystallographica Section C","1997","53","12","1895","1897","10.1107/S0108270197010342","","","0.71073","MoKα","","0.044","0.027","","0.065","0.061","","","","0.989","1.128","1.128","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006820","8.584","0.001","16.066","0.003","16.097","0.002","90","","92.93","0.01","90","","2217","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","methyl 3',6'-bis(chloromethyl)-2,2'-dimethoxy-1,1'-binaphthalene-3-carboxylate","","- C26 H22 Cl2 O4 -","- C26 H22 Cl2 O4 -","- C104 H88 Cl8 O16 -","4","1","FR1060","Pakhomova, Svetlana; Kratochvíl, Bohumil; Lellek, Vít; Stibor, Ivan","Methyl 3',6'-Bis(chloromethyl)-2,2'-dimethoxy-1,1'-binaphthalene-3-carboxylate","Acta Crystallographica Section C","1997","53","12","1871","1873","10.1107/S0108270197010172","","","1.54187","CuKα","","0.0718","0.0664","","0.2026","0.1892","","","","1.054","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006821","6.105","0.0006","6.252","0.0006","14.547","0.001","90","0.009","90","0.009","90","0.009","555.24","0.09","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C6 H7 N O -","- C6 H7 N O -","- C24 H28 N4 O4 -","4","1","FR1062","Suchod, Bernadette; Lajzerowicz, Janine; Collet, André","({-})-2-Azabicyclo[2.2.1]hept-5-en-3-one (Lactam)","Acta Crystallographica Section C","1997","53","12","1911","1912","10.1107/S0108270197011311","","","0.71073","MoKα","","0.057","0.057","","0.028","0.028","","","","3.274","3.274","3.274","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006822","8.584","0.002","8.893","0.002","13.851","0.003","106.94","0.02","101.9","0.02","96.5","0.02","972.6","0.4","296","","296","","","","","","","","","4","P -1","-P 1","2","1,4,5,8-naphthalenetetracarboxylic acid cyclic 1,8-anhydride . 2 dimethyl sulfoxide","","","- C18 H18 O9 S2 -","- C18 H18 O9 S2 -","- C36 H36 O18 S4 -","2","1","FR1073","Blackburn, Anthony C.; Fitzgerald, Lawrence J.; Gerkin, Roger E.","1,4,5,8-Naphthalenetetracarboxylic Acid Cyclic 1,8-Anhydride Bis(dimethyl sulfoxide) Solvate and 1,4,5,8-Naphthalenetetracarboxylic 1,8:4,5-Dianhydride","Acta Crystallographica Section C","1997","53","12","1991","1995","10.1107/S0108270197011712","","","0.7093","MoKα","","","0.052","","","","0.04","","","","","","2.09","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006823","7.88","0.002","5.322","0.001","12.6012","0.0009","90","","107.257","0.009","90","","504.67","0.17","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,4,5,8-naphthalenetetracarboxylic-1,8:4,5-dianhydride","","","- C14 H4 O6 -","- C14 H4 O6 -","- C28 H8 O12 -","2","0.5","FR1073","Blackburn, Anthony C.; Fitzgerald, Lawrence J.; Gerkin, Roger E.","1,4,5,8-Naphthalenetetracarboxylic Acid Cyclic 1,8-Anhydride Bis(dimethyl sulfoxide) Solvate and 1,4,5,8-Naphthalenetetracarboxylic 1,8:4,5-Dianhydride","Acta Crystallographica Section C","1997","53","12","1991","1995","10.1107/S0108270197011712","","","0.71073","MoKα","","","0.051","","","","0.053","","","","","","1.79","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006824","8.48","0.001","9.336","0.001","11.187","0.001","90","","98.351","0.002","90","","876.28","0.16","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","(±)-cis-2-phenylcyclopropanecarboxylic acid","(±)-cis-2-phenylcyclopropanecarboxylic acid","","- C10 H10 O2 -","- C10 H10 O2 -","- C40 H40 O8 -","4","1","FR1081","Gerkin, Roger E.","Hydrogen Bonding and Ring Asymmetry in (±)-<i>cis</i>-2-Phenylcyclopropanecarboxylic Acid","Acta Crystallographica Section C","1997","53","12","1989","1991","10.1107/S0108270197011104","","","0.71073","MoKα","","","0.06","","","","0.08","","","","","","1.39","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006825","18.012","0.002","18.039","0.002","7.579","0.001","90","","90","","90","","2462.6","0.5","296","","296","","","","","","","","","3","P b c a","-P 2ac 2ab","61","1,4-dimethoxynaphthalene-2,5-dicarboxylic acid","1,4-dimethoxynaphthalene-2,5-dicarboxylic acid","","- C14 H12 O6 -","- C14 H12 O6 -","- C112 H96 O48 -","8","1","FR1083","Gerkin, Roger E.","5,8-Dimethoxynaphthalene-1,6-dicarboxylic Acid","Acta Crystallographica Section C","1997","53","12","1987","1989","10.1107/S0108270197011475","","","0.71073","MoKα","","","0.065","","","","0.059","","","","","","1.58","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006826","18.9237","0.0002","18.9167","0.0002","8.7226","0.0001","90","","90","","90","","3122.46","0.06","143","","143","","","","","","","","","3","P c c n","-P 2ab 2ac","56","","[Bis-(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)]-methane","","- C17 H24 O4 -","- C17 H24 O4 -","- C136 H192 O32 -","8","1","HA1194","Bolte, Michael; Scholtyssik, Maria","A Tetragonal-Looking But Twinned Orthorhombic Structure","Acta Crystallographica Section C","1997","53","12","1869","1871","10.1107/S0108270197009438","","","0.71073","MoKα","","0.034","0.033","","0.092","0.091","","","","1.062","1.072","1.072","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006827","6.025","0.001","10.519","0.001","9.584","0.001","90","","105.91","0.01","90","","584.14","0.13","102","","102","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Bis-(trimethylsilyl)acetylene","","- C8 H18 Si2 -","- C8 H18 Si2 -","- C16 H36 Si4 -","2","0.5","JZ1194","Joachim Bruckmann; Carl Krüger","Bis(trimethylsilyl)acetylene","Acta Crystallographica Section C","1997","53","12","1845","1846","10.1107/S0108270197005684","","","0.71069","MoKα","","0.0484","0.0454","","0.1277","0.1244","","","","1.098","1.117","1.117","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006828","8.7652","0.001","7.8844","0.001","9.64","0.002","90","","91.468","0.01","90","","665.99","0.18","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- B5 Cd La O10 -","- B5 Cd La O10 -","- B20 Cd4 La4 O40 -","4","1","JZ1197","Wiesch, Andre; Bluhm, Karsten","The First Cadmium Rare Earth Borates CdLn[B~5~O~10~] with Ln = La, Sm, Eu","Acta Crystallographica Section C","1997","53","12","1730","1733","10.1107/S0108270197008202","","","0.71069","MoKα","","0.0382","0.0245","","0.061","0.0585","","","","1.045","1.101","1.101","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006829","8.588","0.003","7.8819","0.0014","9.583","0.002","90","","92.34","0.02","90","","648.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- B5 Cd O10 Sm -","- B5 Cd O10 Sm -","- B20 Cd4 O40 Sm4 -","4","1","JZ1197","Wiesch, Andre; Bluhm, Karsten","The First Cadmium Rare Earth Borates CdLn[B~5~O~10~] with Ln = La, Sm, Eu","Acta Crystallographica Section C","1997","53","12","1730","1733","10.1107/S0108270197008202","","","0.71069","MoKα","","0.0466","0.0293","","0.0901","0.0869","","","","1.148","1.243","1.243","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006830","8.5477","0.0012","7.881","0.002","9.58","0.002","90","","92.53","0.02","90","","644.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- B5 Cd Eu O10 -","- B5 Cd Eu O10 -","- B20 Cd4 Eu4 O40 -","4","1","JZ1197","Wiesch, Andre; Bluhm, Karsten","The First Cadmium Rare Earth Borates CdLn[B~5~O~10~] with Ln = La, Sm, Eu","Acta Crystallographica Section C","1997","53","12","1730","1733","10.1107/S0108270197008202","","","0.71069","MoKα","","0.0614","0.0393","","0.0949","0.0893","","","","0.989","1.063","1.063","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006831","8.9206","0.0019","10.484","0.002","10.8614","0.0017","93.046","0.014","93.663","0.015","99.182","0.016","998.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(3,5-dimethylpyrazole)(N-salicylideneglycinato)copper(II)","","- C19 H23 Cu N5 O3 -","- C19 H23 Cu N5 O3 -","- C38 H46 Cu2 N10 O6 -","2","1","JZ1209","Warda, Salam A.","Bis(3,5-dimethylpyrazole-<i>N</i>^2^)(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1997","53","12","1759","1761","10.1107/S0108270197009104","","","1.54178","CuKα","","0.0446","0.0442","","","","0.128","","","","","","1.083","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006832","15.564","0.003","12.441","0.002","7.8","0.002","90","","99.49","0.03","90","","1489.7","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- I7 Nb3 S -","- I7 Nb3 S -","- I28 Nb12 S4 -","4","1","JZ1212","Schmidt, Peter Josef; Thiele, Gerhard","A New Structural Variation of Nb~3~<i>YX</i>~7~ Compounds: Monoclinic Nb~3~SI~7~","Acta Crystallographica Section C","1997","53","12","1743","1745","10.1107/S0108270197008196","","","0.71069","MoKα","","0.0439","0.0305","","0.0923","0.0769","","","","1.082","1.086","1.086","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006833","9.634","0.004","8.586","0.002","5.304","0.002","90","","109.69","0.03","90","","413.1","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","vanadium lithium metasilicate","","- Li O6 Si2 V -","- Li O6 Si2 V -","- Li4 O24 Si8 V4 -","4","0.5","JZ1217","Satto, Christine; Millet, Patrice; Galy, Jean","Lithium Vanadium Metasilicate, LiVSi~2~O~6~","Acta Crystallographica Section C","1997","53","12","1727","1728","10.1107/S0108270197008585","","","0.71069","MoKα","","","0.0189","","","0.0162","","","","","1.0784","1.0784","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006834","13.307","0.002","24.15","0.003","14.74","0.002","90","","90","","90","","4736.9","1.1","294","1","294","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Hexamethylenetetramine‒1,1,1-tris(4-hydroxyphenyl)ethane (1/1).","","- C26 H30 N4 O3 -","- C26 H30 N4 O3 -","- C208 H240 N32 O24 -","8","1","JZ1225","Coupar, Pamela I.; Ferguson, George; Glidewell, Christopher; Meehan, Paul R.","Pairwise-Interwoven <i>R</i>^6^~6~(48) Hexagonal Nets in the Hydrogen-Bonded Structure of Hexamethylenetetramine‒1,1,1-Tris(4-hydroxyphenyl)ethane (1/1)","Acta Crystallographica Section C","1997","53","12","1978","1980","10.1107/S010827019701086X","","","0.7107","MolybdenumKα","","0.1996","0.0601","","0.1292","0.1025","","","","0.819","1.227","1.227","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006835","5.7094","0.0004","6.8207","0.0004","9.3291","0.0006","90","","90","","90","","363.29","0.04","293","2","293","2","","","","","","","","3","P m n 21","P 2ac -2","31","Europium nitridosilicate","Dieuropium-pentasiliconoctanitride","","- Eu2 N8 Si5 -","- Eu2 N8 Si5 -","- Eu4 N16 Si10 -","2","0.5","JZ1226","Huppertz, Hubert; Schnick, Wolfgang","Eu~2~Si~5~N~8~ and EuYbSi~4~N~7~. The First Nitridosilicates with a Divalent Rare Earth Metal","Acta Crystallographica Section C","1997","53","12","1751","1753","10.1107/S0108270197008767","","","0.71073","MoKα","","0.0278","0.0237","","0.0471","0.0458","","","","1.122","1.133","1.133","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006836","5.9822","0.0003","5.9822","0.0003","9.7455","0.0004","90","","90","","120","","302.03","0.02","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","Europium ytterbium nitridosilicate","Europium-ytterbium-tetrasiliconheptanitride","","- Eu N7 Si4 Yb -","- Eu N7 Si4 Yb -","- Eu2 N14 Si8 Yb2 -","2","0.166667","JZ1226","Huppertz, Hubert; Schnick, Wolfgang","Eu~2~Si~5~N~8~ and EuYbSi~4~N~7~. The First Nitridosilicates with a Divalent Rare Earth Metal","Acta Crystallographica Section C","1997","53","12","1751","1753","10.1107/S0108270197008767","","","0.71073","MoKα","","0.0261","0.0212","","0.0491","0.0478","","","","1.068","1.091","1.091","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006837","10.6688","0.0001","10.7353","0.0001","18.8291","0.0002","83.323","0.001","83.735","0.001","76.03","0.001","2071.21","0.04","143","","143","","","","","","","","","4","P -1","-P 1","2","","octaphenylcyclotetrasiloxane","","- C48 H40 O4 Si4 -","- C48 H40 O4 Si4 -","- C96 H80 O8 Si8 -","2","1","JZ1227","Hensen, Karl; Gebhardt, Frank; Kettner, Markus; Pickel, Peter; Bolte, Michael","Two Cyclotetrasiloxanes at 143K","Acta Crystallographica Section C","1997","53","12","1867","1869","10.1107/S0108270197010068","","","0.71073","MoKα","","0.0375","0.0301","","0.0825","0.0784","","","","1.031","1.056","1.056","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006838","6.3603","0.0001","17.8106","0.0003","9.3363","0.0001","90","","99.036","0.001","90","","1044.5","0.03","143","","143","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3,5,7-Tetra(cyclotetramethylen)cyclotetrasiloxane","","- C16 H32 O4 Si4 -","- C16 H32 O4 Si4 -","- C32 H64 O8 Si8 -","2","0.5","JZ1227","Hensen, Karl; Gebhardt, Frank; Kettner, Markus; Pickel, Peter; Bolte, Michael","Two Cyclotetrasiloxanes at 143K","Acta Crystallographica Section C","1997","53","12","1867","1869","10.1107/S0108270197010068","","","0.71073","MoKα","","0.0891","0.0546","","","","0.1227","","","","","","1.048","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006839","22.995","0.006","8.0989","0.0008","19.225","0.004","90","","117.76","0.02","90","","3168.3","1.2","294","1","294","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(4-methoxyphenylsulfonyl)methane","","- C15 H16 O6 S2 -","- C15 H16 O6 S2 -","- C120 H128 O48 S16 -","8","1","JZ1232","Meehan, Paul R.; Gregson, Richard M.; Glidewell, Christopher; Ferguson, George","Bis(4-methoxyphenylsulfonyl)methane: a Three-Dimensional Network Generated by Short C—H···O Hydrogen Bonds","Acta Crystallographica Section C","1997","53","12","1975","1978","10.1107/S0108270197011566","","","0.7107","MolybdenumKα","","0.0863","0.0401","","0.1038","","0.0942","","","1.002","","","1.17","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006840","8.455","0.003","7.798","0.003","21.508","0.005","90","","91.37","0.02","90","","1417.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-phenyl-5,6,8-trichloro-3,4-dihydroquinoline-2(1H)one","","- C15 H10 Cl3 N O -","- C15 H10 Cl3 N O -","- C60 H40 Cl12 N4 O4 -","4","1","KA1227","Thirumurugan, R.; Shanmuga Sundara Raj, S.; Murugan, P.; Ramakrishnan, V. T.; Chacko, K. K.","5,6,8-Trichloro-4-phenyl-3,4-dihydroquinolin-2(1<i>H</i>)-one","Acta Crystallographica Section C","1997","53","12","1862","1864","10.1107/S0108270197008810","","","1.54178","CuKα","","0.0842","0.0729","","0.2203","0.1926","","","","1.08","1.017","1.017","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006841","16.803","0.004","7.502","0.002","14.647","0.005","90","","115.39","0.03","90","","1668","0.9","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1,1-Trifluoro-3-phenylbutyl-2-p-nitrobenzoate","","- C17 H14 F3 N O4 -","- C17 H14 F3 N O4 -","- C68 H56 F12 N4 O16 -","4","1","KA1232","Faure, René; Félix, Caroline; Laurent, André; Mison, Pierre","1,1,1-Trifluoro-3-phenyl-2-butyl <i>p</i>-Nitrobenzoate","Acta Crystallographica Section C","1997","53","12","1935","1937","10.1107/S0108270197008822","","","1.5418","CuKα","","","0.057","","","0.067","","","","","1.46","1.46","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006842","20.431","0.004","6.192","0.001","5.136","0.001","90","0.01","95.79","0.02","90","0.01","646.4","0.2","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","L-Proline Monohydrate","","","- C5 H11 N O3 -","- C5 H11 N O3 -","- C20 H44 N4 O12 -","4","1","KA1239","Janczak, Jan; Luger, Peter","<small>L</small>-Proline Monohydrate at 100 K","Acta Crystallographica Section C","1997","53","12","1954","1956","10.1107/S0108270197011487","","","1.54179","CuKα","","0.033","0.033","","0.084","0.084","","","","1.207","1.207","1.207","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006843","7.656","0.001","7.801","0.001","8.547","0.001","111.95","0.01","99.76","0.01","90.09","0.01","465.43","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Endo,endo-2,5-dibromo-9-oxabicyclo[4.2.1]nonane","","- C8 H12 Br2 O -","- C8 H12 Br2 O -","- C16 H24 Br4 O2 -","2","1","LN1000","Hegemann, Klaus; Haufe, Günter; Fröhlich, Roland; Zippel, Frank","Three 2,5-Disubstituted 9-Oxabicyclo[4.2.1]nonanes. Transannular O-Heterocyclization Products of Cycloocta-1,5-diene","Acta Crystallographica Section C","1997","53","12","1889","1892","10.1107/S0108270197011748","","","0.71073","MoKα","","0.0833","0.0387","","0.1077","0.0963","","","","1.006","1.108","1.108","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006844","12.433","0.002","25.248","0.004","5.59","0.001","90","","90","","90","","1754.7","0.5","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Endo,endo-2,5-bis(phenylsulfenyl)-9-oxabicyclo[4.2.1]nonane","","- C20 H22 O S2 -","- C20 H22 O S2 -","- C80 H88 O4 S8 -","4","0.5","LN1000","Hegemann, Klaus; Haufe, Günter; Fröhlich, Roland; Zippel, Frank","Three 2,5-Disubstituted 9-Oxabicyclo[4.2.1]nonanes. Transannular O-Heterocyclization Products of Cycloocta-1,5-diene","Acta Crystallographica Section C","1997","53","12","1889","1892","10.1107/S0108270197011748","","","0.71073","MoKα","","0.1037","0.0566","","0.1843","0.165","","","","1.059","1.217","1.217","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006845","6.143","0.001","6.521","0.001","9.194","0.001","90","","106.73","0.01","90","","352.71","0.09","223","2","223","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9,10-Dioxatricyclo[4.2.1.1^2,5^]decane","","- C8 H12 O2 -","- C8 H12 O2 -","- C16 H24 O4 -","2","0.5","LN1000","Hegemann, Klaus; Haufe, Günter; Fröhlich, Roland; Zippel, Frank","Three 2,5-Disubstituted 9-Oxabicyclo[4.2.1]nonanes. Transannular O-Heterocyclization Products of Cycloocta-1,5-diene","Acta Crystallographica Section C","1997","53","12","1889","1892","10.1107/S0108270197011748","","","1.54178","CuKα","","0.0636","0.0629","","0.1836","0.1833","","","","1.077","1.09","1.09","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006846","14.208","0.004","16.484","0.006","6.663","0.002","90","","90","","90","","1560.5","0.9","294","","294","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H24 Cl2 O -","- C16 H24 Cl2 O -","- C64 H96 Cl8 O4 -","4","1","LN1007","Lassaba, E.; Benharref, A.; Giorgi, M.; Pierrot, M.","Cyclopropanation of a β-Himachalene Monoepoxide Derivative","Acta Crystallographica Section C","1997","53","12","1943","1945","10.1107/S0108270197009888","","","0.71073","MoKα","","0.043","0.036","","","0.048","","","","","1.84","1.84","","","","","has coordinates,has Fobs","208466","2020-10-21","18:00:00",""
"2006847","9.518","0.002","14.003","0.002","14.977","0.003","90","","90","","90","","1996.1","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3aR, 7aS)-N-Triphenylmethyl-3a,6,7,7a-tetrahydropyrano-[2,3-d]pyrrolid-2-one","","- C26 H25 N O2 -","- C26 H25 N O2 -","- C104 H100 N4 O8 -","4","1","LN1010","Vassilios Nastopoulos; Ourania Gourgioti; George Balayiannis; George Karigiannis; Dionissios Papaioannou; Constantin Kavounis","(3a<i>R</i>,7a<i>S</i>)-<i>N</i>-Triphenylmethyl-1,2,3,3a,5,6,7,7a-octahydropyrano[3,2-<i>b</i>]pyrrol-2-one","Acta Crystallographica Section C","1997","53","12","1971","1973","10.1107/S010827019701158X","","","0.71069","MoKα","","0.0418","0.0406","","0.1067","","0.1053","","","1.095","","","1.105","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006848","13.237","0.003","8.309","0.002","13.954","0.004","90","","104.17","0.03","90","","1488.1","0.7","143","2","143","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Ethylammonium Di(benzenesulfonyl)amide: 1,4,7,10,13,16-Hexaoxacyclooctadecane (1:1)","","- C26 H42 N2 O10 S2 -","- C26 H42 N2 O10 S2 -","- C52 H84 N4 O20 S4 -","2","1","LN1011","Henschel, Dagmar; Blaschette, Armand; Jones, Peter G.","Polysulfonylamines. XCI. Ethylammonium Di(benzenesulfonyl)amide 1,4,7,10,13,16-Hexaoxacyclooctadecane (1/1/1)","Acta Crystallographica Section C","1997","53","12","1875","1877","10.1107/S010827019701007X","","","0.71073","MoKα","","0.0341","0.0311","","0.0796","0.0756","","","","1.042","1.034","1.034","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006849","10.349","0.004","13.981","0.006","10.247","0.004","90","","102.46","0.06","90","","1447.7","1.1","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,3-Bis[bis(dimethylamino)]-N-methyldiborylamine","","- C9 H27 B2 N5 -","- C8.5 H27 B2 N4.5 -","- C34 H108 B8 N18 -","4","0.5","LN1012","Meller, Anton; Hoppe, Holger; Albers, Thomas","1,3-Bis[bis(dimethylamino)]-<i>N</i>-methyldiborylamine","Acta Crystallographica Section C","1997","53","12","1951","1952","10.1107/S0108270197010822","","","0.71073","MoKα","","0.064","0.056","","0.162","0.149","","","","1.068","1.066","1.066","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006850","9.031","0.001","14.262","0.002","20.58","0.002","90","","90","","90","","2650.7","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-3-(γ-methyl-N^α^-triphenylmethylglutamyl)benzotriazole 1-Oxide","","- C31 H28 N4 O4 -","- C31 H28 N4 O4 -","- C124 H112 N16 O16 -","4","1","LN1017","Mamos, Petros; Papaioannou, Dionissios; Kavounis, Constantin; Nastopoulos, Vassilios","(<i>S</i>)-3-(<i>O</i>^{γ^}-Methyl-<i>N</i>^{α^}-triphenylmethylglutamyl)benzotriazole 1-Oxide","Acta Crystallographica Section C","1997","53","12","1973","1975","10.1107/S0108270197011591","","","0.71069","MoKα","","0.048","0.046","","0.123","","0.12","","","1.069","","","1.079","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006851","14.963","0.004","9.78","0.003","15.734","0.005","90","","115.76","0.02","90","","2073.7","1.1","143","2","143","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(1,2-Benzenedisulfonylimido-N,O)(1,4,7,10,13-pentaoxacyclododecane)sodium","","- C16 H24 N Na O9 S2 -","- C16 H24 N Na O9 S2 -","- C64 H96 N4 Na4 O36 S8 -","4","1","LN1019","Jones, Peter G.; Moers, Oliver; Blaschette, Armand","Polysulfonylamines. XCV. (1,2-Benzenedisulfonylimido-<i>N</i>,<i>O</i>)(1,4,7,10,13-pentaoxacyclopentadecane-κ^5^<i>O</i>)sodium","Acta Crystallographica Section C","1997","53","12","1811","1813","10.1107/S0108270197011062","","","0.71073","MoKα","","0.0686","0.0467","","0.1173","0.1022","","","","1.03","1.038","1.038","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006852","5.8656","0.0002","14.0699","0.0002","17.8671","0.0002","90","","92.335","0.004","90","","1473.32","0.06","295","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 Cl3 N O -","- C15 H10 Cl3 N O -","- C60 H40 Cl12 N4 O4 -","4","1","MU1315","Ülkü, Dinçer; Ercan, Filiz; Güner, Vildan","3,3-Dichloro-4-(4-chlorophenyl)-1-phenylazetidin-2-one","Acta Crystallographica Section C","1997","53","12","1945","1947","10.1107/S0108270197009748","","","0.71073","MoKα","","","0.055","","","0.064","","","","","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006853","19.289","0.004","6.058","0.001","16.792","0.003","90","","98.23","0.01","90","","1942","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H21 N -","- C27 H21 N -","- C108 H84 N4 -","4","1","MU1329","Jayanta Kumar Ray; Bidhan Chandra Roy; A.Chakraborty; Kandasamy Chinnakali; Hoong-Kun Fun","6-<i>n</i>-Butylacenaphtho[1,2-<i>b</i>]benzo[<i>h</i>]quinoline","Acta Crystallographica Section C","1997","53","12","1864","1865","10.1107/S0108270197009359","","","0.71073","MoKα","","0.0769","0.042","","0.1379","0.117","","","","0.891","1.012","1.012","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006854","10.381","0.001","12.556","0.001","6.883","0.001","90","","102.07","0.01","90","","877.32","0.17","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-dimethoxy-4-nitrobenzene.","","- C8 H9 N O4 -","- C8 H9 N O4 -","- C32 H36 N4 O16 -","4","1","MU1333","Hoong-Kun Fun; Kandasamy Chinnakali; Kandasamy Sivakumar; Teng-Wah Sam; Siew-Eng How","Substituted Methoxybenzene Derivatives: C~8~H~9~NO~4~, C~9~H~11~NO~5~ and C~13~H~18~O~4~","Acta Crystallographica Section C","1997","53","12","1859","1862","10.1107/S010827019700975X","","","0.71073","MoKα","","0.0842","0.0454","","0.1404","0.1219","","","","0.957","1.123","1.123","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006855","7.025","0.001","13.89","0.002","10.356","0.001","90","","99.03","0.01","90","","998","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,4,5-Trimethoxy-1-nitrobenzene","","- C9 H11 N O5 -","- C9 H11 N O5 -","- C36 H44 N4 O20 -","4","1","MU1333","Hoong-Kun Fun; Kandasamy Chinnakali; Kandasamy Sivakumar; Teng-Wah Sam; Siew-Eng How","Substituted Methoxybenzene Derivatives: C~8~H~9~NO~4~, C~9~H~11~NO~5~ and C~13~H~18~O~4~","Acta Crystallographica Section C","1997","53","12","1859","1862","10.1107/S010827019700975X","","","0.71073","MoKα","","0.0568","0.0408","","0.1324","0.1236","","","","1.013","1.147","1.147","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006856","12.1275","0.0012","7.5965","0.0007","13.989","0.0014","90","","96.006","0.009","90","","1281.7","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-(2,4,5-trimethoxyphenyl)-1-butanone.","","- C13 H18 O4 -","- C13 H18 O4 -","- C52 H72 O16 -","4","1","MU1333","Hoong-Kun Fun; Kandasamy Chinnakali; Kandasamy Sivakumar; Teng-Wah Sam; Siew-Eng How","Substituted Methoxybenzene Derivatives: C~8~H~9~NO~4~, C~9~H~11~NO~5~ and C~13~H~18~O~4~","Acta Crystallographica Section C","1997","53","12","1859","1862","10.1107/S010827019700975X","","","0.71073","MoKα","","0.072","0.0419","","0.132","0.1174","","","","0.965","1.136","1.136","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006857","10.399","0.001","5.806","0.001","28.126","0.002","90","","93.02","0.01","90","","1695.8","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Bis(3,4-dimethoxybenzyl)ether","","- C18 H22 O5 -","- C18 H22 O5 -","- C72 H88 O20 -","4","1","MU1334","Hoong-Kun Fun; Kandasamy Chinnakali; Kandasamy Sivakumar; Teng-Wah Sam; Siew-Eng How","Bis(3,4-dimethoxybenzyl) Ether and Tetramethoxy-4,4'-(2,3-dimethyltetramethylene)dipyrocatechol","Acta Crystallographica Section C","1997","53","12","1857","1859","10.1107/S0108270197009761","","","0.71073","MoKα","","0.0842","0.0398","","0.1104","0.096","","","","0.865","1.044","1.044","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006858","6.274","0.001","10.571","0.001","15.426","0.001","86.49","0.01","80.78","0.01","87.72","0.01","1007.5","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Tetramethoxy-4,4'-(2,3-dimethyltetramethylene)dipyrocatechol","","- C22 H30 O4 -","- C22 H30 O4 -","- C44 H60 O8 -","2","1","MU1334","Hoong-Kun Fun; Kandasamy Chinnakali; Kandasamy Sivakumar; Teng-Wah Sam; Siew-Eng How","Bis(3,4-dimethoxybenzyl) Ether and Tetramethoxy-4,4'-(2,3-dimethyltetramethylene)dipyrocatechol","Acta Crystallographica Section C","1997","53","12","1857","1859","10.1107/S0108270197009761","","","0.71073","MoKα","","0.0698","0.0432","","0.1263","0.1158","","","","0.949","1.117","1.117","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006859","5.191","0.004","11.627","0.006","12.998","0.007","75.8","0.04","79.33","0.06","88.49","0.06","747.2","0.8","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H15 N O8 -","- C14 H15 N O8 -","- C28 H30 N2 O16 -","2","1","MU1340","Blake, Alexander J.; McNab, Hamish; Parsons, Simon; Withell, Kirsti","An Extended Imide Containing Two Methylene Meldrum's Acid Units","Acta Crystallographica Section C","1997","53","12","1956","1958","10.1107/S0108270197009773","","","0.71073","MoKα","","0.2159","0.0645","","0.1127","0.0753","","","","0.98","1.205","1.205","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006860","14.5643","0.0011","7.1338","0.0011","21.231","0.002","90","","105.021","0.008","90","","2130.5","0.4","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichloro-tetrakis{(2-pyridyl)pyrazine}copper(II) complex, C~24~H~16~N~6~Cl~2~Cu","","- C24 H16 Cl2 Cu N6 -","- C24 H16 Cl2 Cu N6 -","- C96 H64 Cl8 Cu4 N24 -","4","1","MU1342","Kožíšek, Jozef; Jaromír Marek; Zuzana Baloghová; Dušan Valigura","Dichloro[2,3,5,6-tetra(2-pyridyl)pyrazine]copper(II), [CuCl~2~(C~24~H~16~N~6~)]","Acta Crystallographica Section C","1997","53","12","1813","1815","10.1107/S0108270197011396","","","0.71073","MoKα","","0.041","0.033","","0.093","0.09","","","","1.084","1.132","1.132","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006861","13.48","0.002","11.459","0.003","15.89","0.003","90","","90.37","0.02","90","","2454.4","0.9","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","N-(2'-S-hydroxypropyl)-N,N'-bis(3,5-dichlorobenzoyl)-1R,2R-diami- nocyclohexane","","- C23 H24 Cl4 N2 O3 -","- C23 H24 Cl4 N2 O3 -","- C92 H96 Cl16 N8 O12 -","4","2","NA1272","Cirilli, Roberto; Gaparrini, Francesco; Villani, Claudio; Gavuzzo, Enrico; Cirilli, Maurizio","The Chiral Selector <i>N</i>-(2'-<i>S</i>-Hydroxypropyl)-<i>N</i>,<i>N</i>'-bis(3,5-dichlorobenzoyl)-1<i>R</i>,2<i>R</i>-diaminocyclohexane","Acta Crystallographica Section C","1997","53","12","1937","1939","10.1107/S0108270197008068","","","1.5458","CuKα","","0.1415","0.088","","0.3335","0.2162","","","","1.15","1.066","1.066","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006862","11.0244","0.001","7.5621","0.001","19.9172","0.001","90","","91.407","0.004","90","","1659.9","0.3","295","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 O6 -","- C20 H16 O6 -","- C80 H64 O24 -","4","1","NA1299","Özbey, Süheyla; Kendi, Engin; Göker, Hakan; Ertan, Rahmiye","2-(2-Ethoxycarbonyl-1,4-benzodioxan-7-yl)-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section C","1997","53","12","1981","1983","10.1107/S0108270197009864","","","0.71073","MoKα","","","0.053","","","0.05","","","","","0.8","0.8","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006863","6.0144","0.0006","13.8744","0.0008","27.517","0.002","90","","90","","90","","2296.2","0.3","293","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(-) Diphenyl (R)-1-[(S)-isoleucyl]pyrrolidine-2-phosphonate hydrochloride","","- C22 H30 Cl N2 O4 P -","- C22 H30 Cl N2 O4 P -","- C88 H120 Cl4 N8 O16 P4 -","4","1","NA1308","Norbert M. Blaton; Oswald M. Peeters; Camiel J. De Ranter","Diphenyl ({-})-(<i>R</i>)-1-[(<i>S</i>)-Isoleucyl]pyrrolidine-2-phosphonate Hydrochloride","Acta Crystallographica Section C","1997","53","12","1952","1954","10.1107/S0108270197008524","","","1.54184","CuKα","","0.0353","0.0325","","0.084","","0.084","","","1.069","","","1.069","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006864","14.02","0.002","14.02","0.002","33.005","0.005","90","","90","","120","","5618.3","1.4","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","tris[1-(2-phenyl-2-oxoethyl)pyridone-2] hydroxonium tetrafluoroborate complex","","- C39 H36 B F4 N3 O7 -","- C39 H36 B F4 N3 O7 -","- C234 H216 B6 F24 N18 O42 -","6","0.333333","NA1311","Zhukov, S. G.; Rybakov, V. B.; Babaev, E. V.; Paseshnichenko, K. A.; Schenk, H.","Tris(1-phenacyl-2-pyridone) Hydroxonium Tetrafluoroborate, a Hydrogen-Bonded Complex","Acta Crystallographica Section C","1997","53","12","1909","1911","10.1107/S010827019701024X","","","0.70926","MoKα","","0.126","0.053","","0.13","0.102","","","","1.027","1.199","1.199","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006865","7.287","0.003","13.779","0.004","7.415","0.005","90","","99.55","0.1","90","","734.2","0.7","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(2-aminopyrimidine) tetrabromo-copper(ii)","","- C8 H12 Br4 Cu N6 -","- C8 H12 Br4 Cu N6 -","- C16 H24 Br8 Cu2 N12 -","2","0.5","NA1316","Raúl Corzo-Suárez; Santiago García-Granda; Isabel Díaz; Vicente Fernández-Herrero; Jose Luis Martínez","Redetermination of Bis(2-aminopyrimidinium) Tetrabromocopper(II) at 200 and 100K","Acta Crystallographica Section C","1997","53","12","1786","1789","10.1107/S0108270197009876","","","0.71073","MoKα","","0.1806","0.0497","","","","0.1544","","","","","","0.995","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006866","7.259","0.002","13.757","0.004","7.377","0.003","90","","99.87","0.03","90","","725.8","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(2-aminopyrimidine) tetrabromo-copper(ii)","","- C8 H12 Br4 Cu N6 -","- C8 H12 Br4 Cu N6 -","- C16 H24 Br8 Cu2 N12 -","2","0.5","NA1316","Raúl Corzo-Suárez; Santiago García-Granda; Isabel Díaz; Vicente Fernández-Herrero; Jose Luis Martínez","Redetermination of Bis(2-aminopyrimidinium) Tetrabromocopper(II) at 200 and 100K","Acta Crystallographica Section C","1997","53","12","1786","1789","10.1107/S0108270197009876","","","0.71073","MoKα","","0.13","0.0424","","","","0.1128","","","","","","1.004","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006867","9.075","0.001","11.282","0.002","9.191","0.001","90","","108.37","","90","","893.1","0.2","295","","","","","","","","","","","7","P 1 21 1","P 2yb","4","","(2‒aminoethanesulfonato‒N,O)bis(ethylenediamine)‒Cobalt(III) perchlorate","","- C6 H22 Cl2 Co N5 O11 S -","- C6 H22 Cl2 Co N5 O11 S -","- C12 H44 Cl4 Co2 N10 O22 S2 -","2","1","OA1028","Murata, Mayumi; Masaaki Kojima; Masakazu Kita; Setsuo Kashino; Yuzo Yoshikawa","A Stable Sulfonato‒Cobalt(III) Complex: Δ-[Co{OS(O)~2~CH~2~CH~2~NH~2~-<i>N</i>,<i>O</i>}(en)~2~](ClO~4~)~2~","Acta Crystallographica Section C","1997","53","12","1761","1762","10.1107/S0108270197010032","","","0.71073","MoKα","","","0.029","","","0.028","","","","","1.51","1.51","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006868","11.8479","0.0001","9.4494","0.0002","17.8596","0.0003","90","","108.384","0.001","90","","1897.44","0.05","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 N O6 P -","- C18 H20 N O6 P -","- C72 H80 N4 O24 P4 -","4","1","PT1044","Boehlow, Todd; De la Cruz, Antonette; Rath, Nigam P.; Spilling, Christopher D.","Dimethyl (±)-(1<i>S</i>*,2<i>R</i>*,3<i>S</i>*)-[3-phenyl-1-(<i>N</i>-phenylcarbamoyloxy)-2,3-epoxypropyl]phosphonate","Acta Crystallographica Section C","1997","53","12","1947","1949","10.1107/S0108270197010408","","","0.71073","MoKα","","0.084","0.0554","","0.1286","0.1121","","","","1.147","1.206","1.206","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006869","6.041","0.0001","9.9354","0.0001","18.3966","0.0003","90","","91.197","0.001","90","","1103.92","0.03","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Benzoyl-2,4-diphenyl-5-hydroxy-5-propionyl-3-imidazoline","","- C25 H22 N2 O4 -","- C25 H22 N2 O4 -","- C50 H44 N4 O8 -","2","1","QA0016","Bolte, Michael","1-Benzoyl-5-hydroxy-2,4-diphenyl-5-propionyloxy-3-imidazoline","Acta Crystallographica Section C","1997","53","12","IUC9700027","","10.1107/S0108270197099290","","","0.71073","MoKα","","0.0542","0.0442","","0.1092","0.1039","","","","1.115","1.148","1.148","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006870","5.9054","0.0008","9.2686","0.0007","15.946","0.002","90","","97.138","0.006","90","","866.04","0.17","143","","143","","","","","","","","","4","P 1 21 1","P 2yb","4","","(+)-(2S,3S,4S,5S)-(N-t-Butyloxycarbonyl)-2-benzyl-4,5-dimethyl- 3-hydroxy-pyrrolidine","","- C18 H27 N O3 -","- C18 H27 N O3 -","- C36 H54 N2 O6 -","2","1","QA0017","Bolte, Michael","(+)-(2<i>S</i>,3<i>S</i>,4<i>S</i>,5<i>S</i>)-2-Benzyl-<i>N</i>-(<i>tert</i>-butyloxycarbonyl)-3-hydroxy-4,5-dimethylpyrrolidine at 143K","Acta Crystallographica Section C","1997","53","12","IUC9700028","","10.1107/S0108270197099289","","","0.71073","MoKα","","0.0369","0.0362","","0.0975","0.097","","","","1.052","1.06","1.06","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006871","11.1376","0.0004","11.3443","0.0004","13.2368","0.0004","90","","109.884","0.001","90","","1572.74","0.09","140","","140","","","","","","","","","5","P 1 21 1","P 2yb","4","","S~S~-N(1S),2S,3R,4R,5R-N-[(1-Hydroxymethyl)-2-(methylpropyl)]-3- hydroxy-4-methyl-5-(4-methylphenylsulfonimidoylmethyl)-1-(4- methylphenylsulfonyl)-2-(phenylmethyl)-pyrrolidine","","- C32 H42 N2 O5 S2 -","- C32 H42 N2 O5 S2 -","- C64 H84 N4 O10 S4 -","2","1","QA0019","Bolte, Michael","(2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>R</i>,S<i>S</i>)-2-Benzyl-3-hydroxy-5-{<i>N</i>-[(<i>S</i>)-1-hydroxy-3-methylbut-2-yl]-4-methylphenylsulfonimidoylmethyl}-4-methyl-1-(4-methylphenylsulfonyl)pyrrolidine at 140K","Acta Crystallographica Section C","1997","53","12","IUC9700029","","10.1107/S0108270197099277","","","0.71073","MoKα","","0.0652","0.0437","","0.095","0.0849","","","","1.055","1.051","1.051","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006872","18.088","0.004","11.17","0.002","12.895","0.002","90","","119.93","0.01","90","","2257.9","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-Bromomethyl-7,8-benzocoumarin","","- C14 H9 Br O2 -","- C14 H9 Br O2 -","- C112 H72 Br8 O16 -","8","1","QA0024","Kandasamy Chinnakali; Hoong-Kun Fun; Ibrahim Abdul Razak; Kamaraj Sriraghavan; Vaylakkavoor T. Ramakrishnan","4-Bromomethyl-7,8-benzocoumarin","Acta Crystallographica Section C","1997","53","12","IUC9700030","","10.1107/S0108270197099265","","","0.71073","MoKα","","0.0844","0.0456","","0.1284","0.1171","","","","0.904","1.089","1.089","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006873","8.387","0.001","10.78","0.001","7.206","0.001","103.4","0.01","109.24","0.01","79.12","0.01","593.88","0.13","298","","","","","","","","","","","3","P -1","-P 1","2","","Bis(2-methylbenzylcyanide) Tetracyanobenzene","","- C28 H20 N6 -","- C28 H20 N6 -","- C28 H20 N6 -","1","0.5","QA0026","Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu; Nakabayashi, Hironari","Bis(2-methylbenzyl cyanide) Tetracyanobenzene","Acta Crystallographica Section C","1997","53","12","IUC9700031","","10.1107/S0108270197099253","","","0.71073","MoKα","","","0.057","","","0.063","","","","","1.12","1.12","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006874","6.814","0.001","9.497","0.002","16.374","0.002","90","","90","","90","","1059.6","0.3","296.2","","296.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Sodium bis(malonato)cuprate(II) dihydrate","","- C6 H8 Cu Na2 O10 -","- C6 H8 Cu Na2 O10 -","- C24 H32 Cu4 Na8 O40 -","4","0.5","QB0022","Barnes, John C.; Weakley, Timothy J.R.","Disodium Bis(malonato)cuprate(II) Dihydrate","Acta Crystallographica Section C","1997","53","12","IUC9700026","","10.1107/S0108270197099307","","","0.71073","MoKα","","0.0747","0.0476","","","","0.1425","","","","","","1.148","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006875","10.799","0.0016","12.6741","0.0012","16.3797","0.0013","90","","91.303","0.01","90","","2241.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-(4-Nitrophenyl)-7-azabicyclo[4.1.0]heptane","","- C12 H14 N2 O2 -","- C12 H14 N2 O2 -","- C96 H112 N16 O16 -","8","2","QB0027","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vaylakkavoor T.Ramakrishnan","7-(4-Nitrophenyl)-7-azabicyclo[4.1.0]heptane","Acta Crystallographica Section C","1997","53","12","IUC9700032","","10.1107/S0108270197099241","","","0.71073","MoKα","","0.1345","0.0453","","0.1264","0.1007","","","","0.818","1.077","1.077","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006876","9.3718","0.0014","17.085","0.003","14.351","0.002","90","","95.121","0.004","90","","2288.7","0.6","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2,4,6,9,11-pentamethyl-5,8-diazadodeca-4,8-diene-2,11- diamine)nickel(II) tetrachlorozincate","","- C15 H32 Cl4 N4 Ni Zn -","- C15 H32 Cl4 N4 Ni Zn -","- C60 H128 Cl16 N16 Ni4 Zn4 -","4","1","SK1009","Gladkikh, Olga P.; Curtis, Neil F.; Heath, Sarah L.","A Nickel(II) Compound with a Tetradentate Diamine‒Diimine Ligand, (2,4,6,9,11-Pentamethyl-5,8-diazadodeca-4,8-diene-2,11-diamine)nickel(II) Tetrachlorozincate","Acta Crystallographica Section C","1997","53","12","1770","1772","10.1107/S0108270197009840","","","0.71073","MoKα","","0.0821","0.0473","","0.1088","0.0918","","","","1.082","1.091","1.091","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006877","17.659","0.003","8.477","0.002","17.763","0.003","90","","114.1","0.01","90","","2427.3","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","octacarbonyl-μ-chloro-μ-dicyclohexylphosphido-dimanganese","","- C20 H22 Cl Mn2 O8 P -","- C20 H22 Cl Mn2 O8 P -","- C80 H88 Cl4 Mn8 O32 P4 -","4","0.5","SK1124","Flörke, Ulrich; Haupt, Hans-Jürgen","Octacarbonyl-μ-chloro-μ-dicyclohexylphosphido-dimanganese","Acta Crystallographica Section C","1997","53","12","1799","1801","10.1107/S0108270197010354","","","0.71073","MoKα","","0.084","0.048","","0.122","","0.104","","","1.028","","","1.103","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006878","13.3551","0.0019","12.4868","0.0008","14.7273","0.0015","90","","112.604","0.01","90","","2267.3","0.5","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(1'-Benzoylferrocenyl)diphenylmethanol","","- C30 H24 Fe O2 -","- C30 H24 Fe O2 -","- C120 H96 Fe4 O8 -","4","1","SK1147","Glidewell, Christopher; Ahmed, S. Zaka; Gallagher, John F.; Ferguson, George","(1'-Benzoylferrocenyl)diphenylmethanol; a Centrosymmetric ^4^~4~(16) Dimer Generated by C—H···O Hydrogen Bonding","Acta Crystallographica Section C","1997","53","12","1775","1778","10.1107/S010827019701233X","","","0.7107","MolybdenumKα","","0.1037","0.0401","","","0.0868","0.0969","","","","","","0.97","","","","has coordinates","192302","2020-10-21","18:00:00",""
"2006879","6.2616","0.0008","25.1866","0.0015","11.603","0.0009","90","","90.06","0.008","90","","1829.9","0.3","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1'-Dibenzoylferrocene","","- C24 H18 Fe O2 -","- C24 H18 Fe O2 -","- C96 H72 Fe4 O8 -","4","1","SK1150","Gallagher, John F.; Ferguson, George; Ahmed, S. Zaka; Glidewell, Christopher; Lewis, Arwel","Accurate Redeterminations of 1,1'-Dibenzoylferrocene and (4-Nitrophenyl)ferrocene","Acta Crystallographica Section C","1997","53","12","1772","1775","10.1107/S0108270197012602","","","0.7107","MolybdenumKα","","0.1026","0.0402","","","","0.0876","","","","","","0.996","","","","has coordinates","192301","2020-10-21","18:00:00",""
"2006880","9.6988","0.0011","9.3056","0.0015","14.543","0.002","90","","93.311","0.012","90","","1310.4","0.3","294","1","294","1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","(4-Nitrophenyl)ferrocene","","- C16 H13 Fe N O2 -","- C16 H13 Fe N O2 -","- C64 H52 Fe4 N4 O8 -","4","1","SK1150","Gallagher, John F.; Ferguson, George; Ahmed, S. Zaka; Glidewell, Christopher; Lewis, Arwel","Accurate Redeterminations of 1,1'-Dibenzoylferrocene and (4-Nitrophenyl)ferrocene","Acta Crystallographica Section C","1997","53","12","1772","1775","10.1107/S0108270197012602","","","0.7107","MolybdenumKα","","0.0841","0.0403","","","","0.1015","","","","","","1","","","","has coordinates","192289","2020-10-21","18:00:00",""
"2006881","13.628","0.002","7.618","0.001","5.11","0.001","90","0.01","90","0.01","90","0.01","530.51","0.15","12","","12","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","L-threonine","","","- C4 H9 N O3 -","- C4 H9 N O3 -","- C16 H36 N4 O12 -","4","1","SX1034","Jan Janczak; Dieter Zobel; Peter Luger","<small>L</small>-Threonine at 12 K","Acta Crystallographica Section C","1997","53","12","1901","1904","10.1107/S0108270197011414","","","0.5609","AgKα_(X-ray_tube)","","0.034","0.026","","0.063","0.03","","","","5.856","2.866","2.866","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006882","10.703","0.002","10.99","0.001","17.584","0.005","90","","90","","90","","2068.3","0.7","298","","298","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","cis-anti-cis-tricyclo[6.4.0.0^2.7^]dodecane-3,12-dione","","- C12 H16 O2 -","- C12 H16 O2 -","- C96 H128 O16 -","8","1","SX1038","Angela Taylor; Edmund J. Eisenbraun; Clinton E. Browne; Elizabeth M. Holt","<i>cis</i>-<i>anti</i>-<i>cis</i>-Tricyclo[6.4.0.0^2,7^]dodecane-3,12-dione and <i>cis</i>-<i>anti</i>-<i>cis</i>-Tricyclo[6.4.0.0^2,7^]dodecane-3,9-dione","Acta Crystallographica Section C","1997","53","12","1963","1966","10.1107/S0108270197011694","","","0.71073","MoKα","","","0.059","","","","0.1562","","","","","","0.725","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006883","8.342","0.003","5.661","0.003","10.553","0.004","90","","93.23","0.01","90","","497.6","0.4","298","","298","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","cis-anti-cis-tricyclo[6.4.0.0^2.7^]dodecane-3,9-dione","","- C12 H16 O2 -","- C12 H16 O2 -","- C24 H32 O4 -","2","0.5","SX1038","Angela Taylor; Edmund J. Eisenbraun; Clinton E. Browne; Elizabeth M. Holt","<i>cis</i>-<i>anti</i>-<i>cis</i>-Tricyclo[6.4.0.0^2,7^]dodecane-3,12-dione and <i>cis</i>-<i>anti</i>-<i>cis</i>-Tricyclo[6.4.0.0^2,7^]dodecane-3,9-dione","Acta Crystallographica Section C","1997","53","12","1963","1966","10.1107/S0108270197011694","","","0.71073","MoKα","","0.1063","0.0551","","","","0.1389","","","","","","0.891","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006884","13.3179","0.0015","13.1523","0.0013","8.6827","0.0012","90","","100.19","0.01","90","","1496.9","0.3","293","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Potassium Cobalt Aluminium Phosphate","","- Al Co K O8 P2 -","- Al Co K O8 P2 -","- Al8 Co8 K8 O64 P16 -","8","1","TA1136","Chen, Xue-An; Zhao, Ling; Li, Yan; Guo, Fang; Chen, Ben-Ming","Potassium Cobalt Aluminium Mixed Phosphate, K(Co^II^,Al)~2~(PO~4~)~2~","Acta Crystallographica Section C","1997","53","12","1754","1756","10.1107/S0108270197009906","","","0.71073","MoKα","","","0.0364","","0.1038","","","","","1.198","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006885","5.294","0.004","8.837","0.004","16.143","0.008","90","","90.6","0.05","90","","755.2","0.8","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dibariummagnesium Diphosphate","","- Ba8 Mg4 O32 P8 -","- Ba2 Mg O8 P2 -","- Ba8 Mg4 O32 P8 -","4","1","TA1147","F. Lucas; G. Wallez; S. Jaulmes; A. Elfakir; M. Quarton","Dibarium Magnesium Phosphate","Acta Crystallographica Section C","1997","53","12","1741","1743","10.1107/S010827019700841X","","","0.71069","MoKα","","0.033","0.033","","0.038","0.038","","","","1.95","1.95","1.95","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006886","18.965","0.002","7.522","0.002","8.794","0.001","90","","101.13","0.01","90","","1230.9","0.4","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H30 N2 O10 -","- C23 H30 N2 O10 -","- C46 H60 N4 O20 -","2","1","TA1149","Kurihara, Hiroyuki; Fujita, Shigeo; Mase, Toshiyasu","({-})-Formoterol, a Selective β~2~-Adrenoreceptor Agonist","Acta Crystallographica Section C","1997","53","12","1887","1889","10.1107/S0108270197009918","","","1.5418","CuKα","","0.0843","0.0662","","0.0886","0.0811","","","","1.307","1.197","1.197","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006887","16.402","0.002","16.402","0.002","14.573","0.002","90","","90","","120","","3395.3","0.7","293","2","293","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Hexasilver Cerium(III) Nonanitrate","","- Ag6 Ce N9 O27 -","- Ag6 Ce N9 O27 -","- Ag36 Ce6 N54 O162 -","6","0.166667","TA1156","Audebrand, Nathalie; Auffrédic, Jean-Paul; Bénard-Rocherullé, Patricia; Louër, Daniel","Cerous Silver Nitrate, Ag~6~Ce(NO~3~)~9~","Acta Crystallographica Section C","1997","53","12","1748","1751","10.1107/S0108270197008688","","","0.71073","MoKα","","0.048","0.0397","","0.115","0.1075","","","","1.006","1.012","1.012","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006888","6.805","0.001","13.225","0.001","13.902","0.001","90","","90","","90","","1251.1","0.2","292","2","292","2","","","","","","","","4","P n a 21","P 2c -2n","33","","7-Methoxy-4,4,6-trichloro-2,4,5,6-tetrahydro-3H-3a,5-meth-anoazulene","","- C12 H13 Cl3 O -","- C12 H13 Cl3 O -","- C48 H52 Cl12 O4 -","4","1","TA1168","Mackay, Maureen F.; Banwell, Martin G.; Pallich, Susanne; Phyland, James R.","Novel Products from the Rearrangement of Some [<i>n</i>.3.1]Propellanes","Acta Crystallographica Section C","1997","53","12","2000","2002","10.1107/S0108270197010044","","","1.5418","CuKα","","0.057","0.052","","0.125","0.121","","","","1.031","1.074","1.074","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006889","9.818","0.002","11.191","0.001","11.79","0.001","90","","90","","90","","1295.4","0.3","292","2","292","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3aα,6α)-(E)-5-Chloromethylene-8,8-dichloro-6-methoxy-1,2,3,4,5,6-hexahydro- 3a,6-methanO-3aH-indene","","- C12 H13 Cl3 O -","- C12 H13 Cl3 O -","- C48 H52 Cl12 O4 -","4","1","TA1168","Mackay, Maureen F.; Banwell, Martin G.; Pallich, Susanne; Phyland, James R.","Novel Products from the Rearrangement of Some [<i>n</i>.3.1]Propellanes","Acta Crystallographica Section C","1997","53","12","2000","2002","10.1107/S0108270197010044","","","1.5418","CuKα","","0.039","0.037","","1.107","1.107","","","","1.109","1.109","1.109","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006890","3.8827","0.001","3.8827","0.001","7.546","0.002","90","","90","","90","","113.76","0.05","124","2","124","2","","","","","","","","5","P 4/m m m","-P 4 2","123","","","","- Ba Co0.9 Cu1.1 O5 Y -","- Ba Co0.9 Cu1.1 O5 Y -","- Ba Co0.9 Cu1.1 O5 Y -","1","0.0625","TA1169","Gainsford, Graeme J.; Tallon, J. L.; Lin, C.T.","YBa(Cu~1.10~Co~0.90~)O~5~, Prepared from YBa~2~Cu~3~O~7~","Acta Crystallographica Section C","1997","53","12","1729","1730","10.1107/S0108270197010743","","","0.7093","MoKα","","0.0289","0.028","","0.0641","0.064","","","","1.316","1.339","1.339","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006891","8.715","0.006","10.229","0.005","25.007","0.012","90","","96.17","0.04","90","","2216","2","293","2","115","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 Cl Co N4 O7 -","- C19 H26 Cl Co N4 O7 -","- C76 H104 Cl4 Co4 N16 O28 -","4","1","TA1171","Hartshorn, Richard M.; Robinson, Ward T.; Telfer, Shane G.","β-(1,10-Phenanthroline)(1,3-propanediamine-<i>N</i>,<i>N</i>'-diacetato)cobalt(III) Chloride Trihydrate","Acta Crystallographica Section C","1997","53","12","1757","1759","10.1107/S0108270197010755","","","0.71073","MoKα","","0.071","0.041","","0.129","","0.103","","","1.026","1.042","1.042","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006892","4.964","0.003","5.19","0.004","24.497","0.003","90","","90.75","0.03","90","","631.1","0.6","296.2","","296.2","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,12-dodecanediol","","","- C12 H26 O2 -","- C12 H26 O2 -","- C24 H52 O4 -","2","0.5","TA1172","Nakamura, Naotake; Setodoi, Shigetaka","1,12-Dodecanediol","Acta Crystallographica Section C","1997","53","12","1883","1885","10.1107/S0108270197011918","","","0.7107","MoKα","","0.097","0.049","","0.091","0.072","","","","1.606","1.27","1.27","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006893","8.332","0.001","9.524","0.001","13.539","0.002","90.02","0.01","100.32","0.02","111.33","0.01","982.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-acetatobis(dicarbonyl(pyrazole)ruthenium(I))","","- C14 H14 N4 O8 Ru2 -","- C14 H14 N4 O8 Ru2 -","- C28 H28 N8 O16 Ru4 -","2","1","TA1175","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Huang, Chao-Hao; Tung, Shu-Fang; Shiu, Kom-Bei","Di-μ-acetato-bis[dicarbonyl(pyrazole)ruthenium(I)] and Di-μ-acetato-bis[dicarbonyl(3,5-dimethylpyrazole)ruthenium(I)]","Acta Crystallographica Section C","1997","53","12","1782","1784","10.1107/S0108270197012274","","","0.7093","MoKα","","0.03","0.024","","0.06","0.059","","","","1.035","1.094","1.094","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006894","9.292","0.001","13.731","0.001","18.639","0.002","90","","90","","90","","2378.1","0.4","293","2","293","2","","","","","","","","5","B b 21 m","B -2 -2b","36","","Di-u-acetatobis(dicarbonyl(3,5-dimethylpyrazole)ruthenium(I))","","- C18 H22 N4 O8 Ru2 -","- C18 H22 N4 O8 Ru2 -","- C72 H88 N16 O32 Ru8 -","4","0.5","TA1175","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Huang, Chao-Hao; Tung, Shu-Fang; Shiu, Kom-Bei","Di-μ-acetato-bis[dicarbonyl(pyrazole)ruthenium(I)] and Di-μ-acetato-bis[dicarbonyl(3,5-dimethylpyrazole)ruthenium(I)]","Acta Crystallographica Section C","1997","53","12","1782","1784","10.1107/S0108270197012274","","","0.7093","MoKα","","0.054","0.05","","0.169","0.168","","","","1.199","1.242","1.242","","","","","has coordinates","191018","2020-10-21","18:00:00",""
"2006895","8.665","0.003","16.681","0.002","13.673","0.004","90","","98.49","0.03","90","","1954.7","0.9","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(Perchlorato-O)(1,4,7,11,13- pentaazacyclohexadecane-N,N',N'',N''',N'''') Nickel(II) Perchlorate","","- C11 H27 Cl2 N5 Ni O8 -","- C11 H27 Cl2 N5 Ni O8 -","- C44 H108 Cl8 N20 Ni4 O32 -","4","2","TA1177","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Tung, Shu-Fang; Chi, Ta-Yung; Chung, Chung-Sun","(1,4,7,11,13-Pentaazacyclohexadecane-κ^5^<i>N</i>)(perchlorato-κ<i>O</i>)nickel(II) Perchlorate","Acta Crystallographica Section C","1997","53","12","1778","1780","10.1107/S0108270197011141","","","0.7093","MoKα","","0.088","0.066","","0.157","0.142","","","","0.848","1.217","1.217","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006896","6.6161","0.0013","9.633","0.002","12.692","0.003","98.27","0.02","104.84","0.02","106.74","0.02","727.8","0.3","293","1","293","1","","","","","","","","4","P -1","-P 1","2","","","","- C13 H13 Br3 O3 -","- C13 H13 Br3 O3 -","- C26 H26 Br6 O6 -","2","1","TA1187","Gable, Robert W.; Lowe, David A.; Tsanaktsidis, John","<i>endo</i>-1,4,4-Tribromo-3-methyltricyclo[5.2.1.0^2,6^]dec-8-ene-5,10-dione 10-Ethylene Acetal","Acta Crystallographica Section C","1997","53","12","1916","1917","10.1107/S0108270197012286","","","0.71073","MoKα","","0.0684","0.0447","","0.1188","0.1052","","","","1.055","1.097","1.097","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006897","13.716","0.001","14.969","0.003","15.925","0.001","90","","90","","90","","3269.6","0.7","293","2","293","2","","","","","","","","6","P c a b","-P 2bc 2ac","61","","Chloro (1,4,7,11-tetraazacyclotetradecane-N,N',N'',N''') Zinc(II) Perchlorate","","- C10 H24 Cl2 N4 O4 Zn -","- C10 H24 Cl2 N4 O4 Zn -","- C80 H192 Cl16 N32 O32 Zn8 -","8","1","VJ1073","Lu, Tian-Huey; Panneerselvam, Kaliyamoorthy; Tung, Shu-Fang; Chi, Ta-Yung; Chung, Chung-Sun","Chloro(1,4,7,11-tetraazacyclotetradecane-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')zinc(II) Perchlorate","Acta Crystallographica Section C","1997","53","12","1780","1782","10.1107/S010827019701192X","","","0.7107","MoKα","","0.09","0.054","","0.143","0.137","","","","0.936","1.114","1.114","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006898","21.4236","0.0009","21.4236","0.0009","25.757","0.003","90","","90","","90","","11821.7","1.5","170","2","170","2","","","","","","","","6","I 41 c d","I 4bw -2c","110","","(μ~5~-oxo)-bis(μ~3~-isopropoxo)-hexakis(μ~2~-isopropoxo) -hexakis(isopropoxy)-tetra-terbium(III)-titanium (μ~5~-oxo)-bis(μ~3~-isopropoxo)-hexakis(μ~2~-isopropoxo) -hexakis(isopropoxy)-tetra-erbium(III)-titanium","","- C42 H98 Er0.4 O15 Tb3.6 Ti -","- C42 H98 Er0.4 O15 Tb3.6 Ti -","- C336 H784 Er3.2 O120 Tb28.8 Ti8 -","8","0.5","AB1489","Marat Moustiakimov; Mikael Kritikos; Gunnar Westin","(Tb~0.9~,Er~0.1~)~4~TiO(O^<i>i^</i>Pr)~14~, a Novel Pentanuclear Oxo‒Alkoxide","Acta Crystallographica Section C","1998","54","1","29","31","10.1107/S0108270197010664","","","0.71073","MoKα","","0.0393","0.0238","","0.0632","0.0597","","","","0.997","1.122","1.122","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006899","13.1891","0.0009","10.5406","0.0008","8.0819","0.0008","90","","90","","90","","1123.55","0.16","200","2","200","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","8,8'-bis(dimethylsulphido)-commo-3,3'-ferra- bis(3,1,2-closo-ferradicarbadodecaborane(10))","","- C8 H32 B18 Fe S2 -","- C8 H32 B18 Fe S2 -","- C16 H64 B36 Fe2 S4 -","2","0.5","AB1497","Plešek, Jaromír; Štíbr, Bohumil; Cooke, Paul A.; Kennedy, John D.; McGrath, Thomas D.; Thornton-Pett, Mark","An Additional Isomer of the Neutral Dicarbollide Analogue of Ferrocene [Fe{C~2~B~9~H~10~(SMe~2~)}~2~]","Acta Crystallographica Section C","1998","54","1","36","38","10.1107/S0108270197012742","","","0.71073","MoKα","","0.0168","0.0165","","0.0452","0.045","","","","1.127","1.126","1.126","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006900","11.159","0.0012","25.112","0.002","9.663","0.0009","90","","90.641","0.009","90","","2707.6","0.4","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","9-(triphenylphosphine)-arachno-6-thiadecaborane(11)","","- C19 H27 B9 Cl3 P S -","- C19 H27 B9 Cl3 P S -","- C76 H108 B36 Cl12 P4 S4 -","4","1","AB1503","Cooke, Paul A.; Holub, Josef; Kennedy, John D.; S̆tíbr, Bohumil; Thornton-Pett, Mark","9-(Triphenylphosphine-<i>P</i>)-<i>arachno</i>-6-thiadecaborane(11) Trichloromethane (1/1)","Acta Crystallographica Section C","1998","54","1","121","123","10.1107/S0108270197012389","","","1.54186","CuKα","","0.0804","0.0547","","0.1456","0.1291","","","","1.006","1.056","1.056","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006901","9.6749","0.0008","14.531","0.002","18.053","0.002","90","","101.462","0.007","90","","2487.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H25 Au B10 Cl P -","- C20 H25 Au B10 Cl P -","- C80 H100 Au4 B40 Cl4 P4 -","4","1","AB1516","McWhannell, M. Anna; Rosair, Georgina M.; Welch, Alan J.","1-[Chloro(diphenylphosphino)gold(I)-<i>P</i>]-2-phenyl-1,2-dicarba-<i>closo</i>-dodecaborane(12)","Acta Crystallographica Section C","1998","54","1","13","15","10.1107/S0108270197013048","","","0.71073","MoKα","","0.0993","0.051","","0.1156","0.096","","","","1.05","1.091","1.091","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006902","11.8721","0.0007","15.406","0.002","7.1392","0.0005","90","","95.361","0.005","90","","1300.1","0.2","298","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","2-(5-Chloro-2-nitrophenyl)thionicotinoyl Chloride","","- C12 H6 Cl2 N2 O3 S -","- C12 H6 Cl2 N2 O3 S -","- C48 H24 Cl8 N8 O12 S4 -","4","1","BK1348","Garcia, J. Gabriel; Haydar, Simon H.; Krapcho, A. Paul; Liu, Yen-Hsiang; Fronczek, Frank R.","2-(5-Chloro-2-nitrophenylthio)nicotinoyl Chloride","Acta Crystallographica Section C","1998","54","1","146","148","10.1107/S0108270197012870","","","1.54184","CuKα","","","0.047","","","0.061","","","","","1.62","1.62","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006903","12.616","0.004","5.336","0.002","12.571","0.004","90","","104.67","0.03","90","","818.7","0.5","294","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H8 N2 O2 -","- C10 H8 N2 O2 -","- C40 H32 N8 O8 -","4","0.5","BK1357","Kanno, Hideaki; Omotera, Yasuyoshi; Iijima, Kinya","2,2'-Bipyridine 1,1'-Dioxide","Acta Crystallographica Section C","1998","54","1","149","151","10.1107/S0108270197013814","","","0.71073","MoKα","","","0.056","","","","0.069","","","","","","1.836","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006904","9.2736","0.0002","11.4181","0.0002","20.5184","0.0003","90","","93.696","0.001","90","","2168.11","0.07","153","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-(triphenylphosphinegold)-indoline-2,3-dione","","- C26 H19 Au N O2 P -","- C26 H19 Au N O2 P -","- C104 H76 Au4 N4 O8 P4 -","4","1","BM1167","Churakov, Andrei V.; Kuz'mina, Lyudmila G.; Howard, Judith A. K.; Grandberg, Kira I.","(2,3-Dioxoindolinyl-<i>N</i>)(triphenylphosphine-<i>P</i>)gold(I)","Acta Crystallographica Section C","1998","54","1","54","56","10.1107/S0108270197013437","","","0.71073","MoKα","","0.049","0.03","","0.07","0.06","","","","1.019","1.067","1.067","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2006905","15.9349","0.0006","8.0535","0.0003","18.6618","0.0009","90","","90","","90","","2394.9","0.17","180","2","180","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","3-Acetoxy-6-hydroxy-2,4-dimethoxyacetophenone","","- C12 H14 O6 -","- C12 H14 O6 -","- C96 H112 O48 -","8","1","BM1189","Mukherjee, Shubhasish; Parmar, Virinder S; Errington, William","3-Acetoxy-6-hydroxy-2,4-dimethoxyacetophenone","Acta Crystallographica Section C","1998","54","1","123","125","10.1107/S0108270197012894","","","0.71073","MoKα","","0.0693","0.0421","","","","0.1045","","","","","","0.885","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006906","11.48","0.005","8.114","0.003","11.882","0.004","90","","107.68","0.03","90","","1054.5","0.7","296","","296","","","","","","","","","5","P 1 21 1","P 2yb","4","","O-Phospho-L-tyrosine","","- C9 H12 N O6 P -","- C9 H11.5 N O6 P -","- C36 H46 N4 O24 P4 -","4","2","BS1022","Suga, Tamami; Inubushi, Chika; Okabe, Nobuo","<i>O</i>-Phospho-<small>L</small>-tyrosine","Acta Crystallographica Section C","1998","54","1","83","85","10.1107/S0108270197009827","","","0.71069","MoKα","","","0.121","","","0.13","","","","","1.23","1.23","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006907","6.068","0.002","11.118","0.003","24.925","0.005","90","","90","","90","","1681.5","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","\3a,\4b-Dihydroxy-5α-androstan-17-one","","- C19 H30 O3 -","- C19 H30 O3 -","- C76 H120 O12 -","4","1","BS1035","Paixão, J. A.; Andrade, L. C. R.; de Almeida, M. J.; Costa, M. M. R. R.; Tavares da Silva, E. J.; Sá e Melo, M. L.; Campos Neves, A. S.","3α,4β-Dihydroxy-5α-androstan-17-one","Acta Crystallographica Section C","1998","54","1","89","91","10.1107/S0108270197009505","","","0.7093","MoKα","","0.064","0.034","","0.089","0.078","","","","1.056","1.078","1.078","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006908","7.4828","0.0008","12.126","0.001","14.179","0.002","90","","90","","90","","1286.6","0.3","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 O3 S -","- C14 H16 O3 S -","- C56 H64 O12 S4 -","4","1","CF1177","Zukerman-Schpector, J.; Monteiro, Hugo J.","Intermediates in the Synthesis of (+)-Grandisol. II","Acta Crystallographica Section C","1998","54","1","96","97","10.1107/S0108270197011426","","","0.71073","MoKα","","0.0988","0.041","","0.119","","0.0857","","","1.13","","","1.078","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2006909","10.21","0.007","29.279","0.003","9.314","0.004","90","","90","","90","","2784","2","296.2","","296.2","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C34 H34 O4 -","- C34 H34 O4 -","- C136 H136 O16 -","4","1","DE1056","Kazuyoshi Nishikawa; Harumichi Tsukada; Satoshi Abe; Shintaro Misaki; Noritake Yasuoka","(<i>R</i>,<i>R</i>)-({-})-<i>trans</i>-2,3-Bis(hydroxydiphenylmethyl)-1,4-dioxaspiro[4.5]decane","Acta Crystallographica Section C","1998","54","1","111","112","10.1107/S010827019700992X","","","0.7107","MoKα","","0.0671","0.0671","","0.1049","0.1049","","","","1.109","1.109","1.109","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006910","13.21","0.003","9.801","0.003","13.968","0.003","90","","91.728","0.012","90","","1807.6","0.8","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4H,9H-4,9-dihydroxy-4,9-dimethyl-1,2,5,6,6a,7,8- heptahydroimidazo[1,2,3,-i,j][1,8]naphthyridinium benzoate","","- C19 H26 N2 O4 -","- C19 H26 N2 O4 -","- C76 H104 N8 O16 -","4","1","DE1059","Zhang, Jian-Heng; Chen, Xue-An; Li, Yan; Huang, Zhi-Tang","4,9-Dihydroxy-4,9-dimethyl-4<i>H</i>,9<i>H</i>-1,2,5,6,6a,7,8-heptahydroimidazo[1,2,3-<i>i</i>,<i>j</i>][1,8]naphthyridinium Benzoate","Acta Crystallographica Section C","1998","54","1","140","142","10.1107/S0108270197009529","","","0.71073","MoKα","","","0.0441","","0.111","","","","","0.919","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006911","10.506","0.001","14.39","0.001","6.471","0.001","90","","105.79","0.01","90","","941.38","0.19","293","","","","","","","","","","","4","C 1 m 1","C -2y","8","","Structure of Synthetic Heptacobalt Tetrasodium Monophosphate Na~4~Co~7~(PO~4~)~6~","","- Co7 Na4 O24 P6 -","- Co7 Na4 O24 P6 -","- Co14 Na8 O48 P12 -","2","0.5","DU1180","Kobashi, Dilshat; Kohara, Shizuo; Yamakawa, Junji; Kawahara, Akira","Un Monophosphate Synthétique de Sodium et de Cobalt: Na~4~Co~7~(PO~4~)~6~","Acta Crystallographica Section C","1998","54","1","7","9","10.1107/S010827019701189X","","","0.71069","MoKα","","","0.038","","","","0.033","","","","","","1.284","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006912","8.3","0.002","14.813","0.005","27.654","0.006","90","","90","","90","","3400","1.6","293","1","293","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","chasmanthinine","","","- C36 H49 N O9 -","- C36 H49 N O9 -","- C144 H196 N4 O36 -","4","1","FG1328","Parvez, Masood; Gul, Waseem; Anwar, Saeed","Chasmanthinine","Acta Crystallographica Section C","1998","54","1","125","126","10.1107/S0108270197013449","","","1.54178","CuKα","","0.0605","0.0511","","0.1513","0.1262","","","","1.078","1.045","1.045","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006913","8.022","0.004","38.685","0.004","5.847","0.003","90","","90","","90","","1814.5","1.3","294","","294","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H19 N O S -","- C22 H19 N O S -","- C88 H76 N4 O4 S4 -","4","1","FG1342","Fu, Tai Y.; Scheffer, John R.; Trotter, James","Photocleavage Reactions of Monothioimides","Acta Crystallographica Section C","1998","54","1","103","107","10.1107/S0108270197011645","","","1.5418","CuKα","","","0.03","","","","0.0845","","","","","","1.71","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006914","9.506","0.001","17.643","0.002","11.96","0.001","90","","91.65","0.01","90","","2005","0.4","294","","294","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C22 H18 Br N O S -","- C22 H18 Br N O S -","- C88 H72 Br4 N4 O4 S4 -","4","1","FG1342","Fu, Tai Y.; Scheffer, John R.; Trotter, James","Photocleavage Reactions of Monothioimides","Acta Crystallographica Section C","1998","54","1","103","107","10.1107/S0108270197011645","","","1.5418","CuKα","","","0.0439","","","","0.1298","","","","","","3.63","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006915","38.032","0.003","7.373","0.004","7.725","0.004","90","","90","","90","","2166.2","1.6","294","","294","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C24 H22 Br N O S -","- C24 H22 Br N O S -","- C96 H88 Br4 N4 O4 S4 -","4","1","FG1342","Fu, Tai Y.; Scheffer, John R.; Trotter, James","Photocleavage Reactions of Monothioimides","Acta Crystallographica Section C","1998","54","1","103","107","10.1107/S0108270197011645","","","0.7107","MoKα","","","0.0331","","","","0.0824","","","","","","1.18","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006916","26.345","0.006","24.531","0.007","6.073","0.01","90","","90","","90","","3925","7","294","","294","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C23 H21 N O2 S -","- C23 H21 N O2 S -","- C184 H168 N8 O16 S8 -","8","1","FG1342","Fu, Tai Y.; Scheffer, John R.; Trotter, James","Photocleavage Reactions of Monothioimides","Acta Crystallographica Section C","1998","54","1","103","107","10.1107/S0108270197011645","","","0.7107","MoKα","","","0.046","","","","0.122","","","","","","1.03","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006917","10.338","0.003","18.947","0.001","8.548","0.001","90","","90","","90","","1674.3","0.5","294","","294","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H15 N O S -","- C20 H15 N O S -","- C80 H60 N4 O4 S4 -","4","1","FG1356","Fu, Tai Y.; Scheffer, John R.; Trotter, James","<i>N</i>-Phenyl-<i>N</i>-(phenylthioxomethyl)benzamide","Acta Crystallographica Section C","1998","54","1","101","102","10.1107/S0108270197011244","","","1.5418","CuKα","","","0.042","","","","0.14","","","","","","2.73","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006918","11.6819","0.0014","15.2304","0.0016","16.349","0.002","90","","107.548","0.01","90","","2773.5","0.6","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis-μ-[methylenebis(diphenylphosphine)]disilver(I) Bisperchlorate Bis(dichloromethane) Solvate","","- C52 H48 Ag2 Cl6 O8 P4 -","- C52 H48 Ag2 Cl6 O8 P4 -","- C104 H96 Ag4 Cl12 O16 P8 -","2","0.5","FG1371","Ahrens, Birte; Jones, Peter G.","Bis[μ-methylenebis(diphenylphosphine)-<i>P</i>:<i>P</i>']disilver(I) Diperchlorate Bis(dichloromethane) Solvate","Acta Crystallographica Section C","1998","54","1","16","18","10.1107/S0108270197011657","","","0.71073","MoKα","","0.0678","0.0358","","0.073","0.0671","","","","0.863","1.003","1.003","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006919","23.882","0.004","8.3285","0.0012","20.338","0.003","90","","90","","90","","4045.3","1.1","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Tetrakis(acetonitrilo)copper(I) Tetrafluoroborate","","- C8 H12 B Cu F4 N4 -","- C8 H12 B Cu F4 N4 -","- C96 H144 B12 Cu12 F48 N48 -","12","3","FG1379","Jones, Peter G.; Crespo, Olga","Tetrakis(acetonitrile-<i>N</i>)copper(I) Tetrafluoroborate","Acta Crystallographica Section C","1998","54","1","18","20","10.1107/S0108270197013322","","","0.71073","MoKα","","0.0745","0.0437","","0.0907","0.0834","","","","0.931","1.055","1.055","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006920","15.865","0.004","11.886","0.006","20.252","0.004","90","","112.438","0.014","90","","3530","2","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","9-(o-tert-butylphenyl)-9-fluorenol","","- C23 H22 O -","- C23 H22 O -","- C184 H176 O8 -","8","2","FG1380","Robinson, Paul D.; Hou, Yuqing; Lutfi, Hisham G.; Meyers, Cal Y.","Exclusivity of the <i>sp</i> Rotamers of 9-(<i>o</i>-<i>tert</i>-Butylphenyl)fluorene and 9-(<i>o</i>-<i>tert</i>-Butylphenyl)-9-fluorenol in Solution and the Crystalline State","Acta Crystallographica Section C","1998","54","1","73","77","10.1107/S0108270197012638","","","0.71069","MoKα","","0.1362","0.0424","","0.149","","0.1074","","","1.012","1.111","1.111","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006921","10.7211","0.0011","15.186","0.002","10.4816","0.0008","90","","90","","90","","1706.5","0.3","296","","296","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","sp-9-(o-tert-butylphenyl)fluorene","","- C23 H22 -","- C23 H22 -","- C92 H88 -","4","1","FG1380","Robinson, Paul D.; Hou, Yuqing; Lutfi, Hisham G.; Meyers, Cal Y.","Exclusivity of the <i>sp</i> Rotamers of 9-(<i>o</i>-<i>tert</i>-Butylphenyl)fluorene and 9-(<i>o</i>-<i>tert</i>-Butylphenyl)-9-fluorenol in Solution and the Crystalline State","Acta Crystallographica Section C","1998","54","1","73","77","10.1107/S0108270197012638","","","0.71069","MoKα","","0.1041","0.038","","0.1225","","0.096","","","1.003","1.09","1.09","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006922","10.7794","0.001","7.8301","0.0008","11.8317","0.0012","90","","97.505","0.008","90","","990.09","0.17","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","5-Amino-1-phenylsulfonyl-pyrazolin-3-one","","- C9 H9 N3 O3 S -","- C9 H9 N3 O3 S -","- C36 H36 N12 O12 S4 -","4","2","FG1382","Elgemeie, Galal E.H.; Hanfy, Nadia; Hopf, Henning; Jones, Peter G.","5-Amino-1-phenylsulfonyl-4-pyrazolin-3-one","Acta Crystallographica Section C","1998","54","1","136","138","10.1107/S0108270197012420","","","0.71073","MoKα","","0.0417","0.0328","","0.0839","0.081","","","","1.04","1.108","1.108","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006923","4.71","0.001","14.5119","0.0015","12.212","0.0008","90","","100.151","0.01","90","","821.6","0.2","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H9 B N2 O -","- C8 H9 B N2 O -","- C32 H36 B4 N8 O4 -","4","1","FG1385","Robinson, Paul D.; Groziak, Michael P.; Chen, Liya","A 2-Alkyl Substituted 2,3,1-Benzodiazaborine","Acta Crystallographica Section C","1998","54","1","71","73","10.1107/S0108270197012432","","","0.71069","MoKα","","0.0911","0.0343","","0.1031","","0.0819","","","1.006","1.086","1.086","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006924","6.2591","0.0013","14.616","0.003","14.054","0.003","90","","96.71","0.03","90","","1276.9","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dicholoro-bis(1,3-imidazolidine-2-thione)cadmium(II)","","- C6 H12 Cd Cl2 N4 S2 -","- C6 H12 Cd Cl2 N4 S2 -","- C24 H48 Cd4 Cl8 N16 S8 -","4","1","FR1043","Al-Arfaj, A. R.; Reibenspies, J. H.; Isab, A. A.; Hussain, M. Sakhawat","Dichlorobis(1,3-imidazolidine-2-thione-<i>S</i>)cadmium(II)","Acta Crystallographica Section C","1998","54","1","51","53","10.1107/S0108270197012092","","","0.71073","MoKα","","0.0568","0.0417","","0.1073","0.097","","","","1.051","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006925","9.538","0.002","9.603","0.002","9.769","0.002","82.46","0.03","64","0.03","61.59","0.03","704","0.4","293","2","296","2","","","","","","","","4","P -1","-P 1","2","","N,N'-Bis(1-methylimidazole-2yl-methyl)-1,3-diaminopropan-2-ol","","- C13 H18 N6 O -","- C13 H18 N6 O -","- C26 H36 N12 O2 -","2","1","FR1056","Vencato, Ivo; Neves, Ademir; Scarpellini, Marciela; Correia, Valdir R.","<i>N</i>,<i>N</i>'-Bis(1-methylimidazol-2-ylmethylidene)-1,3-diaminopropan-2-ol, HBIMPNOL","Acta Crystallographica Section C","1998","54","1","97","99","10.1107/S0108270197010202","","","0.71073","MoKα","","0.0573","0.0409","","0.1909","0.1059","","","","1.093","1.022","1.022","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006926","7.126","0.001","8.795","0.001","15.082","0.001","73.41","0.01","85.82","0.01","76.78","0.01","881.85","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H22 Cl2 Hg N2 S2 -","- C12 H22 Cl2 Hg N2 S2 -","- C24 H44 Cl4 Hg2 N4 S4 -","2","1","FR1061","Nuñez Gaytán, María Elena; Bernès, Sylvain; Rodríguez de San Miguel Guerrero, Eduardo; Bernal U., Juan Pablo; De Gyves, Josefina","First Hg^II^‒ω-Thiocaprolactam Complex","Acta Crystallographica Section C","1998","54","1","49","51","10.1107/S0108270197012444","","","0.71073","MoKα","","0.056","0.038","","0.087","0.08","","","","1.03","1.053","1.053","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006927","9.279","0.001","17.633","0.002","15.505","0.001","90","","106.35","0.01","90","","2434.3","0.4","294","","294","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H31 Co N6 O4 -","- C22 H29 Co N6 O4 -","- C88 H116 Co4 N24 O16 -","4","2","FR1066","Gage, Jennifer L.; Weakley, Timothy J.R.; Branchaud, Bruce P.","Bis[2,3-butanedione dioximato(1‒)-<i>N</i>,<i>N</i>'](pyridine){[(<i>R</i>)-5,6,7,8-tetrahydro-8-indolizinyl]methyl}cobalt(III)","Acta Crystallographica Section C","1998","54","1","22","24","10.1107/S0108270197012663","","","0.71073","MolybdenumKα","","0.06","0.039","","","","0.082","","","","","","1.33","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006928","12.602","0.002","13.0428","0.001","19.074","0.003","90","","94.289","0.007","90","","3126.3","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(η^5^-Pentamethylcyclopentadienyl)chromium(III) (η^5^- Pentamethylcyclopentadienyl)trichlorochromium(III)","","- C30 H45 Cl3 Cr2 -","- C30 H45 Cl3 Cr2 -","- C120 H180 Cl12 Cr8 -","4","1","FR1067","Aldridge, Simon; Shang, Maoyu; Fehlner, Thomas P.","Structure of the Chromium(III) Salt [Cp^*^~2~Cr]^+^[Cp^*^CrCl~3~]^{-^}","Acta Crystallographica Section C","1998","54","1","47","49","10.1107/S0108270197011256","","","0.71073","MoKα","","0.0738","0.0528","","0.1467","0.129","","","","1.153","1.167","1.167","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006929","11.1567","0.0005","25.439","0.002","11.7631","0.0006","90","","90","","90","","3338.5","0.3","294.2","","294.2","","","","","","","","","5","P n m a","-P 2ac 2n","62","Cobalt(3,5-di-t-butylsaltmen)","Bis[N,N,N',N'-tetramethyl-1,2-diaminoethane-1,2-bis(3,5-di-t-butyl- salicylideneiminato)]cobalt(II)","","- C36 H54 Co N2 O2 -","- C36 H51 Co N2 O2 -","- C144 H204 Co4 N8 O8 -","4","0.5","FR1070","Lyon, David K.; Miller, Brian E.; Miller, Warren K.; Tyler, David R.; Weakley, Timothy J. R.","[<i>N</i>,<i>N</i>'-(1,1,2,2-Tetramethylethylene)bis(3,5-di-<i>tert</i>-butylsalicylideneiminato)]cobalt(II)","Acta Crystallographica Section C","1998","54","1","20","22","10.1107/S010827019701264X","","","0.71073","MoKα","","","0.04","","","0.045","","","","","2.33","2.33","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006930","13.979","0.002","12.608","0.007","8.024","0.002","90","","90","","90","","1414.2","0.9","294","","294","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C20 H12 O2 -","- C20 H12 O2 -","- C80 H48 O8 -","4","0.5","FR1071","Fu, Tai Y.; Gamlin, Janet N.; Olovsson, Gunnar; Scheffer, John R.; Trotter, James; Young, Dean T.","Photochemistry of Triptycene-1,4-quinone","Acta Crystallographica Section C","1998","54","1","116","119","10.1107/S0108270197012109","","","0.7107","MoKα","","","0.058","","","","0.177","","","","","","1.087","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006931","12.274","0.003","7.957","0.003","15.444","0.003","90","","90","","90","","1508.3","0.7","294","","294","","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C20 H12 O3 -","- C20 H12 O3 -","- C80 H48 O12 -","4","1","FR1071","Fu, Tai Y.; Gamlin, Janet N.; Olovsson, Gunnar; Scheffer, John R.; Trotter, James; Young, Dean T.","Photochemistry of Triptycene-1,4-quinone","Acta Crystallographica Section C","1998","54","1","116","119","10.1107/S0108270197012109","","","0.7107","MoKα","","","0.037","","","","0.103","","","","","","1.078","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006932","28.019","0.005","5.432","0.001","8.055","0.005","90","","95.37","0.06","90","","1220.6","0.8","295","","295","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","bis(4-butoxyphenyl)terephthalate","","- C28 H30 O6 -","- C28 H30 O6 -","- C56 H60 O12 -","2","0.5","HA1195","Centore, Roberto; Tuzi, Angela","Bis(4-butoxyphenyl) Terephthalate","Acta Crystallographica Section C","1998","54","1","107","109","10.1107/S0108270197010640","","","1.54178","CuKα","","0.065","0.046","","","0.068","","","","","1.895","1.895","","","","","has coordinates","192203","2020-10-21","18:00:00",""
"2006933","8.545","0.001","9.643","0.001","10.807","0.001","88.8","0.01","67.61","0.01","82.98","0.01","816.87","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","N-Benzyl-3- Benzylidene Isoindolin-1- one","N-Benzyl-3- Benzylidene Isoindolin-1- one","","- C22 H17 N O -","- C22 H17 N O -","- C44 H34 N2 O2 -","2","1","HA1197","M. Wahab Khan; Subhadra Guha; Alok K. Mukherjee; Nitya G. Kundu","<i>N</i>-Benzyl-3-benzylideneisoindolin-1-one","Acta Crystallographica Section C","1998","54","1","119","120","10.1107/S0108270197011979","","","1.5418","CuKα","","0.0463","0.0438","","0.1206","0.1184","","","","1.112","1.137","1.137","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006934","11.356","0.002","13.243","0.002","20.002","0.003","90","","90","","90","","3008.1","0.8","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Diethyl 3,7-Hypoxanthyldiacetate","","- C13 H16 N4 O5 -","- C13 H16 N4 O5 -","- C104 H128 N32 O40 -","8","1","JZ1236","Sood, Geeta; Schwalbe, Carl H.; Fraser, William","Diethyl 3,7-Hypoxanthyldiacetate","Acta Crystallographica Section C","1998","54","1","114","116","10.1107/S0108270197011906","","","1.54178","CuKα","","0.049","0.042","","0.125","0.118","","","","1.057","1.085","1.085","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006935","9.291","0.005","11.773","0.005","13.079","0.009","108.1","0.05","92.96","0.05","96.01","0.04","1347","1.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aquadicyanonitrosomethanidobis(1,10-phenanthroline)copper(II) Dicyanonitrosomethanide","","- C30 H18 Cu N10 O3 -","- C30 H18 Cu N10 O3 -","- C60 H36 Cu2 N20 O6 -","2","1","KA1234","Mikloš, Dušan; Potočňák, Ivan; Dunaj-Jurčo, Michal; Jäger, Lothar","Aqua(dicyanonitrosomethanido-<i>O</i>)bis(1,10-phenanthroline-<i>N</i>,<i>N</i>')copper(II) Dicyanonitrosomethanide","Acta Crystallographica Section C","1998","54","1","33","36","10.1107/S0108270197010251","","","0.71073","MoKα","","0.148","0.04","","0.099","0.084","","","","0.784","1.07","1.07","","","","","has coordinates","194525","2020-10-21","18:00:00",""
"2006936","6.574","0.002","13.798","0.002","14.838","0.003","90","","90","","90","","1345.9","0.5","299","2","299","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H14 N2 O -","- C17 H14 N2 O -","- C68 H56 N8 O4 -","4","1","KA1241","Elerman, Yalçin; Kabak, Mehmet; Elmali, Ayhan; Svoboda, Ingrid","1-[<i>N</i>-(4-Methyl-2-pyridyl)aminomethylidene]-2(1<i>H</i>)-naphthalenone","Acta Crystallographica Section C","1998","54","1","128","130","10.1107/S0108270197008858","","","0.71093","MoKα","","0.132","0.049","","0.18","0.14","","","","1.101","1.228","1.228","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006937","13.5174","0.0014","13.919","0.0013","17.0708","0.0015","90","","90","","90","","3211.8","0.5","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","3', 4'-dimethoxy-N-methyl-4-stilbazolium tetrafluoroborate","4-[2-(3,4-dimethoxyphenyl)ethenyl]-1-methylpyridinium tetrafluoroborate","","- C16 H18 B F4 N O2 -","- C16 H18 B F4 N O2 -","- C128 H144 B8 F32 N8 O16 -","8","1","KA1254","De-Chun Zhang; Tian-Zhu Zhang; Yan-Qiu Zhang; Li-Qin Ge; Kai-Bei Yu","4-[2-(3,4-Dimethoxyphenyl)ethenyl]-1-methylpyridinium Tetrafluoroborate","Acta Crystallographica Section C","1998","54","1","138","140","10.1107/S0108270197012559","","","0.71073","MoKα","","0.071","0.038","","0.103","0.094","","","","0.891","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006938","6.451","0.002","13.307","0.002","8.885","0.002","90","","95.1","0.04","90","","759.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-[bis(N-methylpiperazine)dichloroplatinum(II)]","","- C10 H24 Cl2 N4 Pt -","- C10 H24 Cl2 N4 Pt -","- C20 H48 Cl4 N8 Pt2 -","2","0.5","LN1009","Marzotto, Armando; Clemente, Dore Augusto; Valle, Giovanni","Platinum(II) Complexes of Piperazine (and Derivatives): <i>trans</i>-Dichlorobis(<i>N</i>-methylpiperazine-<i>N</i>')platinum(II)","Acta Crystallographica Section C","1998","54","1","27","29","10.1107/S0108270197012353","","","0.7107","MoKα","","0.0441","0.0242","","0.0706","0.0635","","","","1.018","1.104","1.104","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006939","11.845","0.001","14.149","0.001","14.766","0.001","90.206","0.007","108.131","0.005","91.112","0.005","2351.3","0.3","193.2","","193.2","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H18 F10 N O3 P -","- C21 H18 F10 N O3 P -","- C84 H72 F40 N4 O12 P4 -","4","2","LN1014","Charles F. Campana; Katherine W. Oliver; Steven J. Rettig; Robert C. Thompson; James Trotter; Shihua Xia","2,2,6,6-Tetramethyl-4-oxopiperidinium Bis(pentafluorophenyl)phosphinate","Acta Crystallographica Section C","1998","54","1","99","101","10.1107/S0108270197011281","","","0.71073","MoKα","","","0.06","","","","0.112","","","","","","2.016","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006940","10.747","0.002","27.457","0.004","17.837","0.003","90","","90","","90","","5263.3","1.5","180","2","180","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","trans-chloro-bis[ethylene-bis(diethylphosphine)]hydrido-iron(II)","","- C20 H49 Cl Fe P4 -","- C20 H49 Cl Fe P4 -","- C160 H392 Cl8 Fe8 P32 -","8","1","LN1021","Wiesler, Beatrix; Tuczek, Felix; Näther, Christian; Bensch, Wolfgang","[FeHCl(C~10~H~24~P~2~)~2~]","Acta Crystallographica Section C","1998","54","1","44","46","10.1107/S0108270197012754","","","0.71073","MoKα","","0.0823","0.0474","","0.1568","0.126","","","","1.073","1.075","1.075","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006941","8.994","0.003","16.534","0.004","9.428","0.002","90","","118.11","0.03","90","","1236.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","(Z)-3(H)-piperidinomethin-1,4-benzodioxin-2-one","","- C14 H15 N O3 -","- C14 H15 N O3 -","- C56 H60 N4 O12 -","4","1","LN1023","Bozzo, Concepción; Pujol, Maria D.; Solans, Xavier; Font-Bardia, Mercè","3-[(<i>Z</i>)-Piperidin-1-ylmethylidene]-2,3-dihydro-1,4-benzodioxan-2-one","Acta Crystallographica Section C","1998","54","1","79","81","10.1107/S0108270197012365","","","0.71069","MoKα","","0.104","0.066","","0.312","0.197","","","","0.985","1.071","1.071","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006942","10.232","0.003","10.685","0.006","13.321","0.003","102.06","0.03","103.11","0.02","108.08","0.03","1285.5","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Ismine","6-[2-(Methylamino)phenyl]-1,3-benzodioxole-5-methanol","","- C15 H15 N O3 -","- C15 H15 N O3 -","- C60 H60 N4 O12 -","4","2","LN1026","Viladomat, Francesc; Codina, Carles; Bastida, Jaume; Solans, Xavier; Font-Bardia, Mercè","Ismine","Acta Crystallographica Section C","1998","54","1","81","82","10.1107/S0108270197012122","","","0.71069","MoKα","","0.0536","0.0472","","0.14","0.1376","","","","0.986","1.033","1.033","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006943","7.983","0.002","10.908","0.001","9.264","0.001","90","","114.51","0.01","90","","734","0.2","293","","293","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 -","- C20 H18 -","- C40 H36 -","2","0.5","LN1034","Avery, Tom D.; Taylor, Dennis K.; Tiekink, Edward R.T.","3,3''-Dimethyl-1,1':4',1''-terphenyl","Acta Crystallographica Section C","1998","54","1","148","149","10.1107/S0108270197012900","","","1.5418","CuKα","","","0.053","","","0.068","","","","","2.828","2.828","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006944","6.358","0.005","10.463","0.005","12.842","0.005","90","","94.57","0.05","90","","851.6","0.9","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S,3S)-N-Benzyl-N-[3-(tert-butoxycarbonylamino)-2-butyl]hydroxylamine","","- C16 H26 N2 O3 -","- C16 H26 N2 O3 -","- C32 H52 N4 O6 -","2","1","NA1318","Merino, Pedro; Merchan, Francisco L.; Tejero, Tomas; Lanaspa, Ana","Chiral Hydroxylamines. V. (2<i>S</i>,3<i>S</i>)-<i>N</i>-Benzyl-<i>N</i>-[3-(<i>tert</i>-butoxycarbonylamino)-2-butyl]hydroxylamine","Acta Crystallographica Section C","1998","54","1","85","86","10.1107/S0108270197013267","","","0.71069","MoKα","","0.073","0.0505","","0.1481","0.1292","","","","1.025","1.056","1.056","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006945","11.019","0.002","6.844","0.002","21.424","0.003","90","","93.8","0.01","90","","1612.1","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-poly[bis(nicotinamide-N^1^)diaquacopper(II)-μ-sulfato-O:O']","","- C12 H16 Cu N4 O8 S -","- C12 H16 Cu N4 O8 S -","- C48 H64 Cu4 N16 O32 S4 -","4","1","NA1322","Kozlevčar, Bojan; Leban, Ivan; Sieler, Joachim; Šegedin, Primož","<i>catena</i>-Poly[diaquabis(nicotinamide-<i>N</i>^1^)copper(II)-μ-sulfato-<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","1998","54","1","39","41","10.1107/S0108270197012547","","","0.71073","MoKα","","0.0772","0.0471","","","","0.1428","","","","","","1.012","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006946","9.221","0.004","9.221","0.004","14.006","0.006","90","","90","","120","","1031.3","0.8","293","","293","","","","","","","","","3","P 32","P 32","145","8α-Hydroxy-11α,13-dihydrozaluzanin C","Decahydro-4,8-dihydroxy-3-methyl-6,9- bis(methylene)-azuleno[4,5-b]furan-2(3H)-one","","- C15 H20 O4 -","- C15 H20 O4 -","- C45 H60 O12 -","3","1","NA1327","Kakuda, Hiroko; Helal, Amr M.; Nakamura, Norio; Hattori, Masao","8α-Hydroxy-11α,13-dihydrozaluzanin C","Acta Crystallographica Section C","1998","54","1","113","114","10.1107/S0108270197012924","","","0.71069","MoKα","","0.0855","0.0445","","0.1466","","0.1211","","","0.92","","","0.926","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006947","3.733","0.003","8.009","0.002","11.508","0.002","90","","92.46","0.03","90","","343.7","0.3","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H10 N2 O4 -","- C4 H10 N2 O4 -","- C8 H20 N4 O8 -","2","0.5","OA1034","Hosomi, Hiroyuki; Ito, Yoshikatsu; Ohba, Shigeru","Ammonium and Isopropylammonium Salts of the Fumaric Acid Dianion","Acta Crystallographica Section C","1998","54","1","142","145","10.1107/S0108270197013796","","","0.71073","MoKα","","","0.04","","","0.048","","","","","1.06","1.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006948","7.236","0.002","6.275","0.002","15.46","0.002","90","","99.55","0.01","90","","692.2","0.3","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H22 N2 O4 -","- C10 H22 N2 O4 -","- C20 H44 N4 O8 -","2","0.5","OA1034","Hosomi, Hiroyuki; Ito, Yoshikatsu; Ohba, Shigeru","Ammonium and Isopropylammonium Salts of the Fumaric Acid Dianion","Acta Crystallographica Section C","1998","54","1","142","145","10.1107/S0108270197013796","","","0.71073","MoKα","","","0.055","","","0.045","","","","","0.97","0.97","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006949","20.913","0.007","10.868","0.008","12.03","0.01","90","","100.45","0.04","90","","2689","3","173.2","","173.2","","","","","","","","","5","P 1 21 1","P 2yb","4","","3-(4,6-dibromo-o-tolyl)-10-(4-tert-butylphenyl)pyrimido[4,5-b]quinoline- 2,4(3H,10H)-dione","","- C29 H27 Br2 N3 O3 -","- C29 H27 Br2 N3 O3 -","- C116 H108 Br8 N12 O12 -","4","2","OA1036","Yasushi Kawai; Jun Kunitomo; Atsuyoshi Ohno","First Determination of the Absolute Configuration of an Atropisomeric Flavin Derivative","Acta Crystallographica Section C","1998","54","1","77","79","10.1107/S0108270197013838","","","0.71069","MoKα","","0.052","0.034","","0.066","0.052","","","","0.828","0.862","0.862","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006950","8.142","0.001","13.393","0.001","14.822","0.001","90","","100.88","0.07","90","","1587.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","Trimethyl isocyanurate","1,3,5-Trimethyl-1,3,5-triazine(1H,3H,5H)-2,4,6-trione","","- C6 H9 N3 O3 -","- C6 H9 N3 O3 -","- C48 H72 N24 O24 -","8","2","OA1038","Thalladi, Venkat R.; Katz, Amy K.; Carrell, H. L.; Nangia, Ashwini; Desiraju, Gautam R.","Trimethyl Isocyanurate and Triethyl Isocyanurate","Acta Crystallographica Section C","1998","54","1","86","89","10.1107/S010827019701384X","","","0.71073","MoKα","","0.074","0.053","","0.163","0.152","","","","1.088","1.211","1.211","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006951","7.835","0.002","8.144","0.001","16.82","0.005","90","","90","","90","","1073.3","0.4","293","2","121","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Triethyl isocyanurate","1,3,5-Triethyl-1,3,5-triazine(1H,3H,5H)-2,4,6-trione","","- C9 H15 N3 O3 -","- C9 H15 N3 O3 -","- C36 H60 N12 O12 -","4","1","OA1038","Thalladi, Venkat R.; Katz, Amy K.; Carrell, H. L.; Nangia, Ashwini; Desiraju, Gautam R.","Trimethyl Isocyanurate and Triethyl Isocyanurate","Acta Crystallographica Section C","1998","54","1","86","89","10.1107/S010827019701384X","","","0.71073","MoKα","","0.044","0.038","","0.107","0.096","","","","1.074","1.041","1.041","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006952","8.1249","0.0015","10.9","0.002","10.132","0.002","90","","107.57","0.02","90","","855.4","0.3","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","4-Azidobenzenesulfonyl chloride","","- C6 H4 Cl N3 O2 S -","- C6 H4 Cl N3 O2 S -","- C24 H16 Cl4 N12 O8 S4 -","4","1","QA0025","Ziemer, Burkhard; Sauer, Erika","4-Azidobenzenesulfonyl Chloride","Acta Crystallographica Section C","1998","54","1","IUC9700034","","10.1107/S0108270198099879","","","0.71071","MoKα","","0.0362","0.0319","","0.1352","0.0918","","","","1.102","1.142","1.142","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2006953","7.453","0.001","13.789","0.001","20.497","0.002","90","","90","","90","","2106.5","0.4","291","2","291","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H18 Fe2 O4 -","- C24 H18 Fe2 O4 -","- C96 H72 Fe8 O16 -","4","1","QA0027","Kempmann, Christoph; Grosser, Rolf; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","(3a<i>S</i>,4<i>S</i>)-(+)-[μ-1(<i>O</i>,4,5,α-η):2(1,2,3,3a,7a-η)-5-benzylidene-6,7-dihydro-4(5<i>H</i>)-indenone]tricarbonyl-1κ^3^<i>C</i>-[2(η^5^)-cyclopentadienyl]diiron","Acta Crystallographica Section C","1998","54","1","IUC9700033","","10.1107/S0108270198099880","","","0.71069","MoKα","","0.044","0.0297","","0.0734","0.0675","","","","1.041","1.062","1.062","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006954","8.06","0.002","5.9206","0.0009","22.638","0.006","90","","91.99","0.03","90","","1079.6","0.4","293","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ortho bis(selenocyanatato)xylene","αα'-diselenocyanatorthoxylene","","- C10 H8 N2 Se2 -","- C10 H8 N2 Se2 -","- C40 H32 N8 Se8 -","4","1","SK1107","McWhinnie, Sean L.W.; Brooks, Adam B.; Abrahams, Isaac","αα'-Diselenocyanato-<i>ortho</i>-xylene","Acta Crystallographica Section C","1998","54","1","126","128","10.1107/S0108270197012262","","","0.71069","MoKα","","0.0575","0.0428","","0.1327","0.1279","","","","0.986","1.066","1.066","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006955","4.488","0.0011","11.4945","0.0013","16.6699","0.0015","90","","92.868","0.003","90","","858.9","0.2","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H9 N O4 -","- C8 H9 N O4 -","- C32 H36 N4 O16 -","4","1","SK1113","Ülkü, Din ̧cer; Tahir, M. Nawaz; Demir, Ayhan S.; Aksoy-Çam, Hilal","Ethyl (<i>E</i>)-2-Furyl-2-(hydroxyimino)acetate","Acta Crystallographica Section C","1998","54","1","94","95","10.1107/S0108270197009852","","","0.71069","MoKα","","","0.061","","","0.063","","","","","0.91","0.91","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006956","12.504","0.003","5.575","0.001","14.45","0.002","90","","102.3","0.01","90","","984.2","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Cu N6 O2 S2 -","- C18 H20 Cu N6 O2 S2 -","- C36 H40 Cu2 N12 O4 S4 -","2","0.5","SK1119","Duan, Chun-ying; You, Xiao-Zeng; T.C.W. Mak","Bis(4-methoxybenzaldehyde thiosemicarbazonato-<i>S</i>,<i>N</i>^4^)copper(II)","Acta Crystallographica Section C","1998","54","1","31","33","10.1107/S0108270197012298","","","0.71073","MoKα","","0.0593","0.0389","","0.1321","0.1196","","","","1.068","1.098","1.098","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006957","10.13","0.001","31.398","0.002","10.7388","0.0009","90","","90.852","0.007","90","","3415.2","0.5","294","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","(Z)-3-Benzylidene-1-ethynyl-1-phenyl-1,3-dihydro- isobenzofuran","","- C23 H16 O -","- C23 H16 O -","- C184 H128 O8 -","8","2","SK1131","Thalji, Reema K.; Ramos, Bethzaida; Garcia, J. Gabriel; Fronczek, Frank R.","(<i>Z</i>)-3-Benzylidene-1-ethynyl-1-phenyl-1,3-dihydroisobenzofuran","Acta Crystallographica Section C","1998","54","1","109","111","10.1107/S0108270197012304","","","1.54184","CuKα","","","0.051","","","0.044","","","","","1.512","1.512","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006958","7.433","0.003","12.128","0.005","17.826","0.004","90","","90","","90","","1607","1","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4-Hydroxy-D-homo-17a-oxaandrost-4-ene-3,17-dione","","- C19 H26 O4 -","- C19 H26 O4 -","- C76 H104 O16 -","4","1","SK1137","Paixão, J. A.; Andrade, L. C. R.; de Almeida, M. J.; Tavares da Silva, E. J.; Sá e Melo, M. L.; Campos Neves, A. S.","4-Hydroxy-17a-oxa-17a-homoandrost-4-ene-3,17-dione","Acta Crystallographica Section C","1998","54","1","92","93","10.1107/S0108270197012316","","","0.71073","MoKα","","0.064","0.032","","0.078","","0.078","","","1.043","","","1.043","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006959","6.4806","0.0012","13.8928","0.0015","10.9886","0.0009","90","","92.738","0.01","90","","988.2","0.2","294","1","294","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,4-bis(2,2'-dipyrromethyl)benzene","1,4-bis(2,2'-dipyrromethyl)benzene","","- C24 H22 N4 -","- C24 H22 N4 -","- C48 H44 N8 -","2","0.5","SK1144","Bennis, Vanessa; Gallagher, John F.","N—Hπ(pyrrole) Intermolecular Interactions in 1,4-Bis(di-2-pyrrolylmethyl)benzene","Acta Crystallographica Section C","1998","54","1","130","132","10.1107/S0108270197012328","","","0.71073","MoKα","","0.218","0.058","","0.104","","0.104","","","0.829","","","0.829","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006960","9.8982","0.0001","20.4966","0.0002","9.7322","0.0001","90","","112.472","0.001","90","","1824.54","0.03","173","","173","","","","","","","","","4","C 1 c 1","C -2yc","9","","3-Methoxy-2,4,6-triphenylpyridine","","- C24 H19 N O -","- C24 H19 N O -","- C96 H76 N4 O4 -","4","1","SK1146","Bolte, Michael","3-Methoxy-2,4,6-triphenylpyridine at 173K","Acta Crystallographica Section C","1998","54","1","132","134","10.1107/S0108270197012778","","","0.71073","MoKα","","0.0331","0.0321","","0.0855","0.0841","","","","1.048","1.045","1.045","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006961","9.022","0.003","11.615","0.004","14.787","0.006","90","","99.44","0.04","90","","1528.6","1","295","1","295.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 Br N O3 -","- C16 H16 Br N O3 -","- C64 H64 Br4 N4 O12 -","4","1","SX1023","Rivera-Gandia, Joel; Morales, Neftali; Cox, Osvaldo; Huang, Songping D.","<i>N</i>-(<i>o</i>-Tolyl)-2-bromo-4,5-dimethoxybenzamide","Acta Crystallographica Section C","1998","54","1","69","71","10.1107/S0108270197011839","","","0.7107","MoKα","","","0.069","","","0.072","","","","","2.425","2.425","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006962","10.557","0.004","14.518","0.005","11.094","0.003","90","","104.51","0.02","90","","1646.1","1","295","1","295.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C15 H9 Br2 Cl N2 O2 S -","- C15 H9 Br2 Cl N2 O2 S -","- C60 H36 Br8 Cl4 N8 O8 S4 -","4","1","SX1024","Alarcòn, Riquelio; Cox, Osvaldo; Rivera, Luis A.; Huang, Songping D.","<i>erythro</i>-1-(Benzothiazol-2-yl)-1,2-dibromo-2-(2-chloro-5-nitrophenyl)ethane","Acta Crystallographica Section C","1998","54","1","68","69","10.1107/S0108270197011840","","","0.7107","MoKα","","","0.053","","","0.061","","","","","1.905","1.905","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006963","9.032","0.003","9.897","0.002","16.231","0.003","90","","90","","90","","1450.9","0.6","295","1","295.2","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 O5 -","- C16 H20 O5 -","- C64 H80 O20 -","4","1","SX1025","Richardson, Patricia L.; Rodríguez, Abimael D.; Boulanger, Anna; Huang, Songping D.","Methoxyamericanolide B","Acta Crystallographica Section C","1998","54","1","66","68","10.1107/S0108270197011852","","","0.7107","MoKα","","","0.0504","","","0.0632","","","","","1.783","1.783","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006964","8.115","0.001","8.271","0.001","10.035","0.002","76.28","0.01","79.13","0.01","61.79","0.01","574.3","0.16","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H14 N2 O2 S -","- C10 H14 N2 O2 S -","- C20 H28 N4 O4 S2 -","2","1","SX1030","Ojala, Charles R.; Ojala, William H.; Pennamon, Shanieka Y.; Gleason, William B.","Conformational Polymorphs of Acetone Tosylhydrazone","Acta Crystallographica Section C","1998","54","1","57","60","10.1107/S0108270197011669","","","1.5418","CuKα","","","0.04","","","0.062","","","","","3.166","3.166","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006965","9.7369","0.0008","8.0691","0.0008","14.776","0.001","90","","96.037","0.007","90","","1154.48","0.17","173","","173.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H14 N2 O2 S -","- C10 H14 N2 O2 S -","- C40 H56 N8 O8 S4 -","4","1","SX1030","Ojala, Charles R.; Ojala, William H.; Pennamon, Shanieka Y.; Gleason, William B.","Conformational Polymorphs of Acetone Tosylhydrazone","Acta Crystallographica Section C","1998","54","1","57","60","10.1107/S0108270197011669","","","1.5418","CuKα","","","0.043","","","0.062","","","","","2.835","2.835","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006966","8.544","0.002","9.308","0.001","16.603","0.002","90","","98.21","0.01","90","","1306.9","0.4","173","2","173.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 N2 O2 S -","- C13 H18 N2 O2 S -","- C52 H72 N8 O8 S4 -","4","1","SX1031","Charles R. Ojala; William H. Ojala; William B. Gleason","By-products from the Preparation of Acetone Tosylhydrazone: 4,5-Dihydro-3,5,5-trimethyl-1-[(4-methylphenyl)sulfonyl]-1<i>H</i>-pyrazole and 1,2-Bis(<i>p</i>-toluenesulfono)hydrazide","Acta Crystallographica Section C","1998","54","1","60","63","10.1107/S0108270197011670","","","1.5418","CuKα","","","0.052","","","0.073","","","","","1.62","1.62","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006967","15.785","0.001","10.7397","0.0009","9.492","0.002","90","","90.168","0.01","90","","1609.1","0.4","296","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 N2 O4 S2 -","- C14 H16 N2 O4 S2 -","- C56 H64 N8 O16 S8 -","4","1","SX1031","Charles R. Ojala; William H. Ojala; William B. Gleason","By-products from the Preparation of Acetone Tosylhydrazone: 4,5-Dihydro-3,5,5-trimethyl-1-[(4-methylphenyl)sulfonyl]-1<i>H</i>-pyrazole and 1,2-Bis(<i>p</i>-toluenesulfono)hydrazide","Acta Crystallographica Section C","1998","54","1","60","63","10.1107/S0108270197011670","","","1.5418","CuKα","","","0.082","","","0.121","","","","","2.06","2.06","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006968","8.268","0.001","8.483","0.001","10.802","0.002","108.85","0.02","101.33","0.02","111.43","0.01","623.4","0.2","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H16 N2 O2 S -","- C12 H16 N2 O2 S -","- C24 H32 N4 O4 S2 -","2","1","SX1033","William H. Ojala; William B. Gleason","Cyclopentanone Tosylhydrazone and Cyclohexanone Tosylhydrazone","Acta Crystallographica Section C","1998","54","1","63","66","10.1107/S0108270197011682","","","1.5418","CuKα","","","0.0453","","","0.0583","","","","","2.656","2.656","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006969","10.1893","0.0008","11.0454","0.0008","6.1106","0.0005","99.258","0.006","93.769","0.007","75.799","0.005","657.77","0.09","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H18 N2 O2 S -","- C13 H18 N2 O2 S -","- C26 H36 N4 O4 S2 -","2","1","SX1033","William H. Ojala; William B. Gleason","Cyclopentanone Tosylhydrazone and Cyclohexanone Tosylhydrazone","Acta Crystallographica Section C","1998","54","1","63","66","10.1107/S0108270197011682","","","1.5418","CuKα","","","0.0342","","","0.0385","","","","","2.194","2.194","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006970","10.236","0.002","10.258","0.002","18.827","0.004","90","","105.1","0.02","90","","1908.6","0.7","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 O3 -","- C24 H22 O3 -","- C96 H88 O12 -","4","1","SX1041","Ray, Suprabhat; Sarkhel, Sanjay; Maulik, Prakas R.; Lobkovsky, Emil; Clardy, Jon","7-Methoxy-2,2-dimethyl-3-phenyl-4-(4-hydroxyphenyl)-2<i>H</i>-1-benzopyran","Acta Crystallographica Section C","1998","54","1","134","136","10.1107/S0108270197012341","","","1.54178","CuKα","","0.0436","0.0362","","0.1021","0.0953","","","","1.071","1.086","1.086","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006971","4.606","0.001","4.606","0.001","9.348","0.002","90","","90","","120","","171.75","0.06","295","","295","","","","","","","","","4","P -6 2 m","P -6 -2","189","","","","- Al2.03 B4 La O10.54 -","- Al2.028 B4 La O10.54 -","- Al2.028 B4 La O10.54 -","1","0.0833333","TA1153","Yang, P.; Yu, Wentao; Wang, J.Y.; Wei, J.Q.; Liu, Y.G.","LaAl~2.03~(B~4~O~10~)O~0.54~","Acta Crystallographica Section C","1998","54","1","11","12","10.1107/S010827019701072X","","","0.71073","MoKα","","0.0373","0.0247","","0.119","0.063","","","","1.091","1.091","1.091","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006972","7.675","0.001","25.4","0.007","7.27","0.002","90","","90","","90","","1417.3","0.6","295.2","","295.2","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C9 H15 Cl N4 O4 Pt -","- C9 H15 Cl N4 O4 Pt -","- C36 H60 Cl4 N16 O16 Pt4 -","4","1","TA1154","Restrepo, Gerson F.; Barnes, Charles L.; Cádiz, Mayra E.; Olivero, Eneida; Huang, Songping D.","<i>cis</i>-Diamminechloro(2,5-dimethylbenzoxazole-<i>N</i>^1^)platinum(II) Nitrate","Acta Crystallographica Section C","1998","54","1","15","16","10.1107/S0108270197011116","","","0.7107","MoKα","","","0.029","","","0.033","","","","","1.282","1.282","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006973","10.94","0.001","10.94","0.001","10.94","0.001","90","","90","","90","","1309.4","0.3","293","2","293","2","","","","","","","","5","P m -3 m","-P 4 2 3","221","","","","- H54 Mo12 N3 O61 P -","- Mo12 N15 O53 P -","- Mo12 N15 O53 P -","1","0.0208333","","Xu, Yan; Xu, Ji-Qing; Yang, Guo-Yu; Yang, Guang-Di; Xing, Yan; Lin, Yong-Hua; Jia, Heng-Qing","(NH~4~)~3~[PMo~12~O~40~].21H~2~O","Acta Crystallographica Section C","1998","54","1","9","11","10.1107/S0108270197011128","","","","","","","0.0591","","","0.138","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2006974","7.885","0.001","7.885","0.001","6.727","0.001","90","","90","","120","","362.21","0.08","293","2","293","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Ga3 O7 P -","- Ga3 O7 P -","- Ga9 O21 P3 -","3","0.166667","","Sophie Boudin; Kwang-Hwa Lii","Ga~3~PO~7~","Acta Crystallographica Section C","1998","54","","05","07","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006975","7.1486","0.0014","11.163","0.002","10.145","0.002","90","","90","","90","","809.6","0.3","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- Fe1.78 Ge2.11 Mg0.11 O9 Pb2 -","- Fe1.786 Ge2.107 Mg0.107 O9 Pb2 -","- Fe7.144 Ge8.428 Mg0.428 O36 Pb8 -","4","0.5","","Barbier, Jacques; Lévy, David","Pb~2~Fe~2~Ge~2~O~9~, the Germanate Analogue of the Silicate Mineral Melanotekite","Acta Crystallographica Section C","1998","54","","02","05","","","","","","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2006976","8.815","0.001","10.905","0.001","13.21","0.002","95.46","0.01","108.26","0.01","107.74","0.01","1122.8","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(C-meso-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-N- acetato-N,N',N'',N''',O)copper(II) Bromide Monohydrate","","- C18 H39 Br Cu N4 O3 -","- C18 H39 Br Cu N4 O3 -","- C36 H78 Br2 Cu2 N8 O6 -","2","1","TA1176","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Chung, Chung-Sun; Chen, Yuan-Jang; Kwan, Keh-Shin","(<i>C</i>-<i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-<i>N</i>^1^-acetato-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''',<i>O</i>)copper(II) Bromide Monohydrate","Acta Crystallographica Section C","1998","54","1","25","27","10.1107/S010827019701113X","","","0.71073","MoKα","","0.083","0.048","","0.123","0.106","","","","1.024","1.073","1.073","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006977","10.174","0.003","11.482","0.003","15.583","0.003","87.23","0.02","87.63","0.02","66.21","0.02","1663.3","0.8","293","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C52 H64 Fe2 N20 Nd2 O16 -","- C52 H64 Fe2 N20 Nd2 O16 -","- C52 H64 Fe2 N20 Nd2 O16 -","1","0.5","TA1180","Yi, Tao; Gao, Song; Chen, Xiong-Wei; Yan, Chun-Hua; Li, Biao-Guo","A Cyano-Bridged Ionic Pair Complex: [FeNd~2~(CN)~6~(C~10~H~8~N~2~)~4~(H~2~ O)~8~][Fe(CN)~6~].8H~2~O","Acta Crystallographica Section C","1998","54","1","41","43","10.1107/S0108270197012675","","","0.71073","MoKα","","0.0331","0.0276","","","","0.07","","","","","","1.052","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006978","13.451","0.003","14.746","0.003","9.402","0.003","90","","90","","90","","1864.9","0.8","299","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","trans-Bis(acetylacetonato)(3-methylpyridine)nitrocobalt(III)","","- C16 H21 Co N2 O6 -","- C16 H21 Co N2 O6 -","- C64 H84 Co4 N8 O24 -","4","0.5","TA1185","Miyazaki, Hiroki; Tsuchimoto, Masanobu; Ohba, Shigeru","<i>trans</i>-Bis(acetylacetonato-<i>O</i>,<i>O</i>')(3-methylpyridine-<i>N</i>)nitrocobalt(III)","Acta Crystallographica Section C","1998","54","1","46","47","10.1107/S0108270197012699","","","0.71073","MoKα","","","0.048","","","0.041","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006979","6.251","0.0011","8.187","0.002","11.784","0.002","91.43","0.02","94.74","0.02","90.56","0.02","600.8","0.2","293","1","293","1","","","","","","","","4","P -1","-P 1","2","","","","- C12 H10 Br2 O3 -","- C12 H10 Br2 O3 -","- C24 H20 Br4 O6 -","2","1","TA1186","Gable, Robert W.; Lowe, David A.; Tsanaktsidis, John","<i>endo</i>-2,4-Dibromo-3a,4,7,7a-tetrahydro-4,7-methanoindene-1,8-dione 8-Ethylene Acetal","Acta Crystallographica Section C","1998","54","1","151","152","10.1107/S010827019701278X","","","0.71073","MoKα","","0.0488","0.0345","","0.0875","0.0808","","","","1.073","1.115","1.115","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006980","10.694","0.001","13.481","0.001","15.307","0.002","90","","94.32","0.01","90","","2200.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(±)- 7,7,9,9-tetramethyl-2,3:4,5-di(naphtho)-1,6,8-trioxa- 7,9-disila-cyclonona-2,4-diene","","- C24 H24 O3 Si2 -","- C24 H24 O3 Si2 -","- C96 H96 O12 Si8 -","4","1","VJ1062","Qiancai Liu; Mengxian Ding; Yonghua Lin; Yan Xing","(±)-7,7,9,9-Tetramethyl-2,3:4,5-dinaphtho-1,6,8-trioxa-7,9-disilacyclonona-2,4-diene","Acta Crystallographica Section C","1998","54","1","145","146","10.1107/S0108270197010317","","","0.71073","MoKα","","0.0713","0.0404","","0.1637","0.1217","","","","0.489","0.479","0.479","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006981","10.88","0.004","8.875","0.003","11.845","0.005","90","","100.89","0.06","90","","1123.2","0.8","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S),(E)-5-Methoxycarbonyl-3-triphenylmethylaminohex-4-en-4-olide","","- C27 H25 N O4 -","- C27 H26 N O4 -","- C54 H52 N2 O8 -","2","1","AB1492","Nastopoulos, Vassilios; Athanassopoulos, Constantinos; Papaioannou, Dionissios; Francis, George W.; Kavounis, Constantin; (S),(E)-5-Methoxycarbonyl-3-triphenylmethylaminohex-4-en-4-olide","(<i>S</i>),(<i>E</i>)-5-Methoxycarbonyl-3-triphenylmethylaminohex-4-en-4-olide","Acta Crystallographica Section C","1998","54","2","267","269","10.1107/S0108270197009128","","","0.71069","MoKα","","0.084","0.061","","0.158","","0.142","","","1.079","","","1.153","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006982","10.301","0.003","4.8869","0.0012","11.51","0.002","90","","91.102","0.019","90","","579.3","0.2","122","2","122","2","","","","","","","","4","C 1 2 1","C 2y","5","Cyclothreonine","(4S,5R)-4-Amino-5-methyl-3-isoxazolidinone","","- C4 H9 N2 O2.5 -","- C4 H9 N2 O2.5 -","- C16 H36 N8 O10 -","4","1","AB1493","Anthoni, Uffe; Fatum, Tine Muxoll; Flensburg, Claus","Cyclothreonine at 122K","Acta Crystallographica Section C","1998","54","2","240","242","10.1107/S0108270197013887","","","1.54184","CuKα","","0.0254","0.0253","","0.0664","0.0663","","","","1.084","1.085","1.085","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006983","6.9732","0.0011","25.252","0.003","9.678","0.0011","90","","93.386","0.01","90","","1701.2","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H21 B9 Mo O2 S -","- C9 H21 B9 Mo O2 S -","- C36 H84 B36 Mo4 O8 S4 -","4","1","AB1502","Johansen, Kjeld; Rosair, Georgina M.; Weller, Andrew S.; Welch, Alan J.","3-(η^3^-Allyl)-3,3-dicarbonyl-4-(dimethyl sulfido)-3,1,2-molybdadicarba-<i>closo</i>-dodecaborane(12)","Acta Crystallographica Section C","1998","54","2","214","217","10.1107/S0108270197011372","","","0.71073","MoKα","","0.1213","0.048","","0.1413","0.0895","","","","1.03","1.008","1.008","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006984","4.8789","0.001","15.011","0.003","9.2835","0.0019","90","","99.46","0.03","90","","670.7","0.2","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","Keto[14]aneS~4~","1,4,8,11-Tetrathiacyclotetradecan-6-one","","- C10 H18 O S4 -","- C10 H18 O S4 -","- C20 H36 O2 S8 -","2","1","AB1526","Blake, Alexander J.; Li, Wan-Sheung; Sutton, Liam R.; Schröder, Martin","1,4,8,11-Tetrathiacyclotetradecan-6-one","Acta Crystallographica Section C","1998","54","2","245","247","10.1107/S0108270197017423","","","0.71073","MoKα","","0.0218","0.0204","","","","0.0519","","","","","","1.111","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006985","9.3482","0.0002","7.0493","0.0003","18.0924","0.0007","90","","90","","90","","1192.26","0.07","161","2","161","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C11 H16 Cl N O2 -","- C11 H16 Cl N O2 -","- C44 H64 Cl4 N4 O8 -","4","1","","Morimoto, Bruce H.; Lovell, Scott; Kahr, Bart","Ecstasy: 3,4-Methylenedioxymethamphetamine (MDMA)","Acta Crystallographica Section C","1998","54","2","229","231","10.1107/S0108270197012390","","","","","","","","","","","","","","","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006986","13.705","0.002","32.939","0.004","11.6224","0.0013","90","","90","","90","","5246.7","1.2","293","2","293","2","","","","","","","","6","P c a b","-P 2bc 2ac","61","","bis(dimethylamine)-trichloro-tris(tert-butyloxy)-ditungsten","","- C16 H41 Cl3 N2 O3 W2 -","- C16 H41 Cl3 N2 O3 W2 -","- C128 H328 Cl24 N16 O24 W16 -","8","1","BK1344","Malcolm H. Chisholm; Kirsten Folting; De-Dong Wu","A Dinuclear Tungsten(III) Complex Containing a Tungsten‒Tungsten Triple Bond with an Asymmetric Arrangement of Ligands: [W~2~Cl~3~(OCMe~3~)~3~(NHMe~2~)~2~]","Acta Crystallographica Section C","1998","54","2","225","227","10.1107/S010827019700872X","","","0.71069","MoKα","","0.059","0.039","","0.094","0.0844","","","","1.14","1.19","1.19","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2006987","21.311","0.004","3.908","0.0008","27.581","0.006","90","","97.49","0.03","90","","2277.4","0.8","163","2","163","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C12 H6 Cl2 S2 -","- C12 H6 Cl2 S2 -","- C96 H48 Cl16 S16 -","8","1","BK1346","Chang, Ning-Leh; Thomas, Stewart N.; Lynch, Vincent M.; Simonsen, Stanley H.","2,7-Dichlorothianthrene","Acta Crystallographica Section C","1998","54","2","266","267","10.1107/S0108270197012018","","","0.71073","MoKα","","0.043","0.032","","0.085","0.081","","","","1.05","1.112","1.112","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006988","12.89","0.006","11.187","0.004","29.565","0.013","90","","90","","90","","4263","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-Methyl-1,5-dinitro-3-azabicyclo[3.3.1]non-7-ene","","- C9 H13 N3 O4 -","- C9 H13 N3 O4 -","- C144 H208 N48 O64 -","16","2","BM1120","Shishkin, O. V.; Atroschenko, Yu. M.; Gitis, S. S.; Alifanova, E. N.; Shakhkeldyan, I. V.","3-Methyl-1,5-dinitro-3-azabicyclo[3.3.1]non-7-ene","Acta Crystallographica Section C","1998","54","2","271","273","10.1107/S0108270197013279","","","0.71073","MoKα","","0.2209","0.0802","","0.3034","0.1457","","","","1.094","1.365","1.365","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006989","13.803","0.003","10.78","0.016","17.272","0.007","90","","90","","90","","2570","4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H8 N2 O5 S -","- C13 H8 N2 O5 S -","- C104 H64 N16 O40 S8 -","8","1","BM1162","Brigas, Amadeu F.; Goncalves, Pedro M.; Johnstone, Robert A.W.","Electronic Effects on C—O—C Ether Bonds in 3-Aryloxy Derivatives of Benzisothiazole 1,1-Dioxides: Rapid Ethanolysis of 3-(4-Nitrophenoxy)-1,2-benzisothiazole 1,1-Dioxide, (1), to give 3-Ethoxy-1,2-benzisothiazole 1,1-Dioxide, (2)","Acta Crystallographica Section C","1998","54","2","251","253","10.1107/S010827019701353X","","","0.71073","MoKα","","0.0766","0.0392","","","","0.1067","","","","","","1.023","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006990","7.149","0.004","8.178","0.005","16.556","0.003","90","","93.15","0.03","90","","966.5","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H9 N O3 S -","- C9 H9 N O3 S -","- C36 H36 N4 O12 S4 -","4","1","BM1162","Brigas, Amadeu F.; Goncalves, Pedro M.; Johnstone, Robert A.W.","Electronic Effects on C—O—C Ether Bonds in 3-Aryloxy Derivatives of Benzisothiazole 1,1-Dioxides: Rapid Ethanolysis of 3-(4-Nitrophenoxy)-1,2-benzisothiazole 1,1-Dioxide, (1), to give 3-Ethoxy-1,2-benzisothiazole 1,1-Dioxide, (2)","Acta Crystallographica Section C","1998","54","2","251","253","10.1107/S010827019701353X","","","0.71073","MoKα","","0.0894","0.0441","","","","0.1079","","","","","","1.025","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006991","8.8328","0.0002","9.4173","0.0002","16.1617","0.0003","96.941","0.001","98.159","0.001","101.396","0.001","1289.06","0.05","153","2","150","2","","","","","","","","6","P -1","-P 1","2","","1-(N-triphenylphosphinegold)-amino-anthracene-9,10-dione","","- C32 H23 Au N O2 P -","- C32 H23 Au N O2 P -","- C64 H46 Au2 N2 O4 P2 -","2","1","BM1166","Churakov, Andrei V.; Kuz'mina, Lyudmila G.; Howard, Judith A. K.","(9,10-Dioxo-9,10-dihydro-1-anthrylaminato-<i>N</i>)(triphenylphosphine-<i>P</i>)gold","Acta Crystallographica Section C","1998","54","2","212","214","10.1107/S0108270197012985","","","0.71073","MoKα","","0.031","0.025","","0.064","0.055","","","","1.12","1.119","1.119","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2006992","21.511","0.005","21.511","0.005","6.369","0.009","90","","90","","120","","2552","4","150","2","150","2","","","","","","","","6","R 3 :H","R 3","146","","6-α-Chloro-3-α-Hydroximethyl-2,2-Dimethyl-Penam-1,1-Dioxide,","","- C8 H12 Cl N O4 S -","- C8 H12 Cl N O4 S -","- C72 H108 Cl9 N9 O36 S9 -","9","1","BM1175","Andres E. Goeta; Carlos E. Boschetti; Oreste Mascaretti; Graciela Punte","6α-Chloro-3α-hydroxymethyl-2,2-dimethylpenam 1,1-Dioxide","Acta Crystallographica Section C","1998","54","2","242","244","10.1107/S0108270197013103","","","0.71073","MoKα","","0.0291","0.0227","","0.0601","0.0582","","","","1.062","1.074","1.074","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006993","9.766","0.002","16.184","0.003","13.456","0.002","90","","100.82","0.02","90","","2089","0.7","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3,3,2'-Tetramethylspiro[indoline-2,3'-[3H]phenanthro[9,10-b][1,4]oxazine]","","- C27 H24 N2 O -","- C27 H24 N2 O -","- C108 H96 N8 O4 -","4","1","BM1186","Liang, Yong-Chao; Chen, Xue-An; Zhao, Ling; Zhang, Qi-Yuan; Chen, Jian-Xin; Ming, Yang-Fu; Fan, Mei-Gong","1,3,3-Trimethylindoline-2-spiro-2'-3'-methyl-2'<i>H</i>-phenanthro[9,10-<i>b</i>][1,4]oxazine","Acta Crystallographica Section C","1998","54","2","279","281","10.1107/S0108270197014637","","","0.71073","MoKα","","","0.0398","","0.1086","0.1011","","","","0.946","1.098","1.098","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006994","5.624","0.0011","7.765","0.002","8.569","0.002","73.85","0.03","83.62","0.03","88.93","0.03","357.19","0.15","150","0.2","150","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H7 N O3 -","- C7 H7 N O3 -","- C14 H14 N2 O6 -","2","1","BM1194","Despinoy, Xavier L.M.; Harris, Steven G.; McNab, Hamish; Parsons, Simon; Withell, Kirsti","The Effect of 3-Substitution on the Structures of Pyrrole-2-carbaldehydes","Acta Crystallographica Section C","1998","54","2","231","233","10.1107/S0108270197014649","","","0.71073","MoKα","","0.0674","0.0464","","0.1287","0.1124","","","","1.054","1.095","1.095","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006995","6.9093","0.0009","12.38","0.002","7.3256","0.0011","90","","107.781","0.01","90","","596.68","0.16","220","0.2","220","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H7 N O2 -","- C6 H7 N O2 -","- C24 H28 N4 O8 -","4","1","BM1194","Despinoy, Xavier L.M.; Harris, Steven G.; McNab, Hamish; Parsons, Simon; Withell, Kirsti","The Effect of 3-Substitution on the Structures of Pyrrole-2-carbaldehydes","Acta Crystallographica Section C","1998","54","2","231","233","10.1107/S0108270197014649","","","1.54184","CuKα","","0.0583","0.0422","","0.1027","0.095","","","","1.097","1.175","1.175","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2006996","6.355","0.0009","6.355","0.0009","4.449","0.0009","90","","90","","90","","179.68","0.05","293","2","293","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- Li2 O5 Si V -","- Li2 O5 Si V -","- Li4 O10 Si2 V2 -","2","0.125","BR1196","Rangan, Krishnaswamy Kasthuri; Piffard, Yves; Joubert, Olivier; Tournoux, Michel","Li~2~VOSiO~4~: a Natisite-Type Structure","Acta Crystallographica Section C","1998","54","2","176","177","10.1107/S0108270197014650","","","0.71073","MoKα","","0.0974","0.0453","","0.088","0.0771","","","","1.016","1.119","1.119","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2006997","15.476","0.003","6.649","0.001","24.08","0.005","90","","93.42","0.02","90","","2473.4","0.8","293","2","293","2","","","","","","","","5","I 1 2/c 1","-I 2yc","15","","poly[N-(2-aminoethyl)-N-methyl-1,2-ethanediamine-κ^3^N]-μ-isothiocyanato- N:S-isothiocyanatonickel(II)","","- C7 H15 N5 Ni S2 -","- C7 H15 N5 Ni S2 -","- C56 H120 N40 Ni8 S16 -","8","1","CF1171","Nirmalya P. Nayak; Alok K. Mukherjee; Arunendu Mondal; Nirmalendu Ray Chaudhuri","A Polymeric Nickel(II) Thiocyanate Complex of <i>N</i>-(2-Aminoethyl)-<i>N</i>-methyl-1,2-ethanediamine","Acta Crystallographica Section C","1998","54","2","208","210","10.1107/S0108270197013280","","","0.71069","MoKα","","0.0436","0.0406","","0.1108","0.108","","","","1.081","1.116","1.116","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006998","8.665","0.001","12.503","0.002","16.306","0.002","90","","94.03","0.01","90","","1762.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","","","","2-(2-hydroxy-3-methoxy-5-sulfo-phenyl)-4H-1-benzopyran-4-one trihydrate","","- C16 H18 O10 S -","- C16 H18 O10 S -","- C64 H72 O40 S4 -","4","1","CF1187","Wallet, Jean-Claude; Habsaoui, Amar; Gaydou, Emile M.; Molins, Elies; Miravitlles, Carlos","2'-Hydroxy-3'-methoxy-5'-flavonesulfonic Acid Trihydrate: a New Zwitterion","Acta Crystallographica Section C","1998","54","2","247","249","10.1107/S0108270197014169","","","0.71069","MoKα","","0.146","0.041","","","0.101","","","","","0.944","0.944","","","","","has coordinates","281832","2023-03-13","07:43:06",""
"2006999","9.4818","0.0009","9.7365","0.0004","10.6089","0.001","93.469","0.008","113.697","0.005","97.89","0.008","881.08","0.13","220","0.2","220","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 O4 S -","- C18 H22 O4 S -","- C36 H44 O8 S2 -","2","1","CF1192","Gould, Robert O.; Harris, Steven G.; McNab, Hamish; Parsons, Simon; Withell, Kirsti","Two Methylsulfanylmethylene Derivatives of Meldrum's Acid","Acta Crystallographica Section C","1998","54","2","234","236","10.1107/S0108270197014170","","","1.5418","CuKα","","","0.0338","","","0.0402","","","","","1.1073","1.1073","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007000","6.137","0.008","7.17","0.008","15","0.03","79","0.08","84.36","0.11","83.08","0.08","641.3","1.7","150","0.2","150","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 O4 S2 -","- C11.681 H12 O4 S2 -","- C23.362 H24 O8 S4 -","2","1","CF1192","Gould, Robert O.; Harris, Steven G.; McNab, Hamish; Parsons, Simon; Withell, Kirsti","Two Methylsulfanylmethylene Derivatives of Meldrum's Acid","Acta Crystallographica Section C","1998","54","2","234","236","10.1107/S0108270197014170","","","0.71073","MoKα","","0.065","0.061","","0.187","0.18","","","","1.152","1.147","1.147","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007001","14.818","0.002","14.818","0.002","29.903","0.006","90","","90","","120","","5686.2","1.6","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","Chloro-tris(1,3-diphenyl-1,3-propanedionato)zirconium(IV)","","- C45 H33 Cl O6 Zr -","- C45 H33 Cl O6 Zr -","- C270 H198 Cl6 O36 Zr6 -","6","0.333333","CF1194","Janiak, Christoph; Scharmann, Tobias G.","The Racemic <i>C</i>~3~-Symmetrical Propeller Structure of Chlorotris(1,3-diphenyl-1,3-propanedionato-<i>O</i>,<i>O</i>')zirconium(IV)","Acta Crystallographica Section C","1998","54","2","210","212","10.1107/S0108270197014182","","","0.71069","MoKα","","0.025","0.024","","0.066","0.065","","","","1.085","1.087","1.087","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007002","13.459","0.004","9.2087","0.0015","15.883","0.005","90","","98.87","0.04","90","","1945","0.9","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","(pyrazolo[3,4-d]pyrimidin-1-yl)alkane","1,3-bis(5-methyl-6-methylthio-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-1-yl)propane","","- C17 H20 N8 O2 S2 -","- C17 H20 N8 O2 S2 -","- C68 H80 N32 O8 S8 -","4","1","CF1197","Maulik, Prakas R.; Avasthi, Kamlakar; Biswas, Goutam; Biswas, Sampa; Rawat, Diwan S.; Sarkhel, Sanjay; Chandra, Tilak; Bhakuni, D. S.","A Stacked Pyrazolo[3,4-<i>d</i>]pyrimidine-Based Flexible Molecule","Acta Crystallographica Section C","1998","54","2","275","277","10.1107/S0108270197013309","","","0.71073","MoKα","","0.0851","0.0404","","0.1213","0.0993","","","","0.956","1.117","1.117","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007003","13.058","0.003","8.677","0.001","21.842","0.003","90","","92.79","0.01","90","","2471.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(di-2-pyridylamine)(propionato)copper(II) Nitrate","","- C23 H23 Cu N7 O5 -","- C23 H23 Cu N7 O5 -","- C92 H92 Cu4 N28 O20 -","4","1","CF1199","Sujittra Youngme; Kamphone Chandavong; Chaveng Pakawatchai; Zhong-yuan Zhou; Hoong-Kun Fun","Bis(di-2-pyridyl-<i>N</i>-amine)(propionato-<i>O</i>)copper(II) Nitrate","Acta Crystallographica Section C","1998","54","2","199","201","10.1107/S0108270197014194","","","0.71073","MoKα","","0.0519","0.0376","","0.1053","0.0997","","","","0.984","1.093","1.093","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007004","31.919","0.005","9.399","0.002","11.26","0.003","90","","93.83","0.01","90","","3370.5","1.3","293","1","293","1","","","","","","","","4","C 1 2 1","C 2y","5","chasmaconitine","","","- C34.5 H49 N O9.5 -","- C34.5 H47 N O9.5 -","- C138 H188 N4 O38 -","4","1","FG1327","Parvez, Masood; Gul, Waseem; Anwar, Saeed; Miana, Ghulam A.; Atta-ur-Rahman; Choudhary, Mohammad I.","Chasmaconitine 0.5-Methanol Solvate","Acta Crystallographica Section C","1998","54","2","236","238","10.1107/S0108270197013450","","","1.54178","CuKα","","0.0692","0.0582","","0.1713","0.1574","","","","1.047","1.054","1.054","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007005","7.6575","0.0005","11.9173","0.0009","25.561","0.002","92.44","0.007","97.574","0.006","90.558","0.007","2309.9","0.3","293","1","293","1","","","","","","","","3","P -1","-P 1","2","","(4Z,10E,12Z)-[1R^*^,14S^*^]-1,8,8-Tris(methoxycarbonyl)-5-methyl-3,17- dioxobicyclo[12.3.0]heptadeca-4,10,12-triene","","- C24 H30 O8 -","- C24 H30 O8 -","- C96 H120 O32 -","4","2","FG1350","Drouin, Marc; Couturier, Michel; Deslongchamps, Pierre","Crystallographic Evidence of [1,5]Prototropic Shifts Occurring upon Transannular Diels‒Alder Reaction of a 14-Membered Macrocycle leading to a 5α-Steroid Skeleton","Acta Crystallographica Section C","1998","54","2","256","261","10.1107/S0108270197013310","","","1.54184","CuKα","","0.0644","0.0507","","0.1575","0.1375","","","","1.1","1.081","1.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007006","9.1783","0.001","10.5526","0.0013","13.657","0.002","108.201","0.01","101.221","0.009","98.791","0.009","1199.7","0.3","293","2","293","1","","","","","","","","3","P -1","-P 1","2","","rac-(5Z,11Z,13Z)-1,8,8-Tris(methoxycarbonyl)-5-methyl-3,17- dioxobicyclo[12.3.0]heptadeca-5,11,13-triene","","- C24 H30 O8 -","- C24 H29.97 O8 -","- C48 H59.94 O16 -","2","1","FG1350","Drouin, Marc; Couturier, Michel; Deslongchamps, Pierre","Crystallographic Evidence of [1,5]Prototropic Shifts Occurring upon Transannular Diels‒Alder Reaction of a 14-Membered Macrocycle leading to a 5α-Steroid Skeleton","Acta Crystallographica Section C","1998","54","2","256","261","10.1107/S0108270197013310","","","1.54184","CuKα","","0.0555","0.0462","","0.1551","0.1453","","","","0.997","1.079","1.079","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007007","8.0693","0.0009","10.9292","0.0005","24.951","0.002","90","","90","","90","","2200.5","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","rac-3,3-Bis(methoxycarbonyl)-18-oxo-5α,9β-androst-6-en-11,17-dione","","- C24 H30 O8 -","- C24 H30 O8 -","- C96 H120 O32 -","4","1","FG1350","Drouin, Marc; Couturier, Michel; Deslongchamps, Pierre","Crystallographic Evidence of [1,5]Prototropic Shifts Occurring upon Transannular Diels‒Alder Reaction of a 14-Membered Macrocycle leading to a 5α-Steroid Skeleton","Acta Crystallographica Section C","1998","54","2","256","261","10.1107/S0108270197013310","","","1.54184","CuKα","","0.0489","0.0487","","0.1162","0.1161","","","","1.253","1.255","1.255","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007008","6.9986","0.0004","12.1754","0.0006","53.584","0.003","90","","90","","90","","4565.9","0.4","293","2","293","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","rac-3,3-Bis(methoxycarbonyl)-18-oxo-5α-androst-6-en-11,17-dione","","- C24 H30 O8 -","- C24 H30 O8 -","- C192 H240 O64 -","8","2","FG1350","Drouin, Marc; Couturier, Michel; Deslongchamps, Pierre","Crystallographic Evidence of [1,5]Prototropic Shifts Occurring upon Transannular Diels‒Alder Reaction of a 14-Membered Macrocycle leading to a 5α-Steroid Skeleton","Acta Crystallographica Section C","1998","54","2","256","261","10.1107/S0108270197013310","","","1.54184","CuKα","","0.0803","0.0631","","0.1832","0.1641","","","","1.055","1.12","1.12","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007009","4.7","0.001","5.0228","0.0008","10.8995","0.0006","90","","90","0.01","90","","257.31","0.07","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","3-aminopyrazole-4-carboxylic acid","","","- C4 H5 N3 O2 -","- C4 H5 N3 O2 -","- C8 H10 N6 O4 -","2","1","FG1359","Dobson, Allison J.; Gerkin, Roger E.","Complex Network of Hydrogen Bonds in 3-Aminopyrazole-4-carboxylic Acid","Acta Crystallographica Section C","1998","54","2","253","256","10.1107/S0108270197013115","","","0.71073","MoKα","","","0.04","","","","0.082","","","","","","3.57","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007010","7.4118","0.0001","16.728","0.0003","13.5168","0.0001","90","","90.748","0.001","90","","1675.73","0.04","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,4'-dimethyl-2,2'-bipyridinetrichloromanganese(III) acetonitrile solvate","","- C14 H15 Cl3 Mn N3 -","- C14 H15 Cl3 Mn N3 -","- C56 H60 Cl12 Mn4 N12 -","4","1","FG1372","Abboud, Khalil A.; Ward, Brian H.; Talham, Daniel R.","Trichloro(4,4'-dimethyl-2,2'-bipyridine-<i>N</i>,<i>N</i>')manganese(III) Acetonitrile Solvate (1/1)","Acta Crystallographica Section C","1998","54","2","180","181","10.1107/S0108270197012419","","","0.71073","MoKα","","0.035","0.03","","0.081","0.076","","","","1.07","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007011","10.048","0.002","10.578","0.015","10.611","0.002","73.79","0.02","71.69","0.02","63.31","0.01","943.9","1.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H33 As Cl2 -","- C18 H33 As Cl2 -","- C36 H66 As2 Cl4 -","2","1","FG1394","Pascu, Sofia; Silaghi-Dumitrescu, Luminita; Blake, Alexander J.; Li, Wan-Sheung; Haiduc, Ionel; Sowerby, D. Bryan","<i>trans</i>-Dichlorotri(cyclohexyl)arsenic(V)","Acta Crystallographica Section C","1998","54","2","219","221","10.1107/S0108270197013334","","","0.71073","MoKα","","0.0236","0.0216","","","","0.0514","","","","","","1.077","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007012","14.8333","0.0008","7.601","0.0009","14.109","0.002","90","","90","","90","","1590.8","0.3","293","2","293","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","Cyclopentadienyltricarbonyltrimethylphosphinemolybdenum(II) tetrafluoroborate","","- C11 H14 B F4 Mo O3 P -","- C11 H14 B F4 Mo O3 P -","- C44 H56 B4 F16 Mo4 O12 P4 -","4","1","FR1063","Fettinger, James C.; Kraatz, Heinz-Bernhard; Poli, Rinaldo","Tricarbonyl(η^5^-cyclopentadienyl)(trimethylphosphine-<i>P</i>)molybdenum(II) Tetrafluoroborate","Acta Crystallographica Section C","1998","54","2","181","183","10.1107/S0108270197012651","","","0.71073","MoKα","","0.0805","0.033","","0.0813","0.0686","","","","1.048","1.118","1.118","","","","","has coordinates,has disorder","192303","2020-10-21","18:00:00",""
"2007013","14.622","0.002","17.901","0.003","6.908","0.001","92.43","0.01","90.88","0.01","92.35","0.01","1804.7","0.5","295","","","","","","","","","","","4","P -1","-P 1","2","","[N-(1-Adamantyl)acetamide]1/3(methanol-water) solvate","","- C12.3333 H21 N O1.6667 -","- C12.3333 H21 N O1.66667 -","- C74 H126 N6 O10 -","6","3","FR1075","Kashino, Setsuo; Tateno, Shuichi; Hamada, Noritaka; Haisa, Masao","Methanol‒Water Solvate of <i>N</i>-(1-Adamantyl)acetamide","Acta Crystallographica Section C","1998","54","2","273","274","10.1107/S0108270197013541","","","0.71073","MoKα","","","0.072","","","","0.064","","","","","","1.16","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007014","7.0367","0.0002","12.2343","0.0004","15.1467","0.0005","90","","103.202","0.001","90","","1269.5","0.07","173","","173","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","trans-Diaquobis(2-thienyl 2-pyridyl ketone-O, N)copper(II) tetrafluoroborate","","- C20 H18 B2 Cu F8 N2 O4 S2 -","- C20 H18 B2 Cu F8 N2 O4 S2 -","- C40 H36 B4 Cu2 F16 N4 O8 S4 -","2","0.5","FR1082","Sommerer, Shaun O.; Friebe, Timothy L.; Jircitano, Alan J.; MacBeth, Cora E.; Abboud, Khalil A.","<i>trans</i>-Diaquabis(2-thienyl 2-pyridyl ketone-<i>O</i>,<i>N</i>)copper(II) Tetrafluoroborate","Acta Crystallographica Section C","1998","54","2","178","179","10.1107/S0108270197014728","","","0.71073","MoKα","","0.063","0.057","","0.153","","0.146","","","1.061","","","1.06","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007015","5.4239","0.0005","7.1863","0.0009","8.1732","0.0008","88.86","0.009","71.254","0.008","81.261","0.009","298.03","0.06","295","2","295","2","","","","","","","","3","P -1","-P 1","2","Citraconic acid","2-methyl-2-butenedioic acid","","- C5 H6 O4 -","- C5 H6 O4 -","- C10 H12 O8 -","2","1","HA1205","Batchelor, Elaine; Jones, William","Citraconic Acid","Acta Crystallographica Section C","1998","54","2","238","240","10.1107/S0108270197014224","","","0.71069","MoKα","","0.0951","0.0489","","0.1574","0.1277","","","","0.973","1.003","1.003","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007016","13.776","0.003","13.262","0.003","24.964","0.01","90","","94.54","0.04","90","","4547","2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","μ^2^(2-thioxo-1,3-dithiole-4,5-dithiolate)bis(tri-p-metoxyphenyl phosphine)digold(I)","","- C45 H42 Au2 O6 P2 S5 -","- C45 H42 Au2 O6 P2 S5 -","- C180 H168 Au8 O24 P8 S20 -","4","1","JZ1240","Cerrada, Elena; Laguna, Mariano; Villacampa, M. Dolores","μ-(2-Thioxo-1,3-dithiole-4,5-dithiolato)-bis{[tris(<i>p</i>-methoxyphenyl)phosphine]gold(I)}","Acta Crystallographica Section C","1998","54","2","201","203","10.1107/S0108270197013346","","","0.71073","MoKα","","0.0631","0.0413","","0.0996","0.0868","","","","1.048","1.045","1.045","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007017","6.9449","0.0007","10.3618","0.0013","11.9715","0.0014","75.392","0.011","88.293","0.01","70.621","0.009","785.04","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aqua(2,3-dimethylpyridine)(N-salicylideneglycinato)copper(II)","","- C16 H18 Cu N2 O4 -","- C16 H18 Cu N2 O4 -","- C32 H36 Cu2 N4 O8 -","2","1","JZ1244","Warda, Salam A.","Aqua(2,3-dimethylpyridine-<i>N</i>)(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1998","54","2","187","189","10.1107/S010827019701305X","","","1.54178","CuKα","","0.0598","0.0488","","","","0.1399","","","","","","1.039","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007018","8.5214","0.0007","15.3737","0.0018","9.9845","0.0005","90","","100.905","0.005","90","","1284.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Polymeric Pyrazine-Bis[N-salicylideneglycinato-copper(II)]-1,4-dioxane","","- C26 H26 Cu2 N4 O8 -","- C26 H26 Cu2 N4 O8 -","- C52 H52 Cu4 N8 O16 -","2","0.5","JZ1247","Warda, Salam A.","<i>catena</i>-Poly[[(<i>N</i>-salicylideneglycinato-<i>N</i>,<i>O</i>,<i>O</i>')copper(II)-μ-pyrazine-<i>N</i>:<i>N</i>'-(<i>N</i>-salicylideneglycinato-<i>N</i>,<i>O</i>,<i>O</i>')copper(II)]-μ-1,4-dioxane-<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","1998","54","2","189","191","10.1107/S0108270197013061","","","0.71073","MoKα","","0.0414","0.0319","","","","0.0897","","","","","","1.08","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007019","12.36","0.002","17.042","0.003","25.08","0.005","90","","92.93","0.03","90","","5275.9","1.6","173","","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","μ-{7,8-Bis(diphenylphosphino)-7,8-dicarba-nido-undecaborato-P,P'}- pentafluorophenyltriphenylphosphinedigold(I) dichloromethane solvate","","- C51 H47 Au2 B9 Cl2 F5 P3 -","- C51 H47 Au2 B9 Cl2 F5 P3 -","- C204 H188 Au8 B36 Cl8 F20 P12 -","4","1","JZ1248","Crespo, Olga; Gimeno, M. Concepción; Laguna, Antonio; Villacampa, M. Dolores","μ-[7,8-Bis(diphenylphosphino)-7,8-dicarba-<i>nido</i>-undecaborato-1κ<i>P</i>,2κ<i>P</i>'](pentafluorophenyl-1κ<i>C</i>)(triphenylphosphine-2κ<i>P</i>)digold(I) Dichloromethane Solvate","Acta Crystallographica Section C","1998","54","2","203","205","10.1107/S0108270197013826","","","0.71073","MoKα","","0.0604","0.043","","0.1081","0.0987","","","","1.04","1.075","1.075","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007020","16.206","0.002","8.991","0.004","18.665","0.002","90","","102.91","0.02","90","","2650.9","1.3","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 O4 -","- C34 H32 O4 -","- C136 H128 O16 -","4","1","KA1242","Sybolt Harkema; Jan-Dirk van Loon; Willem Verboom; David N. Reinhoudt","15,17-Di-2-propenylcalix[4]arene-25,26,27,28-tetrol: Self-Complexation and C—H···O Interactions","Acta Crystallographica Section C","1998","54","2","269","271","10.1107/S0108270197010937","","","0.71073","MoKα","","0.184","0.096","","0.113","0.101","","","","0.817","1.073","1.073","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007021","12.117","0.002","12.324","0.002","13.508","0.003","90","","108.83","0.03","90","","1909.2","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,5-dihydroxiethyl-barbituric acid","","- C8 H12 N2 O5 -","- C8 H12 N2 O5 -","- C64 H96 N16 O40 -","8","2","LN1024","Irles, Nuria; Subirana, J.Antoni; Solans, Xavier","5,5-Dihydroxyethylbarbituric Acid","Acta Crystallographica Section C","1998","54","2","249","250","10.1107/S0108270197013899","","","0.71069","MoKα","","0.1201","0.0683","","0.2904","0.1951","","","","0.984","1.032","1.032","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007022","13.832","0.003","9.055","0.002","16.005","0.003","90","","104.52","0.02","90","","1940.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H16 Cr O4 -","- C23 H16 Cr O4 -","- C92 H64 Cr4 O16 -","4","1","LN1031","Hannesschlager, Patrick; Brun, Pierre; Pèpe, Gérard","Tricarbonyl[(4a,5,6,7,8,9-η)-2-methyl-2-phenyl-2<i>H</i>-benzo[<i>f</i>]chromen]chromium","Acta Crystallographica Section C","1998","54","2","221","223","10.1107/S0108270197014236","","","0.71073","MoKα","","0.0425","0.0414","","0.085","0.0847","","","","0.955","1.119","1.119","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007023","23.424","0.004","9.689","0.004","14.47","0.003","90","","90.53","0.02","90","","3283.9","1.6","293","","293","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C27 H31 Br2 N O S8 -","- C27 H31 Br2 N O S8 -","- C108 H124 Br8 N4 O4 S32 -","4","0.5","LN1035","Honda, Kazumasa; Takasaki, Satoshi; Yamada, Jun-ichi; Nakatsuji, Shin-ichi; Anzai, Hiroyuki","Tetramethyltetrathiafulvalenium Bromide Benzonitrile Water Solvate","Acta Crystallographica Section C","1998","54","2","261","264","10.1107/S0108270197013905","","","0.7107","MoKα","","0.1619","0.053","","0.0739","0.0597","","","","0","1.32","1.32","","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2007024","8.6342","0.0003","11.608","0.0005","13.384","0.001","91.988","0.005","108.291","0.005","95.861","0.003","1263.82","0.12","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(di-2-pyridyl-1-hydroxymethoxy)cobalt(III) Perchlorate Trihydrate","","- C22 H24 Cl Co N4 O11 -","- C22 H24 Cl Co N4 O11 -","- C44 H48 Cl2 Co2 N8 O22 -","2","1","LN1036","Tong, Ming-Liang; Yang, Guang; Chen, Xiao-Ming; Ng, Seik Weng","Bis[di-2-pyridylmethanediolato(1‒)-<i>N</i>,<i>O</i>,<i>N</i>']cobalt(III) Perchlorate Trihydrate","Acta Crystallographica Section C","1998","54","2","217","219","10.1107/S0108270197013358","","","0.71073","MoKα","","0.0404","0.0325","","0.0826","0.0778","","","","1.061","1.082","1.082","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007025","9.672","0.001","15.698","0.002","9.04","0.002","104.48","0.01","105.07","0.01","88.53","0.01","1282.1","0.4","297","","","","","","","","","","","5","P -1","-P 1","2","","dimethanolatotetrakis(μ-4-chlorophenoxyisobutyrato-O:O')dicopper(II) dimethanol solvate","","- C44 H56 Cl4 Cu2 O16 -","- C44 H56 Cl4 Cu2 O16 -","- C44 H56 Cl4 Cu2 O16 -","1","0.5","LN1037","Kani, Yoshiyuki; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","A Dimeric Copper(II) 4-Chlorophenoxyisobutyrate Adduct with Methanol and a Monomeric Copper(II) 4-Chlorophenoxyisobutyrate Adduct with Pyridine","Acta Crystallographica Section C","1998","54","2","193","195","10.1107/S0108270197012973","","","0.71073","MoKα","","","0.046","","","0.042","","","","","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007026","6.728","0.002","16.958","0.001","13.388","0.002","90","","101.38","0.02","90","","1497.5","0.5","299","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-bis(pyridine)bis(4-chlorophenoxyisobutyrato-O,O')copper(II)","","- C30 H30 Cl2 Cu N2 O6 -","- C30 H30 Cl2 Cu N2 O6 -","- C60 H60 Cl4 Cu2 N4 O12 -","2","0.5","LN1037","Kani, Yoshiyuki; Ohba, Shigeru; Matsushima, Hideaki; Tokii, Tadashi","A Dimeric Copper(II) 4-Chlorophenoxyisobutyrate Adduct with Methanol and a Monomeric Copper(II) 4-Chlorophenoxyisobutyrate Adduct with Pyridine","Acta Crystallographica Section C","1998","54","2","193","195","10.1107/S0108270197012973","","","0.71073","MoKα","","","0.043","","","0.048","","","","","1.34","1.34","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007027","16.825","0.004","16.658","0.003","17.162","0.005","90","0.02","102.18","0.02","90","0.02","4702","2","122","2","122","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-bis(1,2-bis(diphenylphosphino)ethane)-hydroxo-oxo-molybdenum(IV) perchlorate","","- C52 H49 Cl Mo O6 P4 -","- C52 H49 Cl Mo O6 P4 -","- C208 H196 Cl4 Mo4 O24 P16 -","4","1","LN1040","Bendix, Jesper; Bøgevig, Anders","<i>trans</i>-[Mo(O)(OH)(dppe)~2~]^+^ as its Perchlorate Salt","Acta Crystallographica Section C","1998","54","2","206","208","10.1107/S010827019701336X","","","0.71073","MoKα","","0.0506","0.0364","","0.0842","","0.0842","","","1.035","","","1.035","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007028","6.879","0.002","14.004","0.003","9.504","0.001","90","","91.37","0.02","90","","915.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Complexe de Cuivre(II) di(Nitriloacétatodiacétique) Dihydrate","","- C12 H20 Cu N2 O14 -","- C12 H20 Cu N2 O14 -","- C24 H40 Cu2 N4 O28 -","2","0.5","MU1346","Ben Amor, Fatma; Bourguiba, Néji; Driss, Ahmed; Jouini, Tahar","Complexe de Cuivre(II) Di(nitriloacétatodiacétique) Dihydrate, [Cu(C~6~H~8~NO~6~)~2~].2H~2~O","Acta Crystallographica Section C","1998","54","2","197","199","10.1107/S0108270197011402","","","0.71069","MoKα","","0.0691","0.0422","","0.0898","0.0801","","","","1.093","1.163","1.163","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007029","9.545","0.002","16.271","0.004","22.797","0.003","90","","90","","90","","3540.5","1.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2R,3R)-2,3-dibenzyloxy-1,4-bis(diphenylphosphino)butane","","- C42 H40 O2 P2 -","- C42 H40 O2 P2 -","- C168 H160 O8 P8 -","4","1","NA1325","Matos Beja, A.; Paixão, J. A.; Ramos Silva, M.; Alte da Veiga, L.; Gonsalves, A. M. A. D'A. Rocha; Pereira, M. M.; Serra, M. Elisa Silva","(2<i>R</i>,3<i>R</i>)-2,3-Dibenzyloxy-1,4-bis(diphenylphosphino)butane","Acta Crystallographica Section C","1998","54","2","264","266","10.1107/S0108270197014248","","","0.71073","MoKα","","0.1191","0.0363","","","0.0741","0.0923","","","","","","1.016","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007030","16.325","0.003","16.325","0.003","35.135","0.005","90","","90","","120","","8109","2","293","2","293","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Sodium potassium gallium intermetallic compound","","- Ga47.45 K4 Na13 -","- Ga47.452 K4 Na13 -","- Ga284.712 K24 Na78 -","6","0.166667","OH1104","Flot, D.; Vincent, L.; Tillard-Charbonnel, M.; Belin, C.","Na~13~K~4~Ga~47.45~: a New Sodium Potassium Gallide Phase Containing Trimeric Icosahedral Gallium Clusters","Acta Crystallographica Section C","1998","54","2","174","175","10.1107/S0108270197015977","","","0.7107","MoKα","","0.0577","0.0536","","0.1376","0.1355","","","","1.071","1.101","1.101","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007031","10.184","0.001","10.941","0.001","13.441","0.001","84.8","0.02","67.94","0.02","82.65","0.02","1375.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H26 N2 O4 S2 -","- C30 H26 N2 O4 S2 -","- C60 H52 N4 O8 S4 -","2","1","PT1051","Govindasamy, Lakashmanan; Velmurugan, D.; Ravikumar, K.; Mohanakrishnan, A. K.","4-Benzyl-2,9-bis(phenylsulfonyl)-1,2,3,4-tetrahydro-9<i>H</i>-β-carboline","Acta Crystallographica Section C","1998","54","2","277","279","10.1107/S0108270197011268","","","0.71073","MoKα","","0.133","0.061","","0.192","0.143","","","","0.963","0.997","0.997","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007032","36.858","0.005","6.5975","0.001","12.145","0.002","90","","101.255","0.01","90","","2896.5","0.8","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,3-Dihydro-8-hydroxy-5,7-dimethoxy-2-phenyl-4H-1-benzopyran-4-one","","- C17 H16 O5 -","- C17 H16 O5 -","- C136 H128 O40 -","8","1","QA0028","Kan Chantrapromma; Vatcharee Seechamnanturakit; Chaveng Pakawatchai; Suchada Chantrapromma; Kandasamy Chinnakali; Hoong-Kun Fun","2,3-Dihydro-8-hydroxy-5,7-dimethoxy-2-phenyl-4<i>H</i>-1-benzopyran-4-one and 3,3,6-Tribromo-2,3-dihydro-8-hydroxy-5,7-dimethoxy-2-phenyl-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section C","1998","54","2","IUC9800001","","10.1107/S0108270198099843","","","0.71073","MoKα","","0.1339","0.0881","","0.3289","0.3023","","","","1.12","1.426","1.426","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007033","8.945","0.003","8.664","0.002","47.029","0.009","90","","90","","90","","3644.7","1.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,3-Dihydro-8-hydroxy-5,7-dimethoxy-3,3,6-tribromo-2-phenyl-4H-1-benzopyran- 4-one","","- C17 H13 Br3 O5 -","- C17 H13 Br3 O5 -","- C136 H104 Br24 O40 -","8","1","QA0028","Kan Chantrapromma; Vatcharee Seechamnanturakit; Chaveng Pakawatchai; Suchada Chantrapromma; Kandasamy Chinnakali; Hoong-Kun Fun","2,3-Dihydro-8-hydroxy-5,7-dimethoxy-2-phenyl-4<i>H</i>-1-benzopyran-4-one and 3,3,6-Tribromo-2,3-dihydro-8-hydroxy-5,7-dimethoxy-2-phenyl-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section C","1998","54","2","IUC9800001","","10.1107/S0108270198099843","","","0.71073","MoKα","","0.2065","0.0826","","0.2357","0.1958","","","","0.833","1.235","1.235","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007034","19.897","0.0018","11.878","0.002","8.0208","0.0012","90","","97.204","0.01","90","","1880.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","8-(2-Bromo-4-methylanilino)-9-hydroxy-4-methyl-7,8,9,10-tetrahydro-7,8- benzocoumarin","","- C21 H20 Br N O3 -","- C21 H20 Br N O3 -","- C84 H80 Br4 N4 O12 -","4","1","QA0031","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan","8-(2-Bromo-4-methylanilino)-9-hydroxy-4-methyl-7,8,9,10-tetrahydro-7,8-benzocoumarin","Acta Crystallographica Section C","1998","54","2","IUC9800003","","10.1107/S010827019809982X","","","0.71073","MoKα","","0.1175","0.0437","","0.1225","0.1026","","","","0.833","1.126","1.126","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007035","12.673","0.003","11.809","0.002","11.921","0.002","90","","100.74","0.03","90","","1752.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 N O4 S -","- C19 H19 N O4 S -","- C76 H76 N4 O16 S4 -","4","1","QB0025","Duque Rodríguez, Julio; Pomés Hernández, Ramón; Diáz de Delgado, Graciela; Roque, Estela; Suárez Navarro, Margarita; Verdecia Reyes, Yamila; Ochoa Rodríguez, Estael; Pita Mieres, Beatriz; Espinosa, Remberto; Liván Alba Gutierrez","2-Ethoxycarbonyl-5-methoxycarbonyl-6-methyl-4-phenyl-4,7-dihydrothieno[2,3-<i>b</i>]pyridine","Acta Crystallographica Section C","1998","54","2","IUC9800002","","10.1107/S0108270198099831","","","0.71069","MoKα","","0.0915","0.0689","","0.1975","0.1771","","","","1.033","1.117","1.117","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007036","14.407","0.001","8.425","0.001","11.777","0.001","90","","100.93","0.01","90","","1403.5","0.2","293","","293","","","","","","","","","6","P 1 21 1","P 2yb","4","","dichloro{(S,S)-trans-diphenyl[(2- diphenylphosphinyl)cyclohexyl]phosphinicacidester}palladium(II)","","- C30 H30 Cl2 O P2 Pd -","- C30 H30 Cl2 O P2 Pd -","- C60 H60 Cl4 O2 P4 Pd2 -","2","1","SK1135","Thurner, C. L.; Barz, M.; Spiegler, M.; Thiel, W. R.","Ligands with Cycloalkane Backbones. IV. Dichloro{(<i>S</i>,<i>S</i>)-<i>trans</i>-diphenyl[(2-diphenylphosphinyl)cyclohexyl]phosphinic acid ester}palladium(II)","Acta Crystallographica Section C","1998","54","2","227","228","10.1107/S0108270197013231","","","0.71073","MoKα","","0.0258","0.0237","","","0.0634","0.0658","","","1.111","1.124","1.124","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007037","6.5295","0.0008","11.0584","0.0007","12.2954","0.0007","90","","92.92","0.006","90","","886.65","0.13","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Tetraammonium tetrametaphosphimate tetrahydrate","Tetraammonium-tetra-μ-imido-cyclotetraphosphate tetrahydrate","","- H28 N8 O12 P4 -","- H28 N8 O12 P4 -","- H56 N16 O24 P8 -","2","0.5","SK1143","Stock, Norbert; Schnick, Wolfgang","Tetraammonium Tetrametaphosphimate Tetrahydrate","Acta Crystallographica Section C","1998","54","2","171","174","10.1107/S0108270197012766","","","0.71073","MoKα","","0.028","0.0262","","0.0778","0.0765","","","","1.124","1.143","1.143","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007038","13.18","0.002","5.8904","0.0008","5.056","0.0005","90","","90","","90","","392.52","0.09","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","Cadmium selenite monohydrate","Cadmium trioxoxselenate(IV) monohydrate","","- Cd H2 O4 Se -","- Cd H2 O4 Se -","- Cd4 H8 O16 Se4 -","4","0.5","SK1149","Bäumer, Ulrich; Engelen, Bernward; Müller, Holger","Intralayer Hydrogen Bonding in CdSeO~3~.H~2~O","Acta Crystallographica Section C","1998","54","2","169","171","10.1107/S0108270197014042","","","0.71069","MoKα","","0.0191","0.0186","","0.044","0.0438","","","","1.29","1.299","1.299","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007039","31.647","0.003","5.598","0.005","11.327","0.002","90","","105.3","0.02","90","","1935.6","1.8","296","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H18 Co N4 O6 -","- C20 H18 Co N4 O6 -","- C80 H72 Co4 N16 O24 -","4","0.5","TA1101","Kyoko Tamaki; Nobuo Okabe","Diaquabis[<i>N</i>-(1-naphthyl)-<i>N</i>-nitrosohydroxylaminato-<i>O</i>,<i>O</i>']cobalt(II)","Acta Crystallographica Section C","1998","54","2","195","197","10.1107/S0108270197013620","","","0.71069","MoKα","","","0.04","","","0.041","","","","","1.22","1.22","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007040","27.96","0.003","9.1643","0.0008","18.488","0.002","90","","131.137","0.008","90","","3567.8","0.8","153","2","153","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","bis(triphenylphoshine)iminium tetrabromooxomolybdate(V)","","- C36 H30 Br4 Mo N O P2 -","- C36 H30 Br4 Mo N O P2 -","- C144 H120 Br16 Mo4 N4 O4 P8 -","4","0.5","TA1139","Fettinger, James C.; Mattamana, Sundeep P.; Poli, Rinaldo","Two Tetrahalooxomolybdate(V) Structures, [Ph~3~PNPPh~3~][MoOBr~4~] and [PPh~4~][MoOI~4~(H~2~ O)]","Acta Crystallographica Section C","1998","54","2","184","187","10.1107/S0108270197010718","","","0.71073","MoKα","","0.0419","0.0291","","0.0697","0.0651","","","","1.115","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007041","13.258","0.002","13.258","0.002","7.8926","0.0015","90","","90","","90","","1387.3","0.4","153","2","153","2","","","","","","","","6","P 4/n :2","-P 4a","85","","tetraphenylphosphonium aquotetraiodooxomolybdate(V)","","- C24 H22 I4 Mo O2 P -","- C24 H20 I4 Mo O2 P -","- C48 H40 I8 Mo2 O4 P2 -","2","0.25","TA1139","Fettinger, James C.; Mattamana, Sundeep P.; Poli, Rinaldo","Two Tetrahalooxomolybdate(V) Structures, [Ph~3~PNPPh~3~][MoOBr~4~] and [PPh~4~][MoOI~4~(H~2~ O)]","Acta Crystallographica Section C","1998","54","2","184","187","10.1107/S0108270197010718","","","0.71073","MoKα","","0.0678","0.0551","","0.1266","0.1212","","","","1.195","1.254","1.254","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007042","16.546","0.003","8.97","0.002","11.507","0.002","90","","98.9","0.02","90","","1687.3","0.6","298","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","[2-Benzylbis(salicylideneiminato)-N,N',O,O']copper(II)","","- C21 H16 Cu N2 O2 -","- C21 H16 Cu N2 O2 -","- C84 H64 Cu4 N8 O8 -","4","1","TA1184","Kani, Yoshiyuki; Ohba, Shigeru; Ishikawa, Takashi; Sakamoto, Masatomi; Nishida, Yuzo","{2-[2-(Salicylideneaminomethyl)phenylimino-methyl]phenolato(2‒)-<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>'}copper(II)","Acta Crystallographica Section C","1998","54","2","191","193","10.1107/S0108270197013619","","","0.71073","MoKα","","","0.042","","","0.038","","","","","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007043","7.5131","0.0001","9.1074","0.0002","9.8983","0.0002","83.786","0.001","79.879","0.001","77.383","0.001","648.93","0.02","153","2","153","2","","","","","","","","6","P -1","-P 1","2","di-2-pyridyl sulfide silver nitrate dimer","","","- C11 H11 Ag N3 O3.5 S -","- C22 H22 Ag2 N6 O7 S2 -","- C22 H22 Ag2 N6 O7 S2 -","1","0.5","TA1195","Anderson, Regan J.; Steel, Peter J.","A Topologically Novel Binuclear Silver Complex of Di-2-pyridyl Sulfide","Acta Crystallographica Section C","1998","54","2","223","225","10.1107/S0108270197014911","","","0.71073","MoKα","","","0.0219","","","","0.0562","","","","","","1.061","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007044","11.4376","0.001","9.8396","0.0009","12.5356","0.0011","90","","101.453","0.007","90","","1382.7","0.2","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Cu N4 O10 -","- C26 H26 Cu N4 O10 -","- C52 H52 Cu2 N8 O20 -","2","0.5","AB1498","Hökelek, Tuncer; Budak, Kıvanç; S̨endi̇l, Kıvılcım; Necefoğlu, Hacali","<i>trans</i>-Diaquabis(4-hydroxybenzoato-<i>O</i>)bis(nicotinamide-<i>N</i>)copper(II)","Acta Crystallographica Section C","1998","54","3","347","348","10.1107/S0108270197013978","","","0.71073","MoKα","","","0.056","","","0.044","","","","","1.21","1.21","","","","","has coordinates","278319","2022-10-03","11:56:22",""
"2007045","8.2968","0.0011","7.7364","0.0011","10.6066","0.0015","90","","93.434","0.011","90","","679.59","0.16","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C5 H6 N2 O2 S -","- C5 H6 N2 O2 S -","- C20 H24 N8 O8 S4 -","4","1","AB1500","Casas, José S.; Castiñeiras, Alfonso; Couce, Delfina; Playá, Nuria; Sordo, José; Varela, José M.","1-Acetyl-2-thiohydantoin","Acta Crystallographica Section C","1998","54","3","427","428","10.1107/S0108270197014960","","","0.71073","MoKα","","0.069","0.04","","0.115","0.102","","","","1.038","1.084","1.084","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007046","14.612","0.003","10.715","0.003","20.636","0.004","90","","92.88","0.02","90","","3226.8","1.3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[Hexakis(N,N-dimethylformamido)nickel(II)] bis(tetrafluoroborate)","","- C18 H42 B2 F8 N6 Ni O6 -","- C18 H42 B2 F8 N6 Ni O6 -","- C72 H168 B8 F32 N24 Ni4 O24 -","4","1","AB1501","Li, Wan-Sheung; Blake, Alexander J.; Champness, Neil R.; Schröder, Martin; Bruce, Duncan W.","Hexakis(<i>N</i>,<i>N</i>-dimethylformamide-<i>O</i>)nickel(II) Bis(tetrafluoroborate)","Acta Crystallographica Section C","1998","54","3","349","351","10.1107/S010827019701398X","","","0.71073","MoKα","","0.0954","0.061","","","","0.1391","","","","","","1.139","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007047","9.421","0.002","9.081","0.002","16.31","0.004","90","","98.14","0.04","90","","1381.3","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H24 Co I6 S6 -","- C12 H24 Co I6 S6 -","- C24 H48 Co2 I12 S12 -","2","0.5","AB1509","Blake, Alexander J.; Lippolis, Vito; Parsons, Simon; Schröder, Martin","Bis(1,4,7-trithiacyclononane-<i>S</i>,<i>S</i>',<i>S</i>'')cobalt(II) Bis(triiodide)","Acta Crystallographica Section C","1998","54","3","293","295","10.1107/S0108270197014418","","","0.71073","MoKα","","0.035","0.031","","","","0.08","","","","","","1.144","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007048","11.608","0.001","11.986","0.001","12.775","0.001","73.426","0.007","71.549","0.007","62.478","0.007","1474.7","0.2","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H26 Cu4 N12 O38 -","- C44 H26 Cu3 N12 O38 -","- C44 H26 Cu3 N12 O38 -","1","0.5","AB1512","Hökelek, Tuncer; Mert, Yüksel; Ünaleroğlu, Canan","<i>catena</i>-Poly[[tetrakis(μ-3,5-dinitrobenzoato-<i>O</i>:<i>O</i>')dicopper(II)]bis[(μ-3,5-dinitrobenzoato-<i>O</i>:<i>O</i>')(methanol-<i>O</i>)copper(II)]]","Acta Crystallographica Section C","1998","54","3","310","313","10.1107/S0108270197014613","","","0.71073","MoKα","","","0.055","","","0.07","","","","","2.31","2.31","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007049","4.3226","0.0006","9.073","0.002","14.284","0.002","90","","91.73","0.01","90","","559.95","0.17","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ammonium hydrogen hydroxypropanedioate","","- C3 H7 N O5 -","- C3 H7 N O5 -","- C12 H28 N4 O20 -","4","1","AB1514","Taka, Jun-ichiro; Ogino, Shinya; Kashino, Setsuo","Ammonium Hydrogen Tartronate","Acta Crystallographica Section C","1998","54","3","384","386","10.1107/S0108270197015126","","","0.71073","MoKα","","","0.066","","","","0.055","","","","","","1.22","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007050","8.949","0.002","11.593","0.002","8.6175","0.0009","97.89","0.01","110.715","0.009","100.44","0.02","802.4","0.3","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H12 Cl N5 -","- C18 H12 Cl N5 -","- C36 H24 Cl2 N10 -","2","1","AB1519","Wang, Zuoxiang; Bai, Zhiping; Yang, Jiaxiang; Okamoto, Ken-ichi; You, Xiaozeng","3,5-Bis(2-pyridyl)-4-<i>p</i>-chlorophenyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","1998","54","3","438","439","10.1107/S0108270197014625","","","0.7107","MoKα","","","0.038","","","0.0515","","","","","1.282","1.282","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007051","9.9029","0.0007","10.1259","0.0006","11.6523","0.0011","79.919","0.006","76.972","0.006","75.994","0.005","1095.52","0.15","294","1","294","1","","","","","","","","4","P -1","-P 1","2","Butadiynyl(cyclopentadienyl)(triphenylphosphine)nickel(II)","1,3-Butadiynyl(η^5^-cyclopentadienyl)(triphenylphosphine)nickel(II)","","- C27 H21 Ni P -","- C27 H21 Ni P -","- C54 H42 Ni2 P2 -","2","1","AB1525","Gallagher, John F.; Butler, Peter; Manning, Anthony R.","(1,3-Butadiynyl-<i>C</i>^1^)(η^5^-cyclopentadienyl)(triphenylphosphine-<i>P</i>)nickel(II)","Acta Crystallographica Section C","1998","54","3","342","345","10.1107/S0108270197016478","","","0.7107","MoKα","","0.037","0.024","","","","0.066","","","","","","1.047","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007052","11.097","0.004","18.745","0.005","12.237","0.003","90","","108.95","0.02","90","","2407.5","1.3","295","1","295","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-(Isopropoxy)-4,12-diphenyl-4-(trifluoromethyl)-1,13-dithia-3,11-diazadispiro[4 .0.4.3]tridec-2,11-diene","","- C25 H25 F3 N2 O S2 -","- C25 H25 F3 N2 O S2 -","- C100 H100 F12 N8 O4 S8 -","4","1","AB1528","Linden, Anthony; Bojkova, Nina; Heimgartner, Heinz","2-(Isopropoxy)-4,12-diphenyl-4-(trifluoromethyl)-1,13-dithia-3,11-diazadispiro[4.0.4.3]trideca-2,11-diene","Acta Crystallographica Section C","1998","54","3","373","376","10.1107/S010827019701648X","","","0.71073","MoKα","","0.0547","0.0372","","","","0.0882","","","","","","1.038","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007053","16.509","0.0015","8.2204","0.0008","12.7283","0.0012","90","","90","","90","","1727.4","0.3","160","2","160","2","","","","","","","","3","P n a 21","P 2c -2n","33","","diphenylzirconocene","","- C22 H20 Zr -","- C22 H20 Zr -","- C88 H80 Zr4 -","4","1","AB1533","Clegg, William; Horsburgh, Lynne; Lindsay, David M.; Mulvey, Robert E.","Diphenylzirconocene","Acta Crystallographica Section C","1998","54","3","315","317","10.1107/S0108270197019343","","","0.71073","MoKα","","0.0236","0.0222","","","","0.0585","","","","","","1.088","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007054","11.044","0.002","11.809","0.002","4.6958","0.0007","92.74","0.01","95.04","0.01","111.337","0.01","566.13","0.17","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H10 F3 N O2 -","- C13 H10 F3 N O2 -","- C26 H20 F6 N2 O4 -","2","1","BK1297","Jasinski, Jerry P.; Jasinski, John M.; Li, Yu","6,7,8,9-Tetrahydro-4-trifluoromethyl-2<i>H</i>-pyrano[3,2-<i>g</i>]quinolin-2-one, (I), and 6,7,8,9-Tetrahydro-9-ethyl-4-trifluoromethyl-2<i>H</i>-pyrano[3,2-<i>g</i>]quinolin-2-one, (II)","Acta Crystallographica Section C","1998","54","3","410","412","10.1107/S0108270197007221","","","0.71069","MoKα","","0.067","0.036","","0.107","0.092","","","","1.03","1.09","1.09","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007055","9.756","0.004","12.613","0.004","22.443","0.004","90","","92.45","0.02","90","","2759.1","1.5","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 F3 N O2 -","- C15 H14 F3 N O2 -","- C120 H112 F24 N8 O16 -","8","2","BK1297","Jasinski, Jerry P.; Jasinski, John M.; Li, Yu","6,7,8,9-Tetrahydro-4-trifluoromethyl-2<i>H</i>-pyrano[3,2-<i>g</i>]quinolin-2-one, (I), and 6,7,8,9-Tetrahydro-9-ethyl-4-trifluoromethyl-2<i>H</i>-pyrano[3,2-<i>g</i>]quinolin-2-one, (II)","Acta Crystallographica Section C","1998","54","3","410","412","10.1107/S0108270197007221","","","0.71069","MoKα","","0.162","0.055","","0.184","0.127","","","","1","1.17","1.17","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007056","12.6451","0.0006","11.5793","0.0006","17.7855","0.0009","90","","99.444","0.001","90","","2568.9","0.2","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(tetra-n-butylammonium) hexakis((μ~3~-sulfido)-nitroso-iron)","","- C32 H72 Fe6 N8 O6 S6 -","- C32 H72 Fe6 N8 O6 S6 -","- C64 H144 Fe12 N16 O12 S12 -","2","0.5","BK1352","Geiser, Urs; Williams, Jack M.","Bis(tetra-<i>n</i>-butylammonium) Hexa-μ~3~-sulfido-hexakis(nitrosoiron)","Acta Crystallographica Section C","1998","54","3","292","293","10.1107/S0108270197013802","","","0.71073","MoKα","","0.055","0.041","","0.114","0.104","","","","1.019","1.017","1.017","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007057","19.6219","0.0004","15.5067","0.0004","19.4399","0.0005","90","","103.015","0.001","90","","5763","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triethylammonium tris(thiobenzoato-O,S)cadmate(II)","","- C27 H31 Cd N O3 S3 -","- C27 H31 Cd N O3 S3 -","- C216 H248 Cd8 N8 O24 S24 -","8","2","BK1365","Vittal, Jagadese J.; Dean, Philip A. W.","Triethylammonium Tris(thiobenzoato-<i>O</i>,<i>S</i>)cadmate(II)","Acta Crystallographica Section C","1998","54","3","319","321","10.1107/S0108270197014431","","","0.71073","MoKα","","0.053","0.034","","0.078","0.07","","","","1.025","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007058","8.313","0.001","13.367","0.001","18.981","0.001","90","","90","","90","","2109.2","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","rotundifoline","E-Seco 9(hydroxy)20-Hβ 19-ethyl rhynchophylline","","- C22 H28 N2 O5 -","- C22 H28 N2 O5 -","- C88 H112 N8 O20 -","4","1","BM1144","Ashish Mukhopadhyyay; Samar Kumar Talapatra; Ashin Kumar Saha; Pranab Kumar Lala; Sunil Kumar Mazumdar; Kinkini Bhattacharyya","Rotundifoline, an Oxoindole Alkaloid","Acta Crystallographica Section C","1998","54","3","399","401","10.1107/S0108270197013528","","","0.71073","MoKα","","0.1818","0.0815","","","","0.2448","","","","","","1.058","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007059","9.197","0.001","10.606","0.001","13.259","0.001","90","","90.94","0.01","90","","1293.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Hydroxy-2-ethyl-1-3,5dimethylphenyl pyridin-4-one","","- C15 H17 N O2 -","- C15 H17 N O2 -","- C60 H68 N4 O8 -","4","1","BM1164","John Burgess; John Fawcett; David R. Russell; Lu Zaisheng","Three <i>N</i>-Aryl-Substituted 3-hydroxypyridin-4-ones","Acta Crystallographica Section C","1998","54","3","430","433","10.1107/S010827019701127X","","","0.71073","MoKα","","0.0518","0.0424","","0.1205","0.112","","","","1.056","1.081","1.081","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007060","7.305","0.001","18.615","0.007","18.296","0.002","90","","99.81","0.02","90","","2451.6","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Hydroxy-2-ethyl-1-4methylphenyl pyridin-4-one","","- C14 H15 N O2 -","- C14 H15 N O2 -","- C112 H120 N8 O16 -","8","2","BM1164","John Burgess; John Fawcett; David R. Russell; Lu Zaisheng","Three <i>N</i>-Aryl-Substituted 3-hydroxypyridin-4-ones","Acta Crystallographica Section C","1998","54","3","430","433","10.1107/S010827019701127X","","","0.71073","MoKα","","0.1","0.054","","0.1484","0.1214","","","","1.017","1.109","1.109","","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"2007061","7.306","0.001","10.351","0.001","17.321","0.002","86.25","0.01","78.44","0.01","71.92","0.01","1219.9","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-Hydroxy-2-ethyl-1-4methoxyphenyl pyridin-4-one","","- C14 H15 N O3 -","- C14 H15 N O3 -","- C56 H60 N4 O12 -","4","2","BM1164","John Burgess; John Fawcett; David R. Russell; Lu Zaisheng","Three <i>N</i>-Aryl-Substituted 3-hydroxypyridin-4-ones","Acta Crystallographica Section C","1998","54","3","430","433","10.1107/S010827019701127X","","","0.71073","MoKα","","0.0699","0.0491","","0.1431","0.1201","","","","1.071","1.111","1.111","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007062","5.565","0.0007","11.9277","0.0014","12.7732","0.0015","77.935","0.003","84.163","0.003","79.965","0.003","814.56","0.17","190","2","190","2","","","","","","","","3","P -1","-P 1","2","","6-Acety-3,7-diacetoxy-2,2-dimethyl-2H-benzopyran","","- C17 H20 O6 -","- C17 H20 O6 -","- C34 H40 O12 -","2","1","BM1179","Jha, Amitaba; Malhotra, Sanjay; Parmar, Virinder S; Errington, William","6-Acetyl-3,4-dihydro-2,2-dimethyl-2<i>H</i>-benzopyran-3,7-diyl Diacetate","Acta Crystallographica Section C","1998","54","3","361","363","10.1107/S010827019701514X","","","0.71073","MoKα","","0.079","0.052","","","","0.14","","","","","","1.043","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007063","10.3731","0.0018","5.7516","0.001","22.46","0.004","90","","101.992","0.004","90","","1310.8","0.4","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3',4'-Dimethoxydihydrocinnamoylpyrrole","","- C15 H17 N O3 -","- C15 H17 N O3 -","- C60 H68 N4 O12 -","4","1","BM1181","Kumar, Rajesh; Parmar, Virinder S.; Errington, William; Wengel, Jesper; Olsen, Carl E.","1-(3,4-Dimethoxy-α,β-dihydrocinnamoyl)pyrrole, a Novel Amide from <i>Piper brachystachyum</i>","Acta Crystallographica Section C","1998","54","3","363","365","10.1107/S0108270197015606","","","0.71073","MoKα","","0.0642","0.0453","","","","0.1192","","","","","","1.023","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007064","8.629","0.003","9.599","0.003","6.739","0.003","90","","90.29","0.03","90","","558.2","0.4","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Trifluoromethyl-5-amino-1H-1,2,4-triazole","","- C3 H3 F3 N4 -","- C3 H3 F3 N4 -","- C12 H12 F12 N16 -","4","1","BM1187","Borbulevych, O. Ya.; Shishkin, O. V.; Desenko, S. M.; Chernenko, V. N.; Orlov, V. D.","5-Amino-3-trifluoromethyl-1<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","1998","54","3","442","444","10.1107/S0108270197014443","","","0.71073","MoKα","","0.121","0.067","","0.312","0.172","","","","1.059","1.129","1.129","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007065","9.835","0.003","11.403","0.003","14.717","0.003","86.75","0.02","84.65","0.02","76.07","0.02","1594","0.7","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H31 Cl2 Fe Hg O P2 -","- C35 H28 Cl2 Fe Hg O P2 -","- C70 H56 Cl4 Fe2 Hg2 O2 P4 -","2","1","BM1195","McGinley, John; McKee, Vickie; McKenzie, Christine J.","Dichloro[ferrocene-1,1'-diylbis(diphenylphosphine-<i>P</i>)]mercury(II) Methanol Solvate","Acta Crystallographica Section C","1998","54","3","345","347","10.1107/S0108270197014832","","","0.71073","MoKα","","0.057","0.037","","","","0.078","","","","","","1.026","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007066","8.9674","0.0008","9.0604","0.0009","11.8823","0.0011","90","","96.087","0.008","90","","959.97","0.16","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-Acetyl-5,8-dihydronaphthalene-1-ol","","- C12 H12 O2 -","- C12 H12 O2 -","- C48 H48 O8 -","4","1","BM1196","Chinnakali, Kandasamy; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vaylakkavoor T.","2-Acetyl-5,8-dihydronaphthalen-1-ol","Acta Crystallographica Section C","1998","54","3","370","371","10.1107/S0108270197015436","","","0.71073","MoKα","","0.077","0.04","","0.124","0.109","","","","0.881","1.087","1.087","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007067","11.4598","0.001","12.5892","0.0011","11.1347","0.0012","90","","97.996","0.007","90","","1590.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-piperazin-1,4-diyldimethylene-bis[6-(cyclohexyliminimethyl) -4-methylphenol]","","- C34 H48 N4 O2 -","- C34 H48 N4 O2 -","- C68 H96 N8 O4 -","2","0.5","BM1205","Thirumurugan, R.; Shanmuga Sundara Raj, S.; Shanmugam, G.; Chinnakali, Kandasamy; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Marappan, M.; Kandaswamy, M.","1,4-Bis[3-(<i>N</i>-cyclohexyliminomethyl)-2-hydroxy-5-methylbenzyl]piperazine","Acta Crystallographica Section C","1998","54","3","365","367","10.1107/S0108270197016934","","","0.71073","MoKα","","0.096","0.043","","0.124","0.105","","","","0.866","1.085","1.085","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007068","10.532","0.002","12.384","0.002","18.095","0.005","88.71","0.02","99.55","0.02","99.99","0.02","2292.1","0.9","296","","","","","","","","","","","6","P 1 1 2","P 2","3","","Tatraethylammonium Bis(tripenylphosphino)copper(I)(2,2-dicyano-1,1- ethylenedithiolate, (Et~4~N)[Cu(PPh~3~)~2~{S~2~C~2~(CN)~2~}]","","- C48 H50 Cu N3 P2 S2 -","- C48 H50 Cu N3 P2 S2 -","- C96 H100 Cu2 N6 P4 S4 -","2","1","BS1018","Su, Weiping; Hong, Maochun; Cao, Rong; Liu, Hanqin","Tetraethylammonium (2,2-Dicyano-1,1-ethylenedithiolato-<i>S</i>,<i>S</i>')bis(triphenylphosphino-<i>P</i>)copper(I), (Et~4~ N)[Cu(PPh~3~)~2~{S~2~C~2~(CN)~2~}]","Acta Crystallographica Section C","1998","54","3","337","338","10.1107/S0108270197009815","","","0.71073","MoKα","","","0.052","","","0.059","","","","","1.44","1.44","","","","","has coordinates","278246","2022-09-28","14:48:12",""
"2007069","18.123","0.004","7.924","0.002","17.732","0.004","90","","111.11","0.03","90","","2375.5","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Rac-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraaza- cyclotetradecane Hydrochloride Trihydrate","","- C16 H44 Cl2 N4 O3 -","- C16 H44 Cl2 N4 O3 -","- C64 H176 Cl8 N16 O12 -","4","0.5","CF1175","Simonov, Yurii A.; Bocelli, Gabriele; Fonari, Marina S.; Ganin, Edward V.; Popkov, Yurii A.","Inclusion Complex of <i>rac</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane with Hydrochloride and Water","Acta Crystallographica Section C","1998","54","3","433","436","10.1107/S0108270197013292","","","1.5418","CuKα","","0.0392","0.0372","","0.1069","0.0951","","","","1.023","1.024","1.024","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007070","13.154","0.007","13.154","0.007","11.869","0.008","90","","90","","90","","2054","2","293","2","293","2","","","","","","","","4","P 41","P 4w","76","","[N-(1'-Phenylethyl)-2-azabicyclo[4,3,0]-6-allyl-8,8-dimethyl-3-oxonon -5-yl]-carboxylic acid","","- C22 H27 N O3 -","- C22 H27 N O3 -","- C88 H108 N4 O12 -","4","1","CF1188","Chiaroni, Angèle; Riche, Claude; Dumas Franc̨oise; Mauduit, Marc; Miet, Christine","6-Allyl-8,8-dimethyl-3-oxo-2-(1-phenylethyl)-2-azabicyclo[4.3.0]non-1(9)-ene-5-carboxylic Acid, a Key Compound in the Asymmetric Synthesis of Quadrone","Acta Crystallographica Section C","1998","54","3","401","403","10.1107/S0108270197015448","","","0.7107","MoKα","","0.04","0.031","","0.095","0.073","","","","1.083","1.095","1.095","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007071","9.3028","0.001","8.5506","0.0006","23.96","0.002","90","","97.636","0.008","90","","1889","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","8-Acetyl-4-methyl-9-phenylthio-7,8,9,10-tetrahydro-7,8-benzocoumarin","","- C22 H20 O4 S -","- C22 H20 O4 S -","- C88 H80 O16 S4 -","4","1","CF1196","Chinnakali, Kandasamy; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vaylakkavoor T.","8-Acetyl-4-methyl-9-phenylthio-7,8,9,10-tetrahydro-7,8-benzocoumarin","Acta Crystallographica Section C","1998","54","3","367","368","10.1107/S0108270197014522","","","0.71073","MoKα","","0.05","0.04","","0.116","0.111","","","","1.048","1.131","1.131","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007072","8.9","0.002","11.508","0.002","7.7675","0.001","94.713","0.014","107.873","0.013","67.784","0.014","700.4","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","diphenylsulfoximidium hydrogen sulfate","","","- C12 H13 N O5 S2 -","- C12 H13 N O5.02 S2 -","- C24 H26 N2 O10.04 S4 -","2","1","CF1214","Longridge, John J.; Rawson, Jeremy M.; Feeder, Neil; Raithby, Paul R.","The First Structural Characterization of a Sulfoximidium Salt","Acta Crystallographica Section C","1998","54","3","398","399","10.1107/S0108270197016569","","","0.71069","MoKα","","0.052","0.0357","","0.0993","0.0896","","","","1.026","1.064","1.064","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007073","11.503","0.005","17.843","0.005","19.132","0.009","90","","106.51","0.03","90","","3765","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","2,2-di-t-butylamino-4,4,6,6-tetrakis(3,5-dimethylpyrazol-1-yl)- cycltriphosphazene cobalt(II)chloride","","","- C28 H48 Cl2 Co N13 P3 -","- C28 H48 Cl2 Co N13 P3 -","- C112 H192 Cl8 Co4 N52 P12 -","4","1","DE1067","K. R. Justin Thomas","A Novel Cyclotriphosphazene Complex with a Short Transannular P···P Contact","Acta Crystallographica Section C","1998","54","3","331","333","10.1107/S0108270197015114","","","0.71073","MoKα","","0.0472","0.0327","","0.0893","0.077","","","","1.088","1.057","1.057","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007074","8.597","0.001","15.42","0.002","22.449","0.003","90","","90","0.02","90","","2976","0.7","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H11 N3 O5 S -","- C14 H11 N3 O5 S -","- C112 H88 N24 O40 S8 -","8","1","DU1181","Hdii, Fatiha; Reboul, Jean-Pierre; Barbe, Jacques; Siri, Didier; Pepe, Gerard","2-Acétamido-2',4'-dinitrodiphénylsulfure","Acta Crystallographica Section C","1998","54","3","391","392","10.1107/S0108270197013462","","","0.71069","MoKα","","0.0476","0.0438","","0.0897","0.0893","","","","0.968","1.292","1.292","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007075","8.7286","0.0006","8.0635","0.0006","12.261","0.0009","90","","105.79","0.001","90","","830.4","0.1","293","2","","","","","","","","","","5","P 1 21 1","P 2yb","4","(-)-sparteine copper(II) chloride","","","- C15 H26 Cl2 Cu N2 -","- C15 H26 Cl2 Cu N2 -","- C30 H52 Cl4 Cu2 N4 -","2","1","FG1370","Lopez, Susan; Muravyov, Igor; Pulley, Shon R.; Keller, Steven W.","Dichloro[({-})-sparteine-<i>N</i>,<i>N</i>']copper(II)","Acta Crystallographica Section C","1998","54","3","355","357","10.1107/S0108270197015886","","","0.7107","MoKα","","0.0487","0.0414","","","","0.0994","","","0.979","1.022","1.022","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007076","12.433","0.002","6.629","0.001","24.559","0.004","90","","93.38","0.01","90","","2020.6","0.6","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","22,23-Bisnor-5α-cholanic acid-3-one","(+)-22,23-Bisnor-3-oxo-5α-cholanic Acid","","- C22 H34 O3 -","- C22 H34 O3 -","- C88 H136 O12 -","4","1","FG1381","Lalancette, Roger A.; Thompson, Hugh W.; Brunskill, Andrew P. J.","(+)-3-Oxo-23,24-dinor-5α-cholan-22-oic Acid: Hydrogen-Bonding Patterns in a Steroidal Keto Acid and its Monohydrate","Acta Crystallographica Section C","1998","54","3","421","424","10.1107/S0108270197016296","","","0.71073","MoKα","","0.188","0.073","","0.156","0.109","","","","1.05","1.22","1.22","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007077","12.696","0.003","6.168","0.002","26.784","0.007","90","","101.26","0.02","90","","2057.1","1","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","22,23-Bisnor-5α-cholanic acid-3-one Monohydrate","(+)-22,23-Bisnor-3-oxo-5α-cholanic Acid Monohydrate","","- C22 H36 O4 -","- C22 H36 O4 -","- C88 H144 O16 -","4","1","FG1381","Lalancette, Roger A.; Thompson, Hugh W.; Brunskill, Andrew P. J.","(+)-3-Oxo-23,24-dinor-5α-cholan-22-oic Acid: Hydrogen-Bonding Patterns in a Steroidal Keto Acid and its Monohydrate","Acta Crystallographica Section C","1998","54","3","421","424","10.1107/S0108270197016296","","","0.71073","MoKα","","0.062","0.044","","0.131","0.106","","","","1.05","1.09","1.09","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007078","36.12","0.002","36.12","0.002","14.787","0.001","90","","90","","120","","16707.3","1.7","295","","295","","","","","","","","","3","R -3 :H","-R 3","148","","","","- C42 H34 O2 -","- C41.9997 H33.4286 O1.99971 -","- C881.994 H702 O41.994 -","21","1.16667","FG1398","Benites, Maria del Rosario; Hammer, Robert P.; Fronczek, Frank R.","1,4-Bis(triphenylmethoxy)-2-butyne, Rhombohedral with <i>Z</i>' = 7/6","Acta Crystallographica Section C","1998","54","3","412","415","10.1107/S0108270197016703","","","1.54184","CuKα","","0.083","0.057","","","0.059","","","","","1.206","1.206","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007079","6.8684","0.001","11.537","0.002","17.079","0.003","90","","90","","90","","1353.4","0.4","293","1","293","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Cyclic Selenenamide","[3aR-(3aα,4α,7α,7aα)]-2-Acetylhexahydro-4,8,8-trimethyl-4,7-methano- 1,2-benzisoselenazol-3a(4H)-ol","","- C13 H21 N O2 Se -","- C13 H21 N O2 Se -","- C52 H84 N4 O8 Se4 -","4","1","FG1405","Back, Thomas G.; Dyck, Brian P.; Nan, Siqiao; Parvez, Masood","[3a<i>R</i>-(3aα,4α,7α,7aα)]-2-Acetyl-4,8,8-trimethylperhydro-4,7-methano-1,2-benzisoselenazol-3a-ol","Acta Crystallographica Section C","1998","54","3","425","427","10.1107/S0108270197015916","","","1.54178","CuKα","","0.037","0.033","","0.088","0.085","","","","1.113","1.107","1.107","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007080","12.346","0.003","5.244","0.003","14.362","0.002","90","","94.77","0.02","90","","926.6","0.6","296","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C11 H11 N O2 -","- C11 H11 N O2 -","- C44 H44 N4 O8 -","4","1","FR1089","Okabe, Nobuo; Adachi, Yukari","1<i>H</i>-Indole-3-propionic Acid","Acta Crystallographica Section C","1998","54","3","386","387","10.1107/S010827019701593X","","","0.71069","MoKα","","","0.042","","","0.045","","","","","1.63","1.63","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007081","14.645","0.0009","17.9176","0.0012","8.152","0.0005","90","","114.188","0.001","90","","1951.3","0.2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H19 Na O12 Rh2 -","- C12 H19 Na O12 Rh2 -","- C48 H76 Na4 O48 Rh8 -","4","0.5","FR1090","Wei, Xinyi; Dickman, Michael H.; Pope, Michael T.","Sodium Hydrogen Hexaacetatodirhodate(II)","Acta Crystallographica Section C","1998","54","3","351","352","10.1107/S0108270197014662","","","0.71073","MoKα","","0.0412","0.033","","0.069","0.0651","","","","1.16","1.16","1.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007082","9.831","0.003","9.817","0.002","13.488","0.004","90","","107.11","0.02","90","","1244.1","0.6","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(3aα,7aα)-Chloromethyl-8,8-dichloro-2,3-dihydro-5-methoxy-3a,7a-methano- 1H-indene","","- C12 H13 Cl3 O -","- C12 H13 Cl3 O -","- C48 H52 Cl12 O4 -","4","1","HA1196","Mackay, Maureen F.; Banwell, Martin G.; Pallich, Susanne; Phyland, James R.","A <i>gem</i>-Dichloro[4.3.1]propellane and a <i>gem</i>-Dichloro[5.3.1]propellenone","Acta Crystallographica Section C","1998","54","3","378","380","10.1107/S0108270197014893","","","1.5418","CuKα","","0.062","0.05","","0.145","0.119","","","","1.152","1.059","1.059","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007083","6.383","0.002","23.443","0.004","8.031","0.002","90","","107.92","0.02","90","","1143.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3aα,8aα)-6,9,9-Trichloro-2,3,5,8-tetrahydro-1H,4H-3a,8a-methanoazulen-5-one","","- C11 H11 Cl3 O -","- C11 H11 Cl3 O -","- C44 H44 Cl12 O4 -","4","1","HA1196","Mackay, Maureen F.; Banwell, Martin G.; Pallich, Susanne; Phyland, James R.","A <i>gem</i>-Dichloro[4.3.1]propellane and a <i>gem</i>-Dichloro[5.3.1]propellenone","Acta Crystallographica Section C","1998","54","3","378","380","10.1107/S0108270197014893","","","1.5418","CuKα","","0.059","0.042","","0.211","0.188","","","","0.91","1.052","1.052","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007084","10.756","0.002","7.069","0.001","10.16","0.002","90","","91.9","0.03","90","","772.1","0.2","295","0.1","295","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,6-Bis(3,5-dioxopiperazine-1-yl)hexane","","- C14 H22 N4 O4 -","- C14 H22 N4 O4 -","- C28 H44 N8 O8 -","2","0.5","HA1201","Liu, Q.; Zhang, S.-W.; Shao, M.-C.","Anticancer Agents. III. 4,4'-(Hexane-1,6-diyl)bis(piperazine-2,6-dione)","Acta Crystallographica Section C","1998","54","3","439","440","10.1107/S0108270197014844","","","0.71073","MoKα","","0.087","0.058","","0.103","0.053","","","","","0.62","0.62","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007085","9.253","0.008","12.88","0.02","12.455","0.01","90","","109.69","0.07","90","","1398","3","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Br4 I2 Pd S6 -","- C12 H24 Br4 I2 Pd S6 -","- C24 H48 Br8 I4 Pd2 S12 -","2","0.5","HA1202","Blake, Alexander J.; Gilby, Liam M.; Gould, Robert O.; Lippolis, Vito; Parsons, Simon; Schröder, Martin","Macrocyclic Thioether Complexes of Palladium with Dibromoiodide Anions","Acta Crystallographica Section C","1998","54","3","295","298","10.1107/S0108270197014212","","","0.71073","MoKα","","0.1236","0.0935","","","","0.2882","","","","","","1.065","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007086","14.651","0.002","9.3117","0.0007","16.7648","0.0011","90","","93.468","0.01","90","","2283","0.4","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C10 H20 Br4 I2 Pd S4 -","- C10 H20 Br4 I2 Pd S4 -","- C40 H80 Br16 I8 Pd4 S16 -","4","0.5","HA1202","Blake, Alexander J.; Gilby, Liam M.; Gould, Robert O.; Lippolis, Vito; Parsons, Simon; Schröder, Martin","Macrocyclic Thioether Complexes of Palladium with Dibromoiodide Anions","Acta Crystallographica Section C","1998","54","3","295","298","10.1107/S0108270197014212","","","0.71073","MoKα","","0.0523","0.0392","","0.1102","0.0903","","","","1.055","1.053","1.053","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007087","16.885","0.006","18.689","0.004","9.452","0.003","90","","94.05","0.05","90","","2975.3","1.6","150","","150","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C15 H32 I6 N6 Ni -","- C15 H32 I6 N6 Ni -","- C60 H128 I24 N24 Ni4 -","4","1","HA1203","Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Schröder, Martin","Bis(acetonitrile-<i>N</i>)(1,4,8,12-tetraazacyclopentadecane)nickel(II) Bis(triiodide) and (1,4,8,12-Tetraazacyclopentadecane)palladium(II) Bis(triiodide)","Acta Crystallographica Section C","1998","54","3","299","302","10.1107/S0108270197014200","","","0.71073","MoKα","","0.0429","0.0377","","","","0.0948","","","","","","1.131","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007088","7.787","0.007","9.173","0.009","9.382","0.006","99.03","0.09","101.14","0.09","107.43","0.1","610.6","1.1","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H26 I6 N4 Pd -","- C11 H22 I6 N4 Pd -","- C11 H22 I6 N4 Pd -","1","0.5","HA1203","Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Schröder, Martin","Bis(acetonitrile-<i>N</i>)(1,4,8,12-tetraazacyclopentadecane)nickel(II) Bis(triiodide) and (1,4,8,12-Tetraazacyclopentadecane)palladium(II) Bis(triiodide)","Acta Crystallographica Section C","1998","54","3","299","302","10.1107/S0108270197014200","","","0.71073","MoKα","","0.061","0.0503","","0.1133","0.1044","","","","1.154","1.145","1.145","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007089","7.597","0.002","7.422","0.001","9.466","0.002","90","","95.47","0.03","90","","531.31","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","α-vanadium(IV) hydrogenphosphat dihydrat","α-oxovanadium(IV)hydrogen phosphate dihydrate","","- H5 O7 P V -","- H5 O7 P V -","- H20 O28 P4 V4 -","4","1","JZ1223","Horst Worzala; Goetze, Thomas; Fratzky, Dietmar; Manfred Meisel","Redetermination of Monoclinic VOHPO~4~.2H~2~O","Acta Crystallographica Section C","1998","54","3","283","285","10.1107/S0108270197014017","","","0.71073","MoKα","","0.0213","0.0178","","0.0464","","0.0464","","","1.119","","","1.119","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007090","11.708","0.002","8.991","0.002","14.994","0.002","90","","106.46","0.01","90","","1513.7","0.5","296","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 Mn N2 O6 -","- C12 H12 Mn N2 O6 -","- C48 H48 Mn4 N8 O24 -","4","1","JZ1229","Okabe, Nobuo; Koizumi, Makiko","Diaquabis(2-pyridinecarboxylato-<i>N</i>,<i>O</i>)manganese(II)","Acta Crystallographica Section C","1998","54","3","288","290","10.1107/S0108270197016326","","","0.71069","MoKα","","","0.036","","","0.046","","","","","1.76","1.76","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007091","6.7233","0.0008","8.8573","0.0008","17.0033","0.0012","99.151","0.008","94.253","0.01","92.019","0.007","995.77","0.17","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","4,4'-Trimethylenedipyridinium (1+) 1,3,5-benzenetricarboxylate (1-)","","- C22 H20 N2 O6 -","- C22 H20 N2 O6 -","- C44 H40 N4 O12 -","2","1","JZ1242","Ferguson, George; Glidewell, Christopher; McManus, Gordon D.; Meehan, Paul R.","A Perforated Molecular Tape in the 1:1 Salt of 4,4'-Trimethylenedipyridine and 1,3,5-Benzenetricarboxylic acid","Acta Crystallographica Section C","1998","54","3","418","421","10.1107/S0108270197012110","","","0.7107","MolybdenumKα","","0.0968","0.0509","","","","0.1227","","","","","","1.028","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007092","7.9688","0.0009","9.9716","0.001","17.2571","0.0013","90","","98.592","0.009","90","","1355.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dimeric (imidazole)(N-salicylidene-R,S-alaninato)copper(II)","","- C13 H13 Cu N3 O3 -","- C13 H13 Cu N3 O3 -","- C52 H52 Cu4 N12 O12 -","4","1","JZ1251","Warda, Salam A.","Dimeric (Imidazole-<i>N</i>^3^)(<i>N</i>-salicylidene-<i>rac</i>-alaninato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1998","54","3","304","306","10.1107/S0108270197014856","","","0.71073","MoKα","","0.0675","0.0413","","","","0.0969","","","","","","1.029","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007093","7.775","0.0005","8.1044","0.0007","11.624","0.0009","70.474","0.008","81","0.008","89.478","0.008","681.09","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","μ, μ'-Pyrazine-bis(N-salicylidene-R,S-alaninato-copper(II)) tetrahydrate","","- C24 H30 Cu2 N4 O10 -","- C24 H30 Cu2 N4 O10 -","- C24 H30 Cu2 N4 O10 -","1","0.5","JZ1252","Warda, Salam A.","Polymeric μ,μ'-Pyrazine-<i>N</i>,<i>N</i>'-bis(<i>N</i>-salicylidene-<i>R</i>,<i>S</i>-alaninato)copper(II) Tetrahydrate","Acta Crystallographica Section C","1998","54","3","302","304","10.1107/S0108270197015783","","","0.71073","MoKα","","","0.0366","","","","0.0821","","","","","","1.017","","","","has coordinates","249787","2020-10-21","18:00:00",""
"2007094","11.801","0.002","13.206","0.003","21.697","0.004","90","","103.144","0.015","90","","3292.8","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-Bis[(2-Diphenylphosphinoethyl)dimethylstannyl]platinum(II)","","- C32 H40 P2 Pt Sn2 -","- C32 H40 P2 Pt Sn2 -","- C128 H160 P8 Pt4 Sn8 -","4","1","JZ1255","Baumeister, Ute; Hartung, Helmut; Schulz, Torsten; Weichmann, Horst","<i>cis</i>-Bis[(2-diphenylphosphinoethyl)dimethylstannyl]platinum(II)","Acta Crystallographica Section C","1998","54","3","333","335","10.1107/S0108270197014029","","","0.71073","MoKα","","0.0411","0.0285","","0.0712","0.0673","","","","1.085","1.138","1.138","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007095","6.781","0.001","15.53","0.003","21.179","0.004","90","","90","","90","","2230.3","0.7","133","2","133","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Cyclohexyl-16'α,17'α-dihydro-3'-methoxy-4H-estra-1',3',5'(10'),16'- tetraeno[16',17'-e][1,3]oxazine","","- C27 H37 N O2 -","- C27 H37 N O2 -","- C108 H148 N4 O8 -","4","1","KA1249","Bes, Teresa; Hajnal, Andrea; Schneider, Gyula; Noltemeyer, Mathias","A Steroidal Dihydro-1,3-oxazine Derivative","Acta Crystallographica Section C","1998","54","3","372","373","10.1107/S0108270197016338","","","0.71073","MoKα","","0.046","0.04","","","","0.099","","","","","","1.116","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007096","6.4376","0.0008","9.744","0.0009","10.8177","0.001","92.328","0.008","96.772","0.011","99.011","0.011","664.31","0.12","293","","293","","","","","","","","","4","P -1","-P 1","2","Tetramethylsulfate","1,3,2-Dioxathiepane, 2,2-dioxide","","- C4 H8 O4 S -","- C4 H8 O4 S -","- C16 H32 O16 S4 -","4","2","KA1250","Krüger, Carl; Kessler, Magnus; Six, Christian; Leitner, Walter","A Cyclic Sulfate with a Seven-Membered Ring: 1,3,2-Dioxathiepane 2,2-Dioxide","Acta Crystallographica Section C","1998","54","3","389","390","10.1107/S010827019701634X","","","0.71069","MoKα","","0.081","0.042","","0.115","0.096","","","","1.019","1.047","1.047","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007097","8.955","0.004","9.702","0.005","14.003","0.005","84.72","0.03","85","0.03","68.74","0.03","1127.1","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(Isocyanato)bis(2,2'-bipyridine)copper(II) Tricyanomethanide","","- C25 H16 Cu N8 O -","- C25 H16 Cu N8 O -","- C50 H32 Cu2 N16 O2 -","2","1","KA1256","Potočňák, Ivan; Dunaj-Jurčo, Michal; Mikloš, Dušan; Jäger, Lothar","Bis(2,2'-bipyridine-<i>N</i>,<i>N</i>')(isocyanato-<i>N</i>)copper(II) Tricyanomethanide","Acta Crystallographica Section C","1998","54","3","313","315","10.1107/S0108270197014510","","","0.71073","MoKα","","0.163","0.033","","0.1","","0.07","","","0.583","","","0.691","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007098","8.5162","0.0012","8.8856","0.0014","16.625","0.002","81.103","0.011","82.321","0.014","71.925","0.011","1176.6","0.3","133","","","","","","","","","","","3","P -1","-P 1","2","","","","- C14 H14 O2 -","- C14 H14 O2 -","- C56 H56 O8 -","4","2","KA1257","Bats, Jan W.; Hashmi, A. Stephen K.","<i>meso</i>-1-[3-(1-Hydroxy-3-butynyl)phenyl]-3-butyn-1-ol","Acta Crystallographica Section C","1998","54","3","376","378","10.1107/S0108270197016351","","","0.71073","MoKα","","","0.06","","","0.074","","","","","2.585","2.585","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007099","9.3972","0.0001","12.3917","0.0001","13.7857","0.0002","90","","90","","90","","1605.31","0.03","173","","173","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Bromohydridomethyl-bis-(4-Methylpyridinium)-siliciumbromid","","- C13 H18 Br2 N2 Si -","- C13 H18 Br2 N2 Si -","- C52 H72 Br8 N8 Si4 -","4","1","KA1258","Hensen, Karl; Kettner, Markus; Bolte, Michael","Bromo(hydrido)methylbis(4-methylpyridine-<i>N</i>)silicon Bromide at 173K","Acta Crystallographica Section C","1998","54","3","358","359","10.1107/S0108270197015801","","","0.71073","MoKα","","0.033","0.024","","0.043","0.042","","","","1.001","1.033","1.033","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007100","12.9274","0.0001","10.7353","0.0001","20.1194","0.0002","90","","92.849","0.001","90","","2788.71","0.04","143","","143","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H25 Cl N6 -","- C36 H25 Cl N6 -","- C144 H100 Cl4 N24 -","4","1","KA1259","Hensen, Karl; Gebhardt, Frank; Bolte, Michael","1,10-Phenanthrolin-1-ium Chloride Bis(1,10-phenanthroline) Solvate at 143K","Acta Crystallographica Section C","1998","54","3","359","361","10.1107/S0108270197016363","","","0.71073","MoKα","","0.0963","0.0539","","0.1212","0.1053","","","","1.063","1.146","1.146","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007101","26.094","0.004","9.717","0.002","6.325","0.002","90","","90","","90","","1603.7","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3R)-4,5-dihydro-4,4-dimethyl-3(1H)-2-oxofuran-3-yl(2S)-2-(2,3-dihydro -1,4-benzodioxin-6-yl)propionate","","- C17 H18 O6 -","- C17 H18 O6 -","- C68 H72 O24 -","4","1","LN1022","M. Teresa Vázquez,; M. Dolors Pujol; Xavier Solans","(3<i>S</i>)-4,4-Dimethyl-2-oxotetrahydrofuran-3-yl (2<i>S</i>)-2-(1,4-Benzodioxin-6-yl)propionate","Acta Crystallographica Section C","1998","54","3","428","430","10.1107/S0108270197015618","","","0.71069","MoKα","","0.0872","0.0491","","0.1593","0.1086","","","","0.949","1.104","1.104","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007102","8.897","0.002","11.242","0.004","17.13","0.02","104.46","0.02","93.79","0.02","90.3","0.02","1655","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Piperazinium (2,6-dichlorophenylamino)phenylacetate dihydrate","","- C32 H36 Cl4 N4 O6 -","- C32 H36 Cl4 N4 O6 -","- C64 H72 Cl8 N8 O12 -","2","1","LN1032","Carlo Castellari; Stefano Ottani","Stereochemistry of Anti-Inflammatory Drugs. VI. Piperazinium 2-(2,6-Dichlorophenylamino)phenylacetate Dihydrate, (H~2~PZ)<i>D</i>~2~.2H~2~O","Acta Crystallographica Section C","1998","54","3","415","417","10.1107/S010827019701490X","","","0.71069","MoKα","","0.1017","0.0409","","0.1154","0.0913","","","","1.012","1.089","1.089","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007103","10.153","0.003","12.228","0.003","14.166","0.003","100.284","0.014","98.644","0.011","112.866","0.01","1547","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H30 B F4 N7 O3 Zn -","- C32 H30 B F4 N7 O3 Zn -","- C64 H60 B2 F8 N14 O6 Zn2 -","2","1","MU1311","Fenton, David E.; Adams, Harry; He, Qing-Yu","(Benzoato-<i>O</i>){tris[(2-benzimidazolyl-<i>N</i>^3^)methyl]amine-<i>N</i>}zinc(II) Tetrafluoroborate Methanol Solvate","Acta Crystallographica Section C","1998","54","3","286","287","10.1107/S0108270197015941","","","0.71073","MoKα","","0.0723","0.0567","","0.1528","0.1475","","","","0.986","1.125","1.125","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007104","10.441","0.001","10.772","0.001","11.079","0.001","87.95","0.01","75.16","0.01","62.9","0.01","1067.5","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","1-(3,4-dichloro)phenyl-4-(2-thiophenyl)-5,5-dicarbethoxy pyrrolidine-2-one","","- C20 H19 Cl2 N O5 S -","- C20 H19 Cl2 N O5 S -","- C40 H38 Cl4 N2 O10 S2 -","2","1","MU1338","Ray, Jayanta Kumar; Chakraborty, Arindam; Adhikari, Sujit Das; Chinnakali, Kandasamy; Fun, Hoong-Kun","Diethyl 1-(3,4-Dichlorophenyl)-5-oxo-3-(2-thienyl)-2,2-pyrrolidinedicarboxylate","Acta Crystallographica Section C","1998","54","3","368","370","10.1107/S0108270197016715","","","0.71073","MoKα","","0.091","0.053","","0.141","0.119","","","","1.015","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007105","9.6642","0.0006","9.5221","0.0006","16.1965","0.0004","90","","107.036","0.002","90","","1425.06","0.13","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diacetonitrilediaquotrichloroerbium(III) Acetonitrile Solvate.","","- C6 H13 Cl3 Er N3 O2 -","- C6 H13 Cl3 Er N3 O2 -","- C24 H52 Cl12 Er4 N12 O8 -","4","1","MU1345","Errington, William; Spry, Marcus P.; Willey, Gerald R.","Bis(acetonitrile-<i>N</i>)diaquatrichloroerbium(III) Acetonitrile Solvate","Acta Crystallographica Section C","1998","54","3","290","291","10.1107/S0108270197015163","","","0.71073","MoKα","","0.034","0.024","","0.052","0.05","","","","0.985","1.023","1.023","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007106","8.082","0.002","12.554","0.002","16.724","0.005","74.02","0.02","85.21","0.03","89.39","0.02","1625.4","0.7","295.2","","295.2","","","","","","","","","6","P -1","-P 1","2","","","","- C14 H16 Cl2 N P Pd -","- C14 H16 Cl2 N P Pd -","- C56 H64 Cl8 N4 P4 Pd4 -","4","2","MU1349","Spicer, Mark D.","<i>cis</i>-Dichloro(2-diphenylphosphinoethylamine-<i>N</i>,<i>P</i>)palladium(II)","Acta Crystallographica Section C","1998","54","3","308","310","10.1107/S0108270197016752","","","0.71069","MoKα","","0.065","0.042","","0.039","0.036","","","","","1.117","1.117","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007107","5.8839","0.0011","9.104","0.002","9.205","0.002","92.6","0.02","101.697","0.015","107.608","0.014","457.21","0.17","293","","293","","","","","","","","","6","P -1","-P 1","2","","trans-Diperchlorato-bis(pyridine-2-carboxamide-N',O)copper(II)","","- C12 H12 Cl2 Cu N4 O10 -","- C12 H12 Cl2 Cu N4 O10 -","- C12 H12 Cl2 Cu N4 O10 -","1","0.5","MU1350","Sieroń, Lesław; Bukowska-Strzyżewska, Maria","<i>trans</i>-Diperchloratobis(pyridine-2-carboxamide-<i>N</i>^1^,<i>O</i>)copper(II)","Acta Crystallographica Section C","1998","54","3","322","324","10.1107/S010827019701487X","","","0.71073","MoKα","","0.0404","0.0362","","","","0.0947","","","","","","1.072","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007108","17.491","0.002","12.428","0.001","19.081","0.002","90","","96.18","0.01","90","","4123.7","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,1,1,2,2,2,3,3,3-nonacarbonyl-1,2-(μ-bis(diphenylphosphino)methane) -3-(trimethylphosphite-P)triangulotriruthenium(0)","","- C37 H31 O12 P3 Ru3 -","- C37 H31 O12 P3 Ru3 -","- C148 H124 O48 P12 Ru12 -","4","1","MU1351","Shawkataly, Omar bin; Ramalingam, Kuppukkannu; Mohmad Ashari,Dewiyana; Fun, Hoong-Kun; Abdul Razak, Ibrahim","1,1,1,2,2,2,3,3,3-Nonacarbonyl-1,2-[μ-bis(diphenylphosphino)methane-<i>P</i>',<i>P</i>'']-3-(trimethylphosphite-<i>P</i>)triangulotriruthenium(0)","Acta Crystallographica Section C","1998","54","3","329","331","10.1107/S0108270197014881","","","0.71073","MoKα","","0.0337","0.0274","","0.0747","0.0722","","","","1.029","1.076","1.076","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007109","13.849","0.001","13.94","0.001","22.024","0.002","95.77","0.01","99.45","0.01","91.51","0.01","4168.9","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H94 Mo12 N15 O47 P5 Si -","- C30 H92 Mo12 N15 O46.5 P5 Si -","- C60 H184 Mo24 N30 O93 P10 Si2 -","2","1","MU1354","Fun, Hoong-Kun; Chinnakali, Kandasamy; Yip, Boon-Chuan; Niu, Jing-Yang; Wang, Jing-Ping; You, Xiao-Zeng","A Dihydrate Complex of Molybdosilicic Acid and Hexamethylphosphoramide, [{(CH~3~)~2~N}~3~PO]~5~[H~4~SiMo~12~O~40~].2H~2~O","Acta Crystallographica Section C","1998","54","3","327","329","10.1107/S0108270197015850","","","0.71073","MoKα","","0.065","0.044","","0.125","0.116","","","","0.961","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007110","8.839","0.003","13.858","0.003","37.155","0.012","90","","92.51","0.03","90","","4547","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","hexacarbonyl-1κ^3^C,2κ^3^C-μ~2~-(4-methylbenz-1-al)hydrazone-1:2κ^2^N^1^- -N^1^-[5-methyl-2(2,3-η)-benzylidene-1κC^3^]-di-iron","","- C22 H16 Fe2 N2 O6 -","- C22 H16 Fe2 N2 O6 -","- C176 H128 Fe16 N16 O48 -","8","2","MU1358","Zachara, Janusz; Zimniak, Andrzej","An Azomethylene Carbonyliron Complex from 4,4'-Dimethylbenzaldazine, μ~2~,η^2^,σ^3^-(4-Methylbenz-1-al)hydrazone-<i>N</i>^1^-(5-methylbenzylidene)hexacarbonyldiiron","Acta Crystallographica Section C","1998","54","3","353","355","10.1107/S0108270197015990","","","0.71073","MoKα","","0.0525","0.0327","","0.0899","0.0741","0.0805","","","1.144","1.104","1.104","1.024","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007111","9.72","0.002","9.735","0.002","10.111","0.002","93.12","0.02","112.8","0.02","108.05","0.02","821.8","0.4","295","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H21 Al Cl N -","- C16 H21 Al Cl N -","- C32 H42 Al2 Cl2 N2 -","2","1","MU1362","Craig, Fiona J.; Kennedy, Alan R.; Mulvey, Robert E.","Chloro(dibenzylamine-<i>N</i>)dimethylaluminium(III)","Acta Crystallographica Section C","1998","54","3","335","337","10.1107/S010827019701679X","","","0.71069","MoKα","","0.077","0.036","","0.048","0.043","","","","","1.614","1.614","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007112","8.907","0.001","10.042","0.002","11.927","0.002","90","","103.64","0.01","90","","1036.7","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 Cu N4 O10 -","- C18 H22 Cu N4 O10 -","- C36 H44 Cu2 N8 O20 -","2","0.5","MU1367","Yi Wang; Helen Stoeckli-Evans","Diaquabis(5-methoxycarbonyl-3,6-dimethylpyrazine-2-carboxylato-<i>N</i>^1^,<i>O</i>)copper(II)","Acta Crystallographica Section C","1998","54","3","306","308","10.1107/S0108270197015643","","","0.71073","MoKα","","0.101","0.045","","0.116","0.089","","","","1.144","1.131","1.131","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007113","7.3941","0.0005","10.532","0.001","25.684","0.002","90","","90.585","0.005","90","","2000","0.3","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H28 Cl3 Co N4 O3 -","- C16 H28 Cl3 Co N4 O3 -","- C64 H112 Cl12 Co4 N16 O12 -","4","1","MU1372","Edwards, Karen-Leigh T.; Alcock, Nathaniel W.; Busch, Daryle H.","The Monomeric Form of a Cobalt(III) Complex of a Tetraaza Macrocyclic Ligand with a Dangling Carboxylate Arm","Acta Crystallographica Section C","1998","54","3","340","342","10.1107/S0108270197015175","","","0.71073","MoKα","","0.0934","0.0521","","0.0996","0.0866","","","","1.06","1.122","1.122","","","","","has coordinates,has Fobs","189124","2020-10-21","18:00:00",""
"2007114","15.896","0.002","11.1691","0.0005","10.365","0.001","90","","90","","90","","1840.2","0.3","180","2","180","2","","","","","","","","7","P n a 21","P 2c -2n","33","","Chloro[N,N',N''-trimethyl-1,5,9-triazacyclododecane] Zinc(II) Hexafluorophosphate.","","- C12 H27 Cl F6 N3 P Zn -","- C12 H27 Cl F6 N3 P Zn -","- C48 H108 Cl4 F24 N12 P4 Zn4 -","4","1","MU1373","Alcock, Nathaniel W.; Clase, Howard J.; Siltchenko, Svetlana; Rybak-Akimova, Elena; Busch, Daryle H.","Chloro(<i>N</i>,<i>N</i>',<i>N</i>''-trimethyl-1,5,9-triazacyclododecane-κ^3^<i>N</i>)zinc(II) Hexafluorophosphate","Acta Crystallographica Section C","1998","54","3","338","340","10.1107/S0108270197015187","","","0.71073","MoKα","","0.0189","0.0171","","","","0.0427","","","","","","1.032","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007115","22.935","0.004","27.125","0.003","8.332","0.001","90","","90","","90","","5183.4","1.2","296","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Ambroxol Theophylline-7-Acetate Salt Monohydrate","Cyclohexanol-4-[[(2-amino-3,5-dibromophenyl)methyl]amino]-trans -mono(1,2,3,6-tetrahydro-1,3-dimethyl-2,6,dioxo-7H-purine-7-acetate) (salt)","","- C22 H30 Br2 N6 O6 -","- C22 H30 Br2 N6 O6 -","- C176 H240 Br16 N48 O48 -","8","1","NA1242","Giuseppetti, Giuseppe; Mazzi, Fiorenzo; Tadini, Carla; Giordano, Ferdinando; Bettinetti, Giampiero; Sorrenti, Milena; Gazzaniga, Andrea","Ambroxol Theophylline-7-acetate Salt Monohydrate","Acta Crystallographica Section C","1998","54","3","407","410","10.1107/S0108270196009328","","","0.7107","MoKα","","0.174","0.086","","0.19","","0.143","","","1.187","","","1.317","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2007116","7.089","0.001","9.648","0.002","9.798","0.001","94.12","0.01","108.04","0.01","101.22","0.02","618.71","0.18","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H13 N3 -","- C15 H13 N3 -","- C30 H26 N6 -","2","1","NA1306","Nicoló, Francesco; Panzalorto, Manuela; Scopelliti, Rosario; Grassi, Giovanni; Risitano, Francesco","5,7-Dimethyl-3-phenyl-1,2,4-benzotriazine","Acta Crystallographica Section C","1998","54","3","405","407","10.1107/S0108270197014972","","","0.71073","MoKα","","0.082","0.034","","0.081","0.073","","","","0.748","1.02","1.02","","","","","has coordinates","211412","2020-10-21","18:00:00",""
"2007117","9.906","0.003","10.635","0.003","8.126","0.001","90.56","0.02","94.84","0.03","116.49","0.02","762.4","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Cyclohexanone-2,4,4,6-tetramethylester","","- C14 H18 O9 -","- C14 H18 O9 -","- C28 H36 O18 -","2","1","OA1039","Hughes, Andrew B.; Mackay, Maureen F.","Cyclohexanone-2,4,4,6-tetramethyl Ester","Acta Crystallographica Section C","1998","54","3","380","382","10.1107/S0108270197014984","","","1.5418","CuKα","","0.047","0.044","","0.124","0.121","","","","1.066","1.092","1.092","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007118","12.335","0.003","14.052","0.001","13.492","0.003","90","","91.68","0.01","90","","2337.6","0.8","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","(1R)-1-[(2R,4R,5S)-5-Phenyl-3-(toluene-4-sulfonyl)-oxazolidin-2-yl] -indan-2-one","","- C26 H25 N O4 S -","- C26 H25 N O4 S -","- C104 H100 N4 O16 S4 -","4","2","QA0029","Berger, Bernd; Bolte, Michael","(1<i>R</i>)-1-[(2<i>R</i>,4<i>R</i>,5<i>S</i>)-4-Methyl-5-phenyl-3-tosyl-1,3-oxazolidin-2-yl]indan-2-one","Acta Crystallographica Section C","1998","54","3","IUC9800006","","10.1107/S010827019809979X","","","1.5418","CuKα","","0.0311","0.0302","","","","0.0828","","","","","","1.058","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007119","7.086","0.002","8.329","0.003","11.655","0.005","71.22","0.05","85.53","0.03","86.14","0.04","648.6","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","efaroxan hydrochloride","[2-[2-ethyl-2,3-dihydro-2-benzofuranyl]]-2-imidazolinium chloride","","- C13 H17 Cl N2 O -","- C13 H17 Cl N2 O -","- C26 H34 Cl2 N4 O2 -","2","1","QB0028","Belin, Claude; Pena, Richard; Chauvet, Alain; Ribet, Jean Paul; Maurel, Jean Louis","Polymorph II of 2-(2-Ethyl-2,3-dihydro-1-benzofuran-2-yl)imidazolinium Chloride","Acta Crystallographica Section C","1998","54","3","IUC9800004","","10.1107/S0108270198099818","","","0.7109","MoKα","","0.211","0.0504","","","","0.1512","","","","","","0.855","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007120","9.5229","0.0011","9.5229","0.0011","14.736","0.002","90","","90","","90","","1336.3","0.3","170","1","170","1","","","","","","","","3","P 43","P 4cw","78","O-methyldehydronorcacalol","","","- C15 H18 O3 -","- C15 H18 O3 -","- C60 H72 O12 -","4","1","QB0029","Parvez, Masood; Kulanthaivel, Palaniappan; Benn, Michael H.","<i>O</i>-Methyldehydronorcacalol","Acta Crystallographica Section C","1998","54","3","IUC9800005","","10.1107/S0108270198099806","","","0.71069","MoKα","","0.0844","0.0377","","","","0.1065","","","","","","1.027","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007121","5.057","0.002","11.046","0.002","12.531","0.002","88.525","0.014","87.03","0.02","79.29","0.02","686.8","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,3-Dihydro-6,7-dimethyl-2-phenyl-4H-1-benzopyran-4-one","","- C17 H16 O2 -","- C17 H16 O2 -","- C34 H32 O4 -","2","1","QC0001","Suchada Chantrapromma; Narintha Chawaluechai; Chatchanok Karalai; Kan Chantrapromma; Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak","2,3-Dihydro-6,7-dimethyl-2-phenyl-4<i>H</i>-1-benzopyran-4-one","Acta Crystallographica Section C","1998","54","3","IUC9800007","","10.1107/S0108270198099788","","","0.71073","MoKα","","0.0812","0.0521","","0.1658","0.151","","","","1.024","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007122","18.331","0.004","3.678","0.003","17.052","0.001","90","","98.43","0.02","90","","1137.2","1","292","","292","","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","2-(nitramino)pyridine","","- C5 H5 N3 O2 -","- C5 H5 N3 O2 -","- C40 H40 N24 O16 -","8","1","SK1128","Angelova, Olyana; Petrova, Rosica; Atanasov, Vladimir","2-(Nitroamino)pyridine","Acta Crystallographica Section C","1998","54","3","441","442","10.1107/S0108270197015503","","","0.71073","MoKα","","","0.043","","","","0.071","","","","","","1.232","","","","has coordinates","190732","2020-10-21","18:00:00",""
"2007123","8.981","0.004","9.72","0.003","14.451","0.004","104.83","0.03","92.42","0.03","110.62","0.03","1129.1","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Manganese tris(ethylendiamine) ethylenediammonium tetraselenoantimonat","","","- C8 H33 Mn N8 Sb Se4 -","- C8 H33 Mn N8 Sb Se4 -","- C16 H66 Mn2 N16 Sb2 Se8 -","2","1","SK1148","Wendland, Frank; Näther, Christian; Schur, Michael; Bensch, Wolfgang","H~2~N(CH~2~)~2~NH~3~^+^.[Mn{H~2~N(CH~2~)~2~NH~2~}~3~]^2+^.[Sb Se~4~]^3{-^}","Acta Crystallographica Section C","1998","54","3","317","319","10.1107/S0108270197014030","","","0.71073","MoKα","","0.0786","0.0428","","0.1194","0.1073","","","","0.991","1.057","1.057","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007124","14.458","0.001","7.569","0.001","12.768","0.001","90","","105.8","0.01","90","","1344.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,3'-dimethyl-3,3'-bis-(tert-butyldimethylsilyloxy)-octa-1,1'-diyne","","- C22 H42 O2 Si2 -","- C22 H42 O2 Si2 -","- C44 H84 O4 Si4 -","2","0.5","SK1151","Wicki, Andreas; Grüschow, Sabine; Lüthi, Therese; von Grothe, Julia; Capelli, Silvia; Hauser, Jürg; Keese, Reinhart","<i>meso</i>-3,6-Dimethyl-3,6-bis(<i>tert</i>-butyldimethylsilyloxy)-1,7-octadiyne","Acta Crystallographica Section C","1998","54","3","382","384","10.1107/S0108270197016855","","","0.71073","MoKα","","0.067","0.051","","","","0.154","","","","","","1.063","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007125","6.973","0.001","7.678","0.001","14.472","0.001","90","","92.83","0.003","90","","773.87","0.16","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","cis-(αS,1S,2R)-2-methyl-1(α-methylbenzylamino)-cyclohexanecarboxamide","","- C16 H24 N2 O -","- C16 H24 N2 O -","- C32 H48 N4 O2 -","2","1","SK1153","Volk, Franz-Josef; Mattern, Günter; Weckert, Edgar; Frahm, August W.","The Absolute Configuration of <i>cis</i>-(α<i>S</i>,1<i>S</i>,2<i>R</i>)-2-Methyl-1-(α-methylbenzylamino)cyclohexanecarboxamide","Acta Crystallographica Section C","1998","54","3","387","389","10.1107/S0108270197013917","","","0.71073","MoKα","","0.0361","0.0361","","0.0387","0.0387","","","","1.16","1.16","1.16","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007126","9.545","0.001","32.428","0.005","6.81","0.001","90","","90","","90","","2107.9","0.5","292","2","292","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","((1R,2S,4R,5S,6S)-exo-2-acetoxy-3,3,endo-6-trimethylbicyclo[3.1.0] hexan-exo-4-yl) camphanoate","","- C21 H30 O6 -","- C21 H30 O6 -","- C84 H120 O24 -","4","1","SK1154","Krief, Alain; Ollevier, Thierry; Swinnen, Dominique; Norberg, Bernadette; Baudoux, Guy; Evrard, Guy","Synthesis and Absolute Structure Determination of Camphanoate Derivatives of Five Bicyclo[3.1.0]hexane Compounds","Acta Crystallographica Section C","1998","54","3","392","398","10.1107/S0108270197013929","","","1.54178","CuKα","","0.0872","0.0555","","","","0.1586","","","","","","0.98","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007127","14.714","0.001","11.001","0.001","14.736","0.002","90","","118.527","0.008","90","","2095.7","0.4","292","2","292","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C21 H30 O6 -","- C21 H30 O6 -","- C84 H120 O24 -","4","2","SK1154","Krief, Alain; Ollevier, Thierry; Swinnen, Dominique; Norberg, Bernadette; Baudoux, Guy; Evrard, Guy","Synthesis and Absolute Structure Determination of Camphanoate Derivatives of Five Bicyclo[3.1.0]hexane Compounds","Acta Crystallographica Section C","1998","54","3","392","398","10.1107/S0108270197013929","","","1.54178","CuKα","","0.0504","0.0478","","","","0.1329","","","","","","1.045","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007128","11.5461","0.0011","12.2484","0.0007","7.169","0.005","90","","102.487","0.004","90","","989.9","0.7","292","2","292","2","","","","","","","","3","P 1 21 1","P 2yb","4","","((1R,2S,4R,5S)-exo-2-acetoxy-3,3-dimethylbicyclo[3.1.0]hexan-exo-4-yl) camphanoate","","- C20 H28 O6 -","- C20 H28 O6 -","- C40 H56 O12 -","2","1","SK1154","Krief, Alain; Ollevier, Thierry; Swinnen, Dominique; Norberg, Bernadette; Baudoux, Guy; Evrard, Guy","Synthesis and Absolute Structure Determination of Camphanoate Derivatives of Five Bicyclo[3.1.0]hexane Compounds","Acta Crystallographica Section C","1998","54","3","392","398","10.1107/S0108270197013929","","","1.54178","CuKα","","0.0438","0.043","","","","0.1088","","","","","","1.084","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007129","12.806","0.001","22.332","0.003","7.2582","0.001","90","","90","","90","","2075.7","0.4","292","2","292","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","((1R,2S,4R,5S,6R)-exo-2-acetoxy-3,3,exo-6-trimethylbicyclo[3.1.0] hexan-exo-4-yl) camphanoate","","- C21 H30 O6 -","- C21 H30 O6 -","- C84 H120 O24 -","4","1","SK1154","Krief, Alain; Ollevier, Thierry; Swinnen, Dominique; Norberg, Bernadette; Baudoux, Guy; Evrard, Guy","Synthesis and Absolute Structure Determination of Camphanoate Derivatives of Five Bicyclo[3.1.0]hexane Compounds","Acta Crystallographica Section C","1998","54","3","392","398","10.1107/S0108270197013929","","","1.54178","CuKα","","0.0408","0.0394","","","","0.1027","","","","","","1.087","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007130","15.58","0.001","12.889","0.001","6.236","0.0001","90","","99.051","0.004","90","","1236.66","0.13","292","2","292","2","","","","","","","","3","P 1 21 1","P 2yb","4","","((1S,2S,4R,5R,6S)-exo-2-acetoxy-endo-6-(3-butenyl)-3,3,exo-6- trimethylbicyclo[3.1.0]hexan-exo-4-yl) camphanoate","","- C25 H36 O6 -","- C25 H36 O6 -","- C50 H72 O12 -","2","1","SK1154","Krief, Alain; Ollevier, Thierry; Swinnen, Dominique; Norberg, Bernadette; Baudoux, Guy; Evrard, Guy","Synthesis and Absolute Structure Determination of Camphanoate Derivatives of Five Bicyclo[3.1.0]hexane Compounds","Acta Crystallographica Section C","1998","54","3","392","398","10.1107/S0108270197013929","","","1.5418","CuKα","","0.0505","0.0491","","","","0.1298","","","","","","1.081","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007131","5.929","0.001","9.131","0.001","11.716","0.001","107.94","0.01","96.29","0.01","93.88","0.01","596.35","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","OLPADRONATE","Monosodium 3(N,N-dimethyl)-1-hydroxy-1,1'-bisphosphonate, hydrate (Olpadronate)","","- C5 H16 N Na O8 P2 -","- C5 H16 N Na O8 P2 -","- C10 H32 N2 Na2 O16 P4 -","2","1","SX1043","Vega, Daniel; Baggio, Ricardo; Piro, Oscar","Monosodium 3-(Dimethylammonio)-1-hydroxy-1,1-propanediyldiphosphonate Monohydrate (Monosodium Olpadronate Monohydrate)","Acta Crystallographica Section C","1998","54","3","324","327","10.1107/S0108270197013553","","","0.71073","MoKα","","0.0903","0.0419","","0.1253","0.0956","","","","1.1","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007132","7.516","0.001","12.962","0.002","8.55","0.001","90","","97.78","0.01","90","","825.29","0.19","213","","213","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H10 N2 O2 -","- C7 H10 N2 O2 -","- C28 H40 N8 O8 -","4","1","TA1190","Crisp, Geoffrey T.; Jiang, Yin-Lin; Tiekink, Edward R.T.","2-(<i>N</i>-Acetylamino)pent-4-ynamide","Acta Crystallographica Section C","1998","54","3","436","437","10.1107/S0108270197016429","","","0.7107","MoKα","","","0.0441","","","0.0511","","","","","2.151","2.151","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007133","6.8829","0.0002","6.9979","0.0003","7.8655","0.0003","111.529","0.001","95.615","0.002","106.786","0.002","328.45","0.02","153","2","153","2","","","","","","","","3","P -1","-P 1","2","cyclotene hydrate","2-Hydroxy-3-methylcyclopent-2-enone hydrate","","- C6 H10 O3 -","- C6 H10 O3 -","- C12 H20 O6 -","2","1","TA1197","Fayle, Siân E.; Gerrard, Juliet A.; Nursten, Harry E.; Steel, Peter J.","Cyclotene Hydrate, C~6~H~8~O~2~.H~2~O","Acta Crystallographica Section C","1998","54","3","404","405","10.1107/S0108270197013632","","","0.71073","MoKα","","","0.0445","","","","0.1156","","","","","","1.135","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007134","8.54","0.003","9.536","0.002","15.819","0.006","93.31","0.02","94.12","0.03","90.67","0.02","1282.6","0.7","122","0.5","122","0.5","","","","","","","","5","P -1","-P 1","2","","Bis[tetra-n-butylammonium]Bis[(4-cyanophenyl)dithocarbimato]Nickel(II)","","- C48 H80 N6 Ni S4 -","- C48 H80 N6 Ni S4 -","- C48 H80 N6 Ni S4 -","1","0.5","AB1504","Steen B. Schougaard; Thomas Pittelkow; Frederik Krebs; Sine Larsen; Henning O. Sørensen; Daniel R. Greve; Thomas Bjørnholm","Bis(tetra-<i>n</i>-butylammonium) Bis[(4-cyanophenyl)dithiocarbimato(2‒)-<i>S</i>,<i>S</i>']nickel(II)","Acta Crystallographica Section C","1998","54","4","470","473","10.1107/S0108270197016971","","","0.71073","MoKα","","0.0465","0.0352","","0.0621","0.0607","","","","2.474","2.639","2.639","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007135","13.727","0.001","13.727","0.001","8.13","0.001","90","","90","","90","","1531.9","0.2","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","2,3-diiodo-2-buten-1,4-diol","","- C4 H6 I2 O2 -","- C4 H6 I2 O2 -","- C32 H48 I16 O16 -","8","0.5","AB1505","Løiten, Marianne Sveaas; Bjørn Dalhus; Fjαertoft, Berit; Klaveness, Jo","<i>trans</i>-2,3-Diiodo-2-butene-1,4-diol","Acta Crystallographica Section C","1998","54","4","555","557","10.1107/S0108270197014406","","","0.71073","MoKα","","0.0315","0.0271","","0.0531","0.0522","","","","2.239","2.299","2.299","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007136","7.424","0.004","14.303","0.003","26.51","0.002","90","","90","","90","","2815","1.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C16 H14 N2 O S -","- C16 H14 N2 O S -","- C128 H112 N16 O8 S8 -","8","1","AB1510","Elerman, Yalc̨in; Elmali, Ayhan","2-Salicylideneamino-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene-3-carbonitrile","Acta Crystallographica Section C","1998","54","4","529","531","10.1107/S0108270197013991","","","0.71069","MoKα","","0.0371","0.0338","","0.0902","0.0876","","","","1.083","1.238","1.238","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007137","10.8018","0.0009","12.5581","0.0009","10.9691","0.0009","90","","91.052","0.007","90","","1487.7","0.2","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C6 H14 Cl4 N2 O P2 -","- C6 H14 Cl4 N2 O P2 -","- C24 H56 Cl16 N8 O4 P8 -","4","1","AB1517","Hökelek, Tuncer; Kılıç, Zeynel; Dal, Hakan","<i>P</i>,<i>P</i>-Dichloro-<i>N</i>-(dichlorophosphinoyl)-<i>P</i>-(diisopropylamino)monophosphazene","Acta Crystallographica Section C","1998","54","4","523","525","10.1107/S0108270197016983","","","0.71073","MoKα","","","0.045","","","0.063","","","","","2.15","2.15","","","","","has coordinates","278320","2022-10-03","12:00:49",""
"2007138","10.446","0.001","11.045","0.001","11.316","0.001","64.24","0.01","79.2","0.01","85.35","0.01","1155","0.2","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","1,5,8,12-Tetrathiaspiro[6.6]tridecane","","- C9 H16 S4 -","- C9 H16 S4 -","- C36 H64 S16 -","4","2","AB1520","Barrot, Mireia; Fabrias, Gemma; Camps, Francisco; Molins, Elies; Roig, Anna; Maniukiewicz, Waldemar","1,5,8,12-Tetrathiaspiro[6.6]tridecane","Acta Crystallographica Section C","1998","54","4","533","534","10.1107/S0108270197015138","","","0.71069","MoKα","","0.0355","0.0294","","","","0.0876","","","","","","1.122","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007139","15.747","0.001","15.747","0.001","13.148","0.001","90","","90","","90","","3260.3","0.4","173","2","173","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C68 H104 Cl6 Mn N4 -","- C68 H104 Cl6 Mn N4 -","- C136 H208 Cl12 Mn2 N8 -","2","0.25","BK1313","Chang, Ning-Leh; Lynch, Vincent M.; Simonsen, Stanley H.","Tetrakis[1-(1-phenylcyclohexyl)piperidinium] Tetrachloromanganate(II) Dichloride","Acta Crystallographica Section C","1998","54","4","475","476","10.1107/S0108270197005842","","","0.71073","MoKα","","0.0466","0.035","","0.089","0.0842","","","","1.06","1.086","1.086","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007140","11.2065","0.0005","6.0273","0.0004","12.7077","0.0005","90","","105.1","0.03","90","","828.7","0.14","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 N2 O4 -","- C18 H20 N2 O4 -","- C36 H40 N4 O8 -","2","0.5","BK1345","Moreno-Fuquen, Rodolfo; Gambardella, Maria Teresa do Prado; Valderrama-N, Jaime","2:1 Complex of 3-Picoline <i>N</i>-Oxide and Hydroquinone","Acta Crystallographica Section C","1998","54","4","515","517","10.1107/S0108270197016260","","","0.71073","MoKα","","0.0481","0.04","","0.1374","0.123","","","","1.022","0.988","0.988","","","","","has coordinates","197922","2020-10-21","18:00:00",""
"2007141","10.3139","0.0009","7.3105","0.0005","16.735","0.001","90","","90","","90","","1261.82","0.16","298","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C11 H13 N O2 Si -","- C11 H13 N O2 Si -","- C44 H52 N4 O8 Si4 -","4","0.5","BK1347","Garcia, J. Gabriel; Asfaw, Bruktawit; Rodriguez, Augusto; Fronczek, Frank R.","4-Nitro-1-(trimethylsilylethynyl)benzene","Acta Crystallographica Section C","1998","54","4","489","491","10.1107/S0108270197012407","","","1.54184","CuKα","","","0.046","","","0.051","","","","","2.17","2.17","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007142","12.004","0.002","19.108","0.002","20.328","0.002","90","","90","","90","","4662.7","1","220","2","220","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","ferrocenylbenzonitrile","3,6-Dimethoxy-2-[α-ferrocenyl-α-(2',5'-dimethoxy- phenyl)]methylbenzonitrile","","- C28 H27 Fe N O4 -","- C28 H27 Fe N O4 -","- C224 H216 Fe8 N8 O32 -","8","1","BK1350","Zhang, Hongming; Lu, Yingchun; Biehl, Ed","2-[(2,5-Dimethoxyphenyl)(ferrocenyl)methyl]-3,6-dimethoxybenzonitrile","Acta Crystallographica Section C","1998","54","4","462","464","10.1107/S010827019701442X","","","0.71073","MoKα","","0.081","0.043","","0.102","0.086","","","","1.02","1.086","1.086","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007143","7.5011","0.0014","7.1875","0.0013","24.917","0.002","90","","92.9","0.02","90","","1341.7","0.4","243","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 N3 O5 -","- C13 H13 N3 O5 -","- C52 H52 N12 O20 -","4","1","BK1358","Moreno-Fuquen, Rodolfo; De Almeida Santos, Regina Helena; De Castro, Eustaquio Vinicius Ribeiro","1:1 Complex of 2-Aminobenzoic Acid and 3-Methyl-4-nitropyridine <i>N</i>-Oxide","Acta Crystallographica Section C","1998","54","4","517","519","10.1107/S0108270197016272","","","0.71073","MoKα","","0.0825","0.055","","0.1823","0.149","","","","1.064","1.04","1.04","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007146","13.775","0.006","13.775","0.006","30.533","0.005","90","","90","","90","","5794","4","291","2","291","2","","","","","","","","7","I -4 2 d","I -4 2bw","122","","bis(iodo)tetrakis{tris(dimethylamido)phosphineoxide}bismuth(III) pentaiodide","","- C24 H72 Bi I7 N12 O4 P4 -","- C24 H72 Bi I7 N12 O4 P4 -","- C96 H288 Bi4 I28 N48 O16 P16 -","4","0.25","BM1163","Louis J. Farrugia; Nicholas C. Norman; Nigel L. Pickett","Diiodotetrakis[tris(dimethylamino)phosphine oxide-<i>O</i>]bismuth(III) Pentaiodide, [BiI~2~{OP(NMe~2~)~3~}~4~][I~5~]","Acta Crystallographica Section C","1998","54","4","476","479","10.1107/S0108270197015485","","","0.71073","MoKα","","0.0658","0.0305","","0.0765","0.0659","","","","1.001","1.081","1.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007147","11.0474","0.0011","15.6902","0.0012","15.093","0.0011","90","","104.974","0.002","90","","2527.3","0.4","295","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H60 Cu N10 Ni2 O12 -","- C46 H60 Cu N10 Ni2 O12 -","- C92 H120 Cu2 N20 Ni4 O24 -","2","0.5","BM1190","Tahir, M. Nawaz; Ülkü, Dinçer; Atakol, Orhan; Çakırer, Orhan","Bis[μ-<i>N</i>,<i>N</i>'-bis(salicylidene)-1,3-propanediaminato]bis(dimethylformamide)di(μ-nitrito)copper(II)dinickel(II)‒Dimethylformamide (1/2)","Acta Crystallographica Section C","1998","54","4","468","470","10.1107/S0108270197013218","","","0.71073","MoKα","","","0.033","","","0.04","","","","","0.93","0.93","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007148","22.711","0.006","15.498","0.005","14.642","0.004","90","0.02","117.97","0.02","90","0.02","4552","2","294","","294","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H23 N5 O4 -","- C26 H23 N5 O4 -","- C208 H184 N40 O32 -","8","1","CF1173","Essaber, Mohamed; Baouid, Abdesselam; Hasnaoui, Aïssa; Giorgi, Michel; Pierrot, Marcel","Some 1,3-Dipolar Adducts from Benzodiazepine. I. Condensation of Nitrilimines with 2-Methyl-4-phenyl-1,5-benzodiazepines","Acta Crystallographica Section C","1998","54","4","519","521","10.1107/S0108270197016491","","","0.71073","MoKα","","0.148","0.055","","","0.066","","","","","1.783","1.783","","","","","has coordinates,has Fobs","208362","2020-10-21","18:00:00",""
"2007149","12.985","0.001","14.036","0.002","13.314","0.003","90","0.2","102.7","0.3","90","0.3","2367","3","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H25 Cl N4 O2 -","- C27 H25 Cl N4 O2 -","- C108 H100 Cl4 N16 O8 -","4","1","CF1173","Essaber, Mohamed; Baouid, Abdesselam; Hasnaoui, Aïssa; Giorgi, Michel; Pierrot, Marcel","Some 1,3-Dipolar Adducts from Benzodiazepine. I. Condensation of Nitrilimines with 2-Methyl-4-phenyl-1,5-benzodiazepines","Acta Crystallographica Section C","1998","54","4","519","521","10.1107/S0108270197016491","","","0.71073","MoKα","","0.194","0.049","","","0.065","","","","","1.877","1.877","","","","","has coordinates,has Fobs","208377","2020-10-21","18:00:00",""
"2007150","8.2178","0.0008","13.345","0.001","9.7934","0.0009","90","","96.781","0.009","90","","1066.5","0.16","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-Methyl-7,10-dihydro-7,8-benzocoumarin","","- C14 H12 O2 -","- C14 H12 O2 -","- C56 H48 O8 -","4","1","CF1186","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vaylakkavoor T.Ramakrishnan","4-Methyl-7,10-dihydrobenzo[<i>h</i>]coumarin and 4-Methyl-7,8,9,10-tetrahydro-8,9-epoxybenzo[<i>h</i>]coumarin","Acta Crystallographica Section C","1998","54","4","542","544","10.1107/S0108270197016508","","","0.71073","MoKα","","0.0843","0.0379","","0.1039","0.0902","","","","0.852","1.061","1.061","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007151","10.959","0.001","12.963","0.001","7.9905","0.0008","90","","106.081","0.009","90","","1090.73","0.18","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-Methyl-7,10-dihydro-7,8-benzocoumarin-8,9-oxide","","- C14 H12 O3 -","- C14 H12 O3 -","- C56 H48 O12 -","4","1","CF1186","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vaylakkavoor T.Ramakrishnan","4-Methyl-7,10-dihydrobenzo[<i>h</i>]coumarin and 4-Methyl-7,8,9,10-tetrahydro-8,9-epoxybenzo[<i>h</i>]coumarin","Acta Crystallographica Section C","1998","54","4","542","544","10.1107/S0108270197016508","","","0.71073","MoKα","","0.0901","0.04","","0.105","0.0909","","","","0.828","1.056","1.056","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007152","4.901","0.002","6.246","0.002","7.748","0.003","85.86","0.02","73.2","0.03","73.44","0.03","217.62","0.15","173","","100","","","","","","","","","4","P -1","-P 1","2","pyrrolidone","Pyrrolidin-2-one (1-aza-2-cyclopentanone)","","- C4 H7 N O -","- C4 H7 N O -","- C8 H14 N2 O2 -","2","1","CF1205","Richard Goddard; Oliver Heinemann; Carl Krüger; Ildikó Magdó; Franz Mark; Kurt Schaffner","A Low-Temperature Phase of 2-Pyrrolidone","Acta Crystallographica Section C","1998","54","4","501","504","10.1107/S010827019701651X","","","0.71069","MoKα","","0.0761","0.0664","","0.2059","0.1946","","","","1.228","1.273","1.273","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007153","5.873","0.001","9.693","0.001","10.4561","0.0009","90","","104.07","0.01","90","","577.38","0.13","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H3 N3 O4 -","- C4 H3 N3 O4 -","- C16 H12 N12 O16 -","4","1","CF1206","Kennedy, Alan R.; Okoth, Maurice O.; Sheen, David B.; Sherwood, John N.; Vrcelj, Ranko M.","Two New Structures of 5-Nitrouracil","Acta Crystallographica Section C","1998","54","4","547","550","10.1107/S0108270197016521","","","0.71069","MoKα","","0.0558","0.0363","","0.0534","0.0506","","","","","1.95","1.95","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007154","8.858","0.001","6.9619","0.0006","15.822","0.001","90","","95.823","0.008","90","","970.68","0.15","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H9 N3 O5 S -","- C6 H9 N3 O5 S -","- C24 H36 N12 O20 S4 -","4","1","CF1206","Kennedy, Alan R.; Okoth, Maurice O.; Sheen, David B.; Sherwood, John N.; Vrcelj, Ranko M.","Two New Structures of 5-Nitrouracil","Acta Crystallographica Section C","1998","54","4","547","550","10.1107/S0108270197016521","","","0.71069","MoKα","","0.035","0.0297","","0.0502","0.0492","","","","","2.132","2.132","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007155","7.808","0.002","7.056","0.002","11.09","0.003","90","","108.14","0.03","90","","580.6","0.3","150","0.2","150","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Methyl-thio-1,2,4-triazine","","- C4 H5 N3 S -","- C4 H5 N3 S -","- C16 H20 N12 S4 -","4","1","CF1207","Palmer, Michael H.; Parsons, Simon; Smith, Susan; Blake, Alexander J.; Guest, Martyn F.","3-Methylthio-1,2,4-triazine: a Comparison of Experimental and Theoretical Structures","Acta Crystallographica Section C","1998","54","4","550","553","10.1107/S0108270197016533","","","0.71073","MoKα","","0.0347","0.029","","0.0827","0.0777","","","","1.055","1.072","1.072","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007156","13.911","0.003","10.357","0.002","28.782","0.006","90","","102.87","0.02","90","","4042.6","1.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H8 Cl10 -","- C16 H8 Cl10 -","- C128 H64 Cl80 -","8","1","CF1209","Wilson, Claire; Howard, Judith A. K.","Two Dyotropomers Resulting from Irreversible Thermal (4σ+2π) 2H Group Transfer","Acta Crystallographica Section C","1998","54","4","544","547","10.1107/S0108270197016557","","","0.71073","MoKα","","0.1211","0.0459","","0.0735","0.058","","","","1.304","1.427","1.427","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007157","7.0543","0.0007","8.8125","0.0009","15.016","0.001","72.98","0.003","77.562","0.003","69.707","0.003","830.42","0.13","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H16 Cl4 -","- C20 H16 Cl4 -","- C40 H32 Cl8 -","2","1","CF1209","Wilson, Claire; Howard, Judith A. K.","Two Dyotropomers Resulting from Irreversible Thermal (4σ+2π) 2H Group Transfer","Acta Crystallographica Section C","1998","54","4","544","547","10.1107/S0108270197016557","","","0.71073","MoKα","","0.0411","0.0388","","0.0992","0.0947","","","","1.118","1.125","1.125","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007158","30.15","0.01","6.644","0.002","12.685","0.007","90","","102.6","0.04","90","","2479.8","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","MEPHENTERMINE HEMISULFATE","","","- C11 H20 N O3 S0.5 -","- C11 H20 N O3 S0.5 -","- C88 H160 N8 O24 S4 -","8","2","DE1069","Sengupta, Rakhi; Banerjee, Rahul; Dattagupta, J.K.","Mephentermine Hemisulfate Monohydrate: an Adrenergic Agent","Acta Crystallographica Section C","1998","54","4","497","499","10.1107/S0108270197015461","","","1.5418","CuKα","","0.053","0.051","","0.162","0.16","","","","1.197","1.224","1.224","","","","","has coordinates","209422","2020-10-21","18:00:00",""
"2007159","11.253","0.001","13.033","0.001","17.563","0.002","90","","90","","90","","2575.8","0.4","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Bis(1,10-Phenantholine)-copper(ii) tetrathionate","","- C24 H16 Cu N4 O6 S4 -","- C24 H16 Cu N4 O6 S4 -","- C96 H64 Cu4 N16 O24 S16 -","4","0.5","FG1333","Freire, Eleonora; Baggio, Sergio; Baggio, Ricardo; Garland, Maria Teresa","Bis(1,10-phenanthroline-<i>N</i>,<i>N</i>')copper(II) Tetrathionate and Tris(1,10-phenanthroline-<i>N</i>,<i>N</i>')copper(II) Tetrathionate Pentahydrate","Acta Crystallographica Section C","1998","54","4","464","468","10.1107/S0108270197016284","","","0.71073","MoKα","","0.1011","0.0556","","0.1803","0.1422","","","","0.951","1.001","1.001","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007160","11.232","0.004","13.569","0.006","14.654","0.006","99.67","0.01","99.44","0.01","109.75","0.01","2012.6","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tris(1,10-Phenantholine)-copper(ii) tetrathionate, pentahydrate","","- C36 H34 Cu N6 O11 S4 -","- C36 H34 Cu N6 O11 S4 -","- C72 H68 Cu2 N12 O22 S8 -","2","1","FG1333","Freire, Eleonora; Baggio, Sergio; Baggio, Ricardo; Garland, Maria Teresa","Bis(1,10-phenanthroline-<i>N</i>,<i>N</i>')copper(II) Tetrathionate and Tris(1,10-phenanthroline-<i>N</i>,<i>N</i>')copper(II) Tetrathionate Pentahydrate","Acta Crystallographica Section C","1998","54","4","464","468","10.1107/S0108270197016284","","","0.71073","MoKα","","0.1168","0.0577","","0.1576","0.1293","","","","0.93","1.035","1.035","","","","","has coordinates,has disorder","199607","2020-10-21","18:00:00",""
"2007161","31.877","0.007","31.877","0.007","9.614","0.001","90","","90","","120","","8460","3","296","2","296","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C16.33 H25 O4.17 Ru -","- C16.3333 H24 O4.16667 Ru -","- C294 H432 O75 Ru18 -","18","1","FG1341","Meléndez, Enrique; Ilarraza, Raimundo; Yap, Glenn P.A.; Rheingold, Arnold L.","Bis(acetylacetonato-<i>O</i>,<i>O</i>')(η^4^-<i>trans</i>-2,4-hexadiene)ruthenium(II) 1/6-Ethanol Solvate","Acta Crystallographica Section C","1998","54","4","449","451","10.1107/S0108270197016958","","","0.71073","MoKα","","0.1017","0.0514","","0.1261","0.101","","","","1.018","1.073","1.073","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007162","12.802","0.003","11.181","0.003","20.281","0.002","90","","90","","90","","2903","1.1","294","","294","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C18 H21 F O -","- C18 H21 F O -","- C144 H168 F8 O8 -","8","2","FG1351","Fu, Tai Y.; Scheffer, John R.; Trotter, James; Yang, Jie","Structure and Photochemistry of Four Adamantylacetophenones","Acta Crystallographica Section C","1998","54","4","491","496","10.1107/S0108270197015862","","","1.5418","CuKα","","","0.042","","","","0.125","","","","","","1.1","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007163","11.617","0.002","6.643","0.006","20.868","0.002","90","","103.27","0.01","90","","1567.4","1.5","294","","294","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C19 H21 N O -","- C19 H21 N O -","- C76 H84 N4 O4 -","4","1","FG1351","Fu, Tai Y.; Scheffer, John R.; Trotter, James; Yang, Jie","Structure and Photochemistry of Four Adamantylacetophenones","Acta Crystallographica Section C","1998","54","4","491","496","10.1107/S0108270197015862","","","1.5418","CuKα","","","0.057","","","","0.171","","","","","","1.673","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007164","12.021","0.003","20.149","0.003","6.655","0.002","90","","90","","90","","1611.9","0.7","294","","294","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H23 N O -","- C20 H23 N O -","- C80 H92 N4 O4 -","4","1","FG1351","Fu, Tai Y.; Scheffer, John R.; Trotter, James; Yang, Jie","Structure and Photochemistry of Four Adamantylacetophenones","Acta Crystallographica Section C","1998","54","4","491","496","10.1107/S0108270197015862","","","0.7107","MoKα","","","0.048","","","","0.153","","","","","","1.45","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007165","12.987","0.003","18.439","0.005","7.281","0.002","101.23","0.02","98.32","0.02","91.12","0.02","1690.1","0.8","294","","294","","","","","","","","","3","P -1","-P 1","2","","","","- C20 H24 O3 -","- C20 H24 O3 -","- C80 H96 O12 -","4","2","FG1351","Fu, Tai Y.; Scheffer, John R.; Trotter, James; Yang, Jie","Structure and Photochemistry of Four Adamantylacetophenones","Acta Crystallographica Section C","1998","54","4","491","496","10.1107/S0108270197015862","","","0.7107","MoKα","","","0.079","","","","0.248","","","","","","2.02","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007166","7.983","0.004","6.054","0.003","22.595","0.001","90","","95.74","0.01","90","","1086.5","0.8","253","","253","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 N2 O4 -","- C11 H10 N2 O4 -","- C44 H40 N8 O16 -","4","1","FG1373","Moreno-Fuquen, Rodolfo; De Almeida Santos, Regina Helena; Francisco, Regina Helena Porto","Pyridine <i>N</i>-Oxide and 4-Nitrophenol (1:1 Complex)","Acta Crystallographica Section C","1998","54","4","513","515","10.1107/S0108270197013474","","","0.71073","MoKα","","0.0653","0.0382","","0.1289","0.0995","","","","1.003","0.947","0.947","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007167","14.381","0.003","7.697","0.003","14.2869","0.0012","90","","100.801","0.01","90","","1553.4","0.7","294","","294","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C12 H18 Mo N4 O4 -","- C12 H18 Mo N4 O4 -","- C48 H72 Mo4 N16 O16 -","4","1","FG1386","Ehlert, Martin K.; Rettig, Steven J.; Storr, Alan; Trotter, James","A <i>cis</i>-Dioxomolybdenum(VI) Complex, [Mo{N~2~C~3~H~3~C(Me)~2~O}~2~(O)~2~]","Acta Crystallographica Section C","1998","54","4","473","475","10.1107/S0108270197015898","","","0.7107","MoKα","","","0.027","","","","0.053","","","","","","1.14","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007168","23.106","0.013","16.445","0.012","7.985","0.007","90","","90","","90","","3034","4","294","","294","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H17 N S -","- C18 H17 N S -","- C144 H136 N8 S8 -","8","1","FG1388","Fu, Tai Y.; Scheffer, John R.; Trotter, James","3-(4-Cyanophenyl)-2,2-dimethyl-1-phenylpropane-1-thione","Acta Crystallographica Section C","1998","54","4","496","497","10.1107/S0108270197015904","","","0.7107","MoKα","","","0.063","","","","0.206","","","","","","1.225","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007169","36.149","0.011","5.471","0.001","18.673","0.007","90","","109.47","0.03","90","","3481.8","1.9","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3',4""-Didecyl-2,2';5',2"";5"",2""'-quaterthiophene","","- C36 H50 S4 -","- C36 H50 S4 -","- C144 H200 S16 -","4","0.5","FG1393","Wang, Shanger; Brisse, François; Bélanger-Gariépy, Francine; Donat-Bouillud, Anne; Leclerc, Mario","3',4''-Didecyl-2,2':5',2'':5'',2'''-quaterthiophene","Acta Crystallographica Section C","1998","54","4","553","555","10.1107/S0108270197016302","","","1.5418","CuKα","","0.0623","0.0477","","0.1404","","0.1326","","","0.963","","","1.076","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007170","12.558","0.004","5.4771","0.0015","23.207","0.005","90","","90","","90","","1596.2","0.8","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Di(4-nitrobenzenesulfonyl)amine Monohydrate","","- C12 H11 N3 O9 S2 -","- C12 H11 N3 O9 S2 -","- C48 H44 N12 O36 S8 -","4","1","FG1400","Moers, Oliver; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. C. Bis(4-nitrobenzenesulfonyl)amine Monohydrate","Acta Crystallographica Section C","1998","54","4","504","507","10.1107/S0108270197016314","","","0.71073","MoKα","","0.0387","0.0323","","0.074","0.0724","","","","1.063","1.114","1.114","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007171","17.108","0.002","10.45","0.002","15.188","0.003","90","","93.33","0.05","90","","2710.7","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H10 N4 O4 S -","- C12 H10 N4 O4 S -","- C96 H80 N32 O32 S8 -","8","1","FR1057","Aygün, Muhittin; Işik, Şamil; Öcal, Nüket; Tahir, M.Nawaz; Kaban, Şeniz; Büyükgüngör, Orhan","Thiophene-2-carbaldehyde <i>N</i>-(2,4-Dinitrophenyl)-<i>N</i>-methylhydrazone","Acta Crystallographica Section C","1998","54","4","527","529","10.1107/S0108270197015928","","","0.7107","MoKα","","0.0459","0.0347","","0.0771","0.073","","","","0.973","1.013","1.013","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007172","14.3132","0.001","10.5769","0.0015","17.9455","0.0013","90","","107.351","0.006","90","","2593.1","0.5","170","","170","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","r-5-dimethylamino-1,1,t-6-trimethyl-2,t-6a-di-p-tolyl-1,1a,5,6,6a,6b-hexahydro- cis-1a-transoid-6a,6b-3,3a-diaza-cyclopro-pa[e]indene-4,4-dicarbonitrile","","- C29 H33 N5 -","- C29 H33 N5 -","- C116 H132 N20 -","4","1","JZ1241","Breu, Josef; Range, Klaus-Jürgen; Weber, Andreas; Sauer, Jürgen","Nonstereospecific 1,3-Dipolar Cycloaddition Reactions of Azomethine Ylides: Proof of the Structures for Four Diastereoisomeric [3+2] Cycloadducts","Acta Crystallographica Section C","1998","54","4","509","513","10.1107/S010827019701439X","","","0.71069","MoKα","","0.0484","0.0339","","0.0905","0.0871","","","","1.063","1.191","1.191","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007173","16.246","0.003","10.8936","0.0008","20.173","0.003","90","","134.282","0.009","90","","2555.9","0.7","200","","200","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","r-5-dimethylamino-1,1,c-6-trimethyl-2,t-6a-di-p-tolyl-1,1a,5,6,6a,6b-hexahydro- cis-1a-transoid-6a,6b-3,3a-diaza-cyclopro-pa[e]indene-4,4-dicarbonitrile","","- C29 H33 N5 -","- C29 H33 N5 -","- C116 H132 N20 -","4","1","JZ1241","Breu, Josef; Range, Klaus-Jürgen; Weber, Andreas; Sauer, Jürgen","Nonstereospecific 1,3-Dipolar Cycloaddition Reactions of Azomethine Ylides: Proof of the Structures for Four Diastereoisomeric [3+2] Cycloadducts","Acta Crystallographica Section C","1998","54","4","509","513","10.1107/S010827019701439X","","","0.71069","MoKα","","0.0656","0.048","","0.1343","0.1252","","","","0.965","1.073","1.073","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007174","12.156","0.002","14.537","0.0011","14.499","0.0014","90","","100.352","0.011","90","","2520.4","0.5","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","c-2-dimethylamino-r-1,1,5-trimethyl-6-(4-methyl-benzoyl)-t-7a-p-tolyl- 1,2,5,7a-tetrahydro-pyrrolizine-3,3-dicarbonitrile","","- C29 H32 N4 O -","- C29 H32 N4 O -","- C116 H128 N16 O4 -","4","1","JZ1241","Breu, Josef; Range, Klaus-Jürgen; Weber, Andreas; Sauer, Jürgen","Nonstereospecific 1,3-Dipolar Cycloaddition Reactions of Azomethine Ylides: Proof of the Structures for Four Diastereoisomeric [3+2] Cycloadducts","Acta Crystallographica Section C","1998","54","4","509","513","10.1107/S010827019701439X","","","0.71069","MoKα","","0.0556","0.0394","","0.1071","0.1016","","","","1.041","1.159","1.159","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007175","9.2212","0.0004","18.0246","0.001","17.4099","0.0008","90","","101.016","0.005","90","","2840.4","0.2","170","","170","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,1-Dimethyl-4a-pyrolidin-1-yl-2,8b-di-p-tolyl-1,1a,4a,5,6,7,8,8a,8b,8c- decahydro-cis-1a-cis-4a-transoid-8a,8b-transoid-8b,8c-3,3a-diaza-cyclopropa [c]fluoren-4,4-dicarbonitril","","- C34 H39 N5 -","- C34 H39 N5 -","- C136 H156 N20 -","4","1","JZ1241","Breu, Josef; Range, Klaus-Jürgen; Weber, Andreas; Sauer, Jürgen","Nonstereospecific 1,3-Dipolar Cycloaddition Reactions of Azomethine Ylides: Proof of the Structures for Four Diastereoisomeric [3+2] Cycloadducts","Acta Crystallographica Section C","1998","54","4","509","513","10.1107/S010827019701439X","","","0.71069","MoKα","","0.0796","0.0344","","0.0551","0.0503","","","","0.713","0.95","0.95","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007176","7.08","0.003","6.8203","0.0005","29.473","0.004","90","0.008","90.32","0.03","90","0.02","1423.2","0.6","208","2","208","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","Dipyridinomethane cis-Dibromotetrafluoroosmate(IV)","","- C11 H12 Br2 F4 N2 Os -","- C11 H12 Br2 F4 N2 Os -","- C44 H48 Br8 F16 N8 Os4 -","4","1","JZ1245","Höhling, Matthias; Preetz, Wilhelm","Dipyridiniomethane <i>cis</i>-Dibromotetrafluoroosmate(IV), <i>cis</i>-[(C~5~H~5~ N)~2~CH~2~][OsBr~2~F~4~]","Acta Crystallographica Section C","1998","54","4","481","483","10.1107/S0108270197017174","","","0.71069","MoKα","","0.043","0.0261","","","0.0616","0.0734","","","","","","1.17","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007177","9.7824","0.0007","10.583","0.001","16.344","0.001","90","","90","","90","","1692","0.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(R)-2-(4-bromophenyl)-2-oxoethyl 2-methoxymethylpyrrolidine-1- dithiocarboxylate","","- C15 H18 Br N O2 S2 -","- C15 H18 Br N O2 S2 -","- C60 H72 Br4 N4 O8 S8 -","4","1","JZ1254","Biedermann, Matthias; Hartung, Helmut; Dölling, Wolfgang; Verjus, Pierre","(<i>R</i>)- and (<i>S</i>)-2-(4-Bromophenyl)-2-oxoethyl 2-Methoxymethylpyrrolidine-1-dithiocarboxylate","Acta Crystallographica Section C","1998","54","4","507","509","10.1107/S0108270197016570","","","0.71073","MoKα","","0.125","0.0623","","0.1326","0.0941","","","","1.242","1.17","1.17","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007178","7.43","0.004","18.453","0.002","7.686","0.003","90","","96.32","0.02","90","","1047.4","0.7","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2H-1-benzopyran-2-[cyano(methylthio)methylene]","","- C12 H9 N O S -","- C12 H9 N O S -","- C48 H36 N4 O4 S4 -","4","1","JZ1258","Pochat, Francis; L'Haridon, Paul","α-(2<i>H</i>-1-Benzopyran-2-ylidene)-α-(methylthio)acetonitrile, a Chromylidene Acetonitrile","Acta Crystallographica Section C","1998","54","4","531","533","10.1107/S0108270197015874","","","0.7107","MoKα","","","0.058","","","","0.066","","","","","","1.15","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007179","12.1747","0.0016","12.1747","0.0016","13.791","0.002","90","","90","","90","","2044.1","0.5","293","2","293","2","","","","","","","","6","P 43","P 4cw","78","","N,N'-dibutylthiourea-(N-salicylideneglycinato)copper(II)","","- C18 H27 Cu N3 O3 S -","- C18 H27 Cu N3 O3 S -","- C72 H108 Cu4 N12 O12 S4 -","4","1","JZ1262","Warda, Salam A.","An Exact Quasi-Ferrodistortive Ordering in (<i>N</i>,<i>N</i>'-Di-<i>n</i>-butylthiourea-<i>S</i>)(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1998","54","4","460","462","10.1107/S0108270197016582","","","0.71073","MoKα","","0.0545","0.035","","","","0.0803","","","","","","1.018","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007180","7.949","0.001","13.383","0.003","14.34","0.004","104.06","0.02","102.15","0.02","95.93","0.02","1427.3","0.6","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","[1,2-Di(methoxyethyl)cyclopentadienyl]-trichlorozirconium(IV)","","- C11 H17 Cl3 O2 Zr -","- C11 H17 Cl3 O2 Zr -","- C44 H68 Cl12 O8 Zr4 -","4","2","JZ1264","van der Zeijden, Adolphus A. H.; Mattheis, Chris; Fröhlich, Roland","[1,2-Bis(2-methoxyethyl-<i>O</i>)-η^5^-cyclopentadienyl]trichlorozirconium(IV)","Acta Crystallographica Section C","1998","54","4","458","460","10.1107/S0108270197016594","","","0.71073","MoKα","","0.0578","0.0385","","0.1648","0.0978","","","","1.189","1.119","1.119","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007181","8.546","0.001","17.865","0.002","15.044","0.002","90","","98.14","0.02","90","","2273.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C23 H23 N O8 S -","- C23 H23 N O8 S -","- C92 H92 N4 O32 S4 -","4","1","LN1030","Pèpe, Gérard; Jean-Claude Wallet; Amar Habsaoui; Emile M. Gaydou","<i>p</i>-Toluidinium 2'-Hydroxy-3'-methoxy-5'-flavonesulfonate Hydrate","Acta Crystallographica Section C","1998","54","4","525","527","10.1107/S0108270197015631","","","0.71073","MoKα","","0.0451","0.043","","0.088","0.0876","","","","1.003","1.194","1.194","","","","","has coordinates","281832","2023-03-13","07:44:32",""
"2007182","7.471","0.001","7.735","0.001","12.33","0.001","85.043","0.007","73.879","0.008","82.665","0.007","677.94","0.14","295","","","","","","","","","","","6","P -1","-P 1","2","","","","- C14 H12 Cl N O2 S -","- C14 H12 Cl N O2 S -","- C28 H24 Cl2 N2 O4 S2 -","2","1","MU1319","Tarimci, Çelik; Ercan, Filiz; Koçoḡlu, Meltem; Ören , İlkay","<i>N</i>-(2-Hydroxy-5-chlorophenyl)thiophenylacetamide","Acta Crystallographica Section C","1998","54","4","488","489","10.1107/S010827019701545X","","","0.71073","MoKα","","","0.033","","","0.043","","","","","1.11","1.11","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007183","10.317","0.002","5.864","0.004","24.582","0.001","90","","100.15","0.02","90","","1463.9","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[2-(napthalenyl)]-3-(3-nitrophenyl)-2-propen-1-one","","- C19 H13 N O3 -","- C19 H13 N O3 -","- C76 H52 N4 O12 -","4","1","MU1335","Shanmuga Sundara Raj, S.; Ponnuswamy, M. N.; Shanmugam, G.; Nanjundan, S.","1-(2-Naphthalenyl)-3-(3-nitrophenyl)-2-propen-1-one","Acta Crystallographica Section C","1998","54","4","541","542","10.1107/S0108270197015953","","","1.5418","CuKα","","0.029","0.028","","0.118","0.097","","","","1.079","0.925","0.925","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007184","7.596","0.001","15.53","0.002","6.966","0.001","90","","90","","90","","821.75","0.19","293","2","293","2","","","","","","","","5","P n n m","-P 2 2n","58","","Bis (2-chloroimidazolium) hexachloroplatinate(IV)","","- C6 H8 Cl8 N4 Pt -","- C6 H8 Cl8 N4 Pt -","- C12 H16 Cl16 N8 Pt2 -","2","0.25","MU1347","Giovanni Valle; Renato Ettorre","Bis(2-chloro-1<i>H</i>-imidazol-3-ium) Hexachloroplatinate(IV), (C~3~H~4~ClN~2~)~2~[PtCl~6~]","Acta Crystallographica Section C","1998","54","4","448","449","10.1107/S0108270197015965","","","0.7107","MoKα","","0.048","0.041","","0.106","0.101","","","","1.283","1.329","1.329","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007185","9.7495","0.0009","13.0024","0.0014","16.358","0.002","90","","94.096","0.008","90","","2068.4","0.4","293","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(6,7-Dimethyl-2,3-bis(2-pyridyl)-quinoxaline-N,N')-dichloro-palladium(II) hydrate","","- C20 H18 Cl2 N4 O Pd -","- C20 H16 Cl2 N4 O Pd -","- C80 H64 Cl8 N16 O4 Pd4 -","4","1","MU1352","Nicoló, Francesco; Cusumano, Matteo; Di Pietro, Maria Letizia; Scopelliti, Rosario; Bruno, Giuseppe","Dichloro[6,7-dimethyl-2,3-bis(2-pyridyl-<i>N</i>)quinoxaline]palladium(II) Monohydrate","Acta Crystallographica Section C","1998","54","4","485","487","10.1107/S0108270198000511","","","0.71073","MoKα","","0.0357","0.0285","","0.0879","0.0862","","","","1.05","1.159","1.159","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007186","9.337","0.008","7.597","0.004","9.321","0.006","90","","104.46","0.07","90","","640.2","0.8","110","1","110","1","","","","","","","","5","P 1 21 1","P 2yb","4","","L-histidinol phosphate tetrahydrate","","- C6 H20 N3 O8 P -","- C6 H20 N3 O8 P -","- C12 H40 N6 O16 P2 -","2","1","MU1353","Lis, Tadeusz; Mazurek, Jarosław; Okabe, Nobuo","<small>L</small>-Histidinol Phosphate Tetrahydrate: Redetermination at 110 and 240K","Acta Crystallographica Section C","1998","54","4","559","561","10.1107/S0108270197016776","","","0.71073","MoKα","","0.038","0.027","","0.069","0.065","","","","1.104","1.131","1.131","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007187","9.359","0.007","7.621","0.003","9.367","0.006","90","","104.31","0.06","90","","647.4","0.7","240","1","240","1","","","","","","","","5","P 1 21 1","P 2yb","4","","L-histidinol phosphate tetrahydrate","","- C6 H20 N3 O8 P -","- C6 H20 N3 O8 P -","- C12 H40 N6 O16 P2 -","2","1","MU1353","Lis, Tadeusz; Mazurek, Jarosław; Okabe, Nobuo","<small>L</small>-Histidinol Phosphate Tetrahydrate: Redetermination at 110 and 240K","Acta Crystallographica Section C","1998","54","4","559","561","10.1107/S0108270197016776","","","0.71073","MoKα","","0.0579","0.0311","","0.0865","0.0778","","","","1.048","1.083","1.083","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007188","12.686","0.001","12.686","0.001","9.314","0.002","90","","90","","120","","1298.1","0.3","293","2","293","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","","Tris(N,N'-diethylthiourea)copper(I)Iodide","","- C15 H36 Cu I N6 S3 -","- C15 H36 Cu I N6 S3 -","- C30 H72 Cu2 I2 N12 S6 -","2","0.333333","MU1356","Fun, Hoong-Kun; Razak, Ibrahim Abdul; Pakawatchai, Chaveng; Khaokong, Chuanpit; Chantrapromma, Suchada; Saithong, Saowanit","Tris(<i>N</i>,<i>N</i>'-diethylthiourea-<i>S</i>)iodocopper(I) and Tris(<i>N</i>,<i>N</i>'-diethylthiourea-<i>S</i>)iodosilver(I)","Acta Crystallographica Section C","1998","54","4","453","456","10.1107/S0108270197016764","","","0.71073","MoKα","","0.037","0.03","","0.081","0.077","","","","0.994","1.056","1.056","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007189","12.792","0.001","12.792","0.001","9.335","0.001","90","","90","","120","","1322.9","0.2","293","2","293","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","","Tris(N,N'-diethylthiourea)silver(I) Iodide","","- C15 H36 Ag I N6 S3 -","- C15 H36 Ag I N6 S3 -","- C30 H72 Ag2 I2 N12 S6 -","2","0.333333","MU1356","Fun, Hoong-Kun; Razak, Ibrahim Abdul; Pakawatchai, Chaveng; Khaokong, Chuanpit; Chantrapromma, Suchada; Saithong, Saowanit","Tris(<i>N</i>,<i>N</i>'-diethylthiourea-<i>S</i>)iodocopper(I) and Tris(<i>N</i>,<i>N</i>'-diethylthiourea-<i>S</i>)iodosilver(I)","Acta Crystallographica Section C","1998","54","4","453","456","10.1107/S0108270197016764","","","0.71073","MoKα","","0.045","0.027","","0.07","0.065","","","","0.901","1.038","1.038","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007190","25.049","0.004","9.043","0.001","15.956","0.002","90","","102.2","0.01","90","","3532.7","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H13 Co N12 -","- C15 H13 Co N12 -","- C120 H104 Co8 N96 -","8","1","MU1361","Zhong-Ning Chen; Alvin Siu; Cheng-Yong Su; Ian Williams; Bei-Sheng Kang","<i>fac</i>-Triazido(2,2'-bipyridine-<i>N</i>,<i>N</i>')(pyridine-<i>N</i>)cobalt(III)","Acta Crystallographica Section C","1998","54","4","479","481","10.1107/S0108270197016375","","","0.71073","MoKα","","0.0547","0.0351","","0.041","0.0357","","","","1.029","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007191","12.615","0.002","9.514","0.001","13.721","0.001","90","","116.58","0.01","90","","1472.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Catena-(Propionato)(di-2-pyridylamine)-nitrato-copper(II)","","- C13 H14 Cu N4 O5 -","- C13 H14 Cu N4 O5 -","- C52 H56 Cu4 N16 O20 -","4","1","MU1370","Sujittra Youngme; Chaveng Pakawatchai; Hoong-Kun Fun","<i>catena</i>-Poly[[(di-2-pyridyl-<i>N</i>-amine)(propionato-<i>O</i>,<i>O</i>')copper(II)]-μ-nitrato-<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","1998","54","4","451","453","10.1107/S0108270197016405","","","0.71073","MoKα","","0.0493","0.0323","","0.0934","0.0876","","","","0.985","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007192","5.4759","0.0007","7.4682","0.0006","50.997","0.005","90","","90","","90","","2085.5","0.4","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H27 Cl O3 -","- C25 H27 Cl O3 -","- C100 H108 Cl4 O12 -","4","1","NA1312","Kuhl, Alexander; Schollmeyer, Dieter; Schürmann, Markus; Preut, Hans; Kreiser, Wolfgang","17α-(4-Chlorobenzoyloxy)-3-methoxy-13α-gona-1,3,5(10)-triene","Acta Crystallographica Section C","1998","54","4","521","523","10.1107/S010827019701737X","","","1.54178","CuKα","","0.8","0.06","","0.175","0.156","","","","1.044","1.07","1.07","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007193","9.345","0.002","14.683","0.004","11.244","0.003","90","","93.07","0.02","90","","1540.6","0.7","292","","292","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Magnesium sulfate tetraurea monohydrate","","- C4 H18 Mg N8 O9 S -","- C4 H18 Mg N8 O9 S -","- C16 H72 Mg4 N32 O36 S4 -","4","1","NA1321","Todor Todorov; Rosica Petrova; Krasimir Kossev; Josef Macíček; Olyana Angelova","Magnesium Sulfate Tetraurea Monohydrate","Acta Crystallographica Section C","1998","54","4","456","458","10.1107/S0108270197012912","","","0.71073","MoKα","","","0.03","","","","0.047","","","","","","0.966","","","","has coordinates","191097","2020-10-21","18:00:00",""
"2007194","12.643","0.001","12.643","0.001","12.643","0.001","90","","90","","90","","2020.9","0.3","297","2","297","2","","","","","","","","3","P m -3","-P 2 2 3","200","α-(AlMnSi)","α-(AlMnSi)","","- Al4 Mn1.01 Si0.74 -","- Al4.0125 Mn Si0.7375 -","- Al96.3 Mn24 Si17.7 -","24","1","OH1107","Sugiyama, Kazumasa; Kaji, Nobutaka; Hiraga, Kenji","Re-Refinement of α-(AlMnSi)","Acta Crystallographica Section C","1998","54","4","445","447","10.1107/S0108270197015989","","","0.71069","MoKα","","0.066","0.031","","0.062","0.057","","","","0.959","1.09","1.09","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007195","10.753","0.002","18.955","0.004","10.326","0.002","93.87","0.02","117.92","0.01","100.9","0.02","1796.4","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,6-di(triphenylphosphine)-closo-decaborane","","- C36 H38 B10 P2 -","- C36 H38 B10 P2 -","- C72 H76 B20 P4 -","2","1","QA0034","Hai-Jun Yao; Chun-Hua Hu; Jian-Min Dou; Jie Sun; Jin-De Wei; Zu-En Huang; Ruo-Shui Jin; Pei-Ju Zheng","A Neutral Triphenylphosphine-Substituted <i>closo</i>-Decaborane: 1,6-(PPh~3~)~2~B~10~H~8~","Acta Crystallographica Section C","1998","54","4","IUC9800008","","10.1107/S0108270198099764","","","0.71069","MoKα","","","0.0649","","","","0.1799","","","","","","0.984","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007196","12.1045","0.001","21.6675","0.0012","21.1669","0.0014","90","","90","","90","","5551.5","0.7","293","2","293","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","[tris(2-(2-methoxyethoxy)ethyl)amine]potassium hexaiodotetracuprate(I)","","- C30 H66 Cu4 I6 K2 N2 O12 -","- C30 H66 Cu4 I5 K2 N2 O12 -","- C120 H264 Cu16 I20 K8 N8 O48 -","4","0.5","QB0033","Mague, Joel T.","Luminescent Cu^I^ Clusters. Bis({tris[2-(2-methoxyethoxy)ethyl]amine}potassium) Hexaiodotetracuprate(I)","Acta Crystallographica Section C","1998","54","4","IUC9800010","","10.1107/S0108270198099776","","","0.71073","MoKα","","0.1039","0.0311","","0.0931","","0.0723","","","1.012","","","1.102","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2007197","8.543","0.003","12.76","0.004","7.8","0.003","98.39","0.03","114.84","0.03","88.36","0.03","762.8","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H10 F7 N O -","- C17 H10 F7 N O -","- C34 H20 F14 N2 O2 -","2","1","QB0034","Swenson, Dale C.; Yamamoto, Michiharu; Burton, Donald J.","The (1<i>S</i>,9a<i>R</i>) and (1<i>S</i>,9a<i>S</i>) Relative Configurations of 3-Fluoro-1,9a-dihydro-1-phenyl-1,2-bis(trifluoromethyl)-4<i>H</i>-quinolizin-4-one","Acta Crystallographica Section C","1998","54","4","IUC9800009","","10.1107/S0108270198099752","","","0.7107","MoKα","","0.193","0.0587","","0.1861","0.1354","","","","0.978","1.133","1.133","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007198","7.533","0.002","10.306","0.003","20.139","0.005","90","","95.24","0.02","90","","1557","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H10 F7 N O -","- C17 H10 F7 N O -","- C68 H40 F28 N4 O4 -","4","1","QB0034","Swenson, Dale C.; Yamamoto, Michiharu; Burton, Donald J.","The (1<i>S</i>,9a<i>R</i>) and (1<i>S</i>,9a<i>S</i>) Relative Configurations of 3-Fluoro-1,9a-dihydro-1-phenyl-1,2-bis(trifluoromethyl)-4<i>H</i>-quinolizin-4-one","Acta Crystallographica Section C","1998","54","4","IUC9800009","","10.1107/S0108270198099752","","","0.7107","MoKα","","0.0796","0.0379","","0.1268","0.0969","","","","1.025","1.031","1.031","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007199","10.458","0.002","10.925","0.002","12.097","0.002","86.17","0.03","81.83","0.03","76.31","0.03","1328.4","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H16 I N8 Sb -","- C32 H16 I N8 Sb -","- C64 H32 I2 N16 Sb2 -","2","1","SK1152","Kubiak, Ryszard; Razik, Mariola","(Phthalocyaninato)antimony Iodide","Acta Crystallographica Section C","1998","54","4","483","485","10.1107/S0108270197016867","","","0.71073","MoKα","","0.0862","0.0387","","0.1001","0.0859","","","","0.985","1.081","1.081","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007200","14.266","0.002","13.528","0.001","11.747","0.001","90","","90","","90","","2267.1","0.4","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","9-(4-DIMETHYLAMINOPHENYL) 3,4,6,9,10-HEXAHYDRO 2,2,8,8-TETRAMETHYL 1,8(2H,5H)-ACRIDINE DIONE","","- C25 H32 N2 O2 -","- C25 H32 N2 O2 -","- C100 H128 N8 O8 -","4","1","VJ1060","V.K. Ganesh; D.Velmurugan; M.Bidya Sagar; P.Murugan","9-(4-Dimethylaminophenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydro-1,8(2<i>H</i>,5<i>H</i>)-acridinedione","Acta Crystallographica Section C","1998","54","4","557","559","10.1107/S0108270197016727","","","0.71073","MoKα","","0.1029","0.0565","","0.1507","0.1261","","","","1.032","1.126","1.126","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007201","5.4376","0.0005","7.2577","0.0008","22.773","0.002","90","","90","","90","","898.72","0.15","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","D-PHENYLGLYCINE HYDROCHLORIDE","D-α-Aminophenyl acetic acid hydrochloride","","- C8 H10 Cl N O2 -","- C8 H10 Cl N O2 -","- C32 H40 Cl4 N4 O8 -","4","1","VJ1074","Ravichandran, S.; Dattagupta, J. K.; Chakrabarti, Chandana","<small>D</small>-Phenylglycine Hydrochloride","Acta Crystallographica Section C","1998","54","4","499","501","10.1107/S0108270197014674","","","0.71073","MoKα","","0.045","0.035","","0.127","0.106","","","","0.768","0.747","0.747","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007202","9.8899","0.0013","10.1168","0.001","10.5673","0.0009","86.702","0.009","88.222","0.011","72.206","0.009","1004.95","0.19","293","2","","","","","","","","","","4","P -1","-P 1","2","","8-hydroxyquinoline salicylate-salicylic acid complex","","- C23 H19 N O7 -","- C23 H19 N O7 -","- C46 H38 N2 O14 -","2","1","VJ1075","Jebamony, Justin Robert; Thomas Muthiah, Packianathan","8-Hydroxyquinolinium‒Salicylate‒Salicylic Acid (1/1/1) Complex, C~9~H~8~NO^+^.C~7~H~5~O~3~^{-^}.C~7~H~6~O~3~","Acta Crystallographica Section C","1998","54","4","539","540","10.1107/S0108270197013930","","","0.71069","MoKα","","","0.0313","","","","0.009","","","","","","1.044","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007203","11.188","0.004","13.672","0.009","27.352","0.002","90","","90","","90","","4184","3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C28 H20 N2 O -","- C28 H20 N2 O -","- C224 H160 N16 O8 -","8","1","AB1463","Banumathi, Sankaran; Velmurugan, Devadasan; Raghunathan, Raghavachary; Shanmuga sundaram, Muthian","1',3'-Diphenylspiro[anthracene-9(10i H),5'(4'<i>H</i>)-pyrazol]-10-one","Acta Crystallographica Section C","1998","54","5","629","630","10.1107/S0108270197017411","","","1.5418","CuKα","","0.0714","0.059","","0.1735","0.1634","","","","1.103","1.183","1.183","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007204","9.346","0.001","14.441","0.001","24.524","0.002","90","0.01","97.13","0.01","94.55","0.01","3273.8","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-benzoyl-2,3,4a,6-tetraphenyl-4a,5,6,7-tetrahydro-1H-[1,3]oxazino[3,2-a] [1,5]benzodiazepin-1-one","","- C43 H32 N2 O3 -","- C43 H32 N2 O3 -","- C172 H128 N8 O12 -","4","2","AB1494","Xu, Jiaxi; Jin, Sheng; Zhang, Zeying; Mak, Thomas C. W.","7-Benzoyl-2,3,4a,6-tetraphenyl-4a,5,6,7-tetrahydro-1<i>H</i>-[1,3]oxazino[3,2-<i>a</i>][1,5]benzodiazepin-1-one","Acta Crystallographica Section C","1998","54","5","666","668","10.1107/S010827019701740X","","","0.71073","MoKα","","0.2057","0.0451","","0.179","0.113","","","","0.973","1.163","1.163","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007205","7.0939","0.0006","9.2625","0.0008","11.657","0.001","90","","97.672","0.001","90","","759.09","0.11","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Acetaminophen","4-acetaminophenol","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C32 H36 N4 O8 -","4","1","AV1018","Dmitry Yu. Naumov; Marina A. Vasilchenko; Judith A. K. Howard","The Monoclinic Form of Acetaminophen at 150K","Acta Crystallographica Section C","1998","54","5","653","655","10.1107/S0108270197018386","","","0.71073","MoKα","","0.0671","0.0555","","0.1119","0.1069","","","","1.185","1.209","1.209","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007206","26.831","0.002","15.2944","0.0007","24.952","0.001","90","","94","0.01","90","","10214.5","1","296","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H12 Cl12 O2 -","- C18 H12 Cl12 O2 -","- C288 H192 Cl192 O32 -","16","2","BK1349","Garcia, J. Gabriel; Fronczek, Frank R.","<i>endo</i>-<i>endo</i>-<i>anti</i> Diels‒Alder Diadduct of Hexachlorocyclopentadiene with 1,6-Dioxacyclodeca-3,8-diene","Acta Crystallographica Section C","1998","54","5","645","647","10.1107/S0108270197014005","","","0.71073","MoKα","","","0.057","","","0.039","","","","","1.243","1.243","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2007207","9.295","0.001","9.295","0.001","17.689","0.003","90","","90","","120","","1323.5","0.3","293","2","293","2","","","","","","","","5","P -6 2 c","P -6c -2c","190","","Tri-aquo-tris-(oxydiacetate) (europium(III) lanthanum(III))-pentahydrate","","- C12 H28 Eu La O23 -","- C12 H12 Eu La O22.98 -","- C24 H24 Eu2 La2 O45.96 -","2","0.166667","BK1364","Baggio, Ricardo; Garland, Maria Teresa; Perec, Mireille","Triaquatris(μ-oxydiacetato)europium(III)lanthanum(III) Pentahydrate","Acta Crystallographica Section C","1998","54","5","591","594","10.1107/S0108270197017356","","","0.71073","MoKα","","0.0267","0.023","","0.065","0.0632","","","","1.09","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007208","10.309","0.002","11.451","0.002","13.361","0.003","96.706","0.002","93.109","0.003","105.188","0.002","1505.8","0.5","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H30 N6 Ni O6 -","- C32 H30 N6 Ni O6 -","- C64 H60 N12 Ni2 O12 -","2","1","BM1157","Tahir, M. Nawaz; Ülkü, Dinçer; Atakol, Orhan; Bas̨gut, Özlem","{2-[(2-Hydroxy-5-methylphenyl)iminomethyl]-4,6-dinitrophenolato(2 ‒)-<i>O</i>,<i>N</i>,<i>O</i>'}tris(3-methylpyridine-<i>N</i>)nickel(II)","Acta Crystallographica Section C","1998","54","5","623","625","10.1107/S0108270197016545","","","0.71069","MoKα","","","0.042","","","0.047","","","","","0.83","0.83","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007209","9.999","0.001","13.867","0.002","8.911","0.004","90.81","0.02","91.18","0.02","104.91","0.01","1193.5","0.6","288","2","288","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H35 N7 Ni S2 -","- C18 H35 N7 Ni S2 -","- C36 H70 N14 Ni2 S4 -","2","1","BM1168","Choi, Ki Young; Kim, Dong Won; Kim, Kyung-Han; Oh, Mi-Ran; Suh, Il-Hwan","Co-Crystallized (Macrocyclic tetraamine)bis(thiocyanato-<i>N</i>)nickel(II) Complexes","Acta Crystallographica Section C","1998","54","5","627","628","10.1107/S0108270197017368","","","0.71069","MoKα","","0.1058","0.0583","","0.1073","0.0936","","","","1.27","1.438","1.438","","","","","has coordinates","197043","2020-10-21","18:00:00",""
"2007210","13.436","0.002","14.584","0.004","14.327","0.003","90","","104.891","0.015","90","","2713.1","1","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5,15-Bis(3,5-di-tert-butylphenyl)-10,20-bis(trimethylsilylethynyl)porphyrin","","- C58 H70 N4 Si2 -","- C58 H70 N4 Si2 -","- C116 H140 N8 Si4 -","2","0.5","BM1176","Huuskonen, S.-P. Juhani; Wilson, G. Scott; Anderson, Harry L.","5,15-Bis(3,5-di-<i>tert</i>-butylphenyl)-10,20-bis(trimethylsilylethynyl)porphyrin","Acta Crystallographica Section C","1998","54","5","662","664","10.1107/S0108270197017162","","","1.54184","CuKα","","0.0466","0.0409","","","0.1155","0.1198","","","","","","1.055","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007211","19.639","0.003","13.143","0.002","15.1992","0.0014","90","","101.845","0.013","90","","3839.6","0.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetrachloro-bis[3-(2-pyridyl)pyrazolato]-bis(N,N'-dimethyformamide) diindium(III) bis(N,N'-dimethyformamide) solvate","","- C28 H40 Cl4 In2 N10 O4 -","- C28 H40 Cl4 In2 N10 O4 -","- C112 H160 Cl16 In8 N40 O16 -","4","0.5","BM1206","Ward, Michael D.; Mann, Karen L. V.; Jeffery, John C.; McCleverty, Jon A.","A Dinuclear Indium(III) Complex with Two Pyrazolate Bridging Ligands","Acta Crystallographica Section C","1998","54","5","601","603","10.1107/S0108270197019185","","","0.71073","MoKα","","0.0428","0.0275","","0.0696","0.0643","","","","1.029","1.074","1.074","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007212","8.9913","0.0005","13.1001","0.001","16.6041","0.001","90","","90","","90","","1955.7","0.2","293","1","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2-deoxy-3epiryanodol","","","- C20 H32 O7 -","- C20 H32 O7 -","- C80 H128 O28 -","4","1","BS1023","Drouin, Marc; Dodier, Marco; Ruest, Luc","3D/2D Hydrogen-Bond Network Preferences for Five New Ryanoid Derivatives","Acta Crystallographica Section C","1998","54","5","687","693","10.1107/S0108270197016843","","","1.54184","CuKα","","0.0313","0.0304","","0.0842","0.0832","","","","1.052","1.059","1.059","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007213","8.914","0.0005","18.1678","0.0013","25.326","0.002","90","","90","","90","","4101.5","0.5","293","2","293","2","","","","","","","","3","I 2 2 2","I 2 2","23","2,3-dideoxy-2,3-dihydroryanodol","","","- C20 H35 O7.5 -","- C20 H34 O7.429 -","- C160 H272 O59.432 -","8","1","BS1023","Drouin, Marc; Dodier, Marco; Ruest, Luc","3D/2D Hydrogen-Bond Network Preferences for Five New Ryanoid Derivatives","Acta Crystallographica Section C","1998","54","5","687","693","10.1107/S0108270197016843","","","1.54184","CuKα","","0.043","0.039","","0.108","0.1039","","","","1.024","1.035","1.035","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007214","9.7509","0.0005","10.3005","0.0008","19.5609","0.0013","90","","101.937","0.005","90","","1922.2","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C40 H56 O12 -","- C40 H56 O12 -","- C80 H112 O24 -","2","1","BS1023","Drouin, Marc; Dodier, Marco; Ruest, Luc","3D/2D Hydrogen-Bond Network Preferences for Five New Ryanoid Derivatives","Acta Crystallographica Section C","1998","54","5","687","693","10.1107/S0108270197016843","","","0.71073","Molybdenum","","0.0549","0.0379","","0.0939","0.0829","","","","1.036","1.082","1.082","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007215","10.321","0.003","13.917","0.005","29.196","0.004","90","","90","","90","","4194","2","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","cinnzeylanol","","","- C40 H74.3 O19.15 -","- C40 H64 O19.154 -","- C160 H256 O76.616 -","4","1","BS1023","Drouin, Marc; Dodier, Marco; Ruest, Luc","3D/2D Hydrogen-Bond Network Preferences for Five New Ryanoid Derivatives","Acta Crystallographica Section C","1998","54","5","687","693","10.1107/S0108270197016843","","","0.71073","MolybdenumKα","","0.0855","0.0617","","0.1519","0.14","","","","1.038","1.143","1.143","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007216","9.0121","0.001","18.08","0.004","25.476","0.003","90","","90","","90","","4151","1.1","293","","293","","","","","","","","","3","P 2 21 21","P 2bc 2","18","2-deoxyryanodol","","","- C20 H34.5 O8.25 -","- C20 H34.5 O8.125 -","- C160 H276 O65 -","8","2","BS1023","Drouin, Marc; Dodier, Marco; Ruest, Luc","3D/2D Hydrogen-Bond Network Preferences for Five New Ryanoid Derivatives","Acta Crystallographica Section C","1998","54","5","687","693","10.1107/S0108270197016843","","","1.54184","CopperKα","","0.0611","0.0553","","0.1585","0.1509","","","","1.041","1.075","1.075","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007217","12.178","0.003","13.885","0.003","7.143","0.003","90","","90","","90","","1207.8","0.6","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Diaquacobalt Tetracyanonickelate Tetrahydrate","","- C4 H12 Co N4 Ni O6 -","- C4 H12 Co N4 Ni O6 -","- C16 H48 Co4 N16 Ni4 O24 -","4","0.5","BS1042","Niu, Tianyan; Crisci, Gerardo; Lu, Jian; Jacobson, Allan J.","Diaquacobalt Tetracyanonickelate Tetrahydrate","Acta Crystallographica Section C","1998","54","5","565","567","10.1107/S0108270197018003","","","0.71073","MoKα","","0.0463","0.0362","","0.1069","0.1028","","","","1.061","1.124","1.124","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007218","6.775","0.005","11.146","0.003","7.055","0.004","90","","111.72","0.06","90","","494.9","0.5","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","6,6'-dimethyl-2,2'-bipyridyl","6,6'-dimethyl-2,2'-bipyridyl","","- C12 H12 N2 -","- C12 H12 N2 -","- C24 H24 N4 -","2","0.5","CF1167","Coles, Simon J.; Hursthouse, Michael B.; Sengül, Abdurrahman; Gillard, Robert D.","6,6'-Dimethyl-2,2'-bipyridyl","Acta Crystallographica Section C","1998","54","5","661","662","10.1107/S0108270197019872","","","0.71069","MoKα","","0.058","0.051","","0.135","0.132","","","","1.065","1.158","1.158","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007219","6.704","0.001","10.156","0.002","13.321","0.002","91.09","0.02","95.49","0.02","108.24","0.02","856.3","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H24 N2 O -","- C22 H24 N2 O -","- C44 H48 N4 O2 -","2","1","CF1201","Chamontin, Karine; Lokshin, Vladimir; Guglielmetti, Robert; Samat, André; Pèpe, Gérard","4-Methylspiro[4-azahomoadamantane-5,3'-[3'<i>H</i>]naphth[2,1-<i>b</i>][1,4]oxazine], a New Photochromic Spirooxazine","Acta Crystallographica Section C","1998","54","5","670","672","10.1107/S0108270197017447","","","0.71069","MoKα","","0.0444","0.0441","","0.0888","0.0887","","","","1.011","1.069","1.069","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007220","17.765","0.001","26.708","0.002","7.6153","0.0009","90","","99.46","0.01","90","","3564.1","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 Fe K2 N6 O2.5 -","- C14 H13 Fe K2 N6 O2.5 -","- C112 H104 Fe8 K16 N48 O20 -","8","2","CF1210","Nieuwenhuyzen, M.; Bertram, B.; Gallagher, J. F.; Vos, J. G.","Dipotassium (2,2'-Bipyridyl-<i>N</i>,<i>N</i>')tetracyanoferrate(II) 2.5-Hydrate, K~2~[Fe(bpy)(CN)~4~].2.5H~2~O","Acta Crystallographica Section C","1998","54","5","603","606","10.1107/S0108270197018039","","","0.71073","MoKα","","0.086","0.045","","0.11","0.093","","","","1.049","1.121","1.121","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007221","13.714","0.004","10.159","0.003","14.006","0.002","90","","118.1","0.02","90","","1721.3","0.8","150","2","150","2","","","","","","","","4","P 1 a 1","P -2ya","7","","dibromotriphenylantimony(V)","","- C18 H15 Br2 Sb -","- C18 H15 Br2 Sb -","- C72 H60 Br8 Sb4 -","4","2","CF1211","Webster, Michael","Dibromotriphenylantimony(V), a Second Polymorph","Acta Crystallographica Section C","1998","54","5","570","572","10.1107/S0108270197018040","","","0.71069","MoKα","","0.088","0.051","","","","0.148","","","","","","1.04","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007222","14.435","0.002","18.025","0.002","8.5494","0.0009","90","0.01","90","0.01","90","0.01","2224.5","0.5","293","2","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Adenosine 5'-carboxylic acid","","- C10 H11 N5 O5 -","- C10 H11 N5 O5 -","- C80 H88 N40 O40 -","8","2","DE1070","G. Sreekanta Padiyar; T. P. Seshadri","Adenosine-5'-carboxylic Acid","Acta Crystallographica Section C","1998","54","5","647","649","10.1107/S0108270197017678","","","0.71067","MoKα","","0.07","0.0379","","0.1124","0.0975","","","","1.023","1.081","1.081","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007223","13.102","0.003","11.57","0.002","19.345","0.003","90","","101.126","0.012","90","","2877.4","0.9","170","","170","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H40 D6 N2 O19 P2 W6 -","- C52 H40 D6 N2 O19 P2 W6 -","- C104 H80 D12 N4 O38 P4 W12 -","2","0.5","FG1378","Parvez, Masood; Boorman, P. Michael; Langdon, Naomi","Tetraphenylphosphonium Hexatungstate(VI) Acetonitrile Solvate","Acta Crystallographica Section C","1998","54","5","608","609","10.1107/S0108270197016946","","","0.71069","MoKα","","0.122","0.035","","0.028","0.022","","","","1.22","1.31","1.31","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007224","11.598","0.001","10.959","0.001","12.148","0.001","90","0.01","117.41","0.01","90","0.01","1370.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Crystal structures of three diphenylsulphones","","- C14 H13 N O4 S -","- C14 H13 N O4 S -","- C56 H52 N4 O16 S4 -","4","1","FR1058","Jeyakanthan, Jeyaraman; Velmurugan, D.; Panneerselvam, K.; Soriano-Garcia, Manuel; Perumal, S.; Chandrasekaran, R.","Three Diphenyl Sulfones","Acta Crystallographica Section C","1998","54","5","630","633","10.1107/S0108270197016831","","","1.54178","CuKα","","0.0399","0.037","","0.113","0.1079","","","","0.613","0.611","0.611","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007225","20.339","0.007","11.024","0.004","15.22","0.007","90","","126.8","0.02","90","","2733","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Crystal structures of three diphenylsulphones","","- C15 H16 O2 S -","- C15 H16 O2 S -","- C120 H128 O16 S8 -","8","1","FR1058","Jeyakanthan, Jeyaraman; Velmurugan, D.; Panneerselvam, K.; Soriano-Garcia, Manuel; Perumal, S.; Chandrasekaran, R.","Three Diphenyl Sulfones","Acta Crystallographica Section C","1998","54","5","630","633","10.1107/S0108270197016831","","","1.54178","CuKα","","0.0508","0.045","","0.133","0.1246","","","","0.921","0.924","0.924","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007226","12.36","0.005","8.246","0.004","11.615","0.007","90","","103.74","0.03","90","","1149.9","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Crystal structures of three diphenylsulphones","","- C13 H12 O2 S -","- C13 H12 O2 S -","- C52 H48 O8 S4 -","4","1","FR1058","Jeyakanthan, Jeyaraman; Velmurugan, D.; Panneerselvam, K.; Soriano-Garcia, Manuel; Perumal, S.; Chandrasekaran, R.","Three Diphenyl Sulfones","Acta Crystallographica Section C","1998","54","5","630","633","10.1107/S0108270197016831","","","1.54178","CuKα","","0.0585","0.0568","","0.1623","0.1602","","","","1.186","1.204","1.204","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007227","6.1119","0.0012","11.047","0.002","6.7488","0.0013","90","","101.23","0.03","90","","446.94","0.15","208","2","208","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C9 H6 O3 W -","- C9 H6 O3 W -","- C18 H12 O6 W2 -","2","0.5","FR1065","Oh, Jane M.; Geib, Steven J.; Cooper, N. John","The Final Member of an Isologous Series of Arenetricarbonyl Complexes: [W(η^6^-C~6~H~6~)(CO)~3~]","Acta Crystallographica Section C","1998","54","5","581","583","10.1107/S0108270197009955","","","0.71073","MoKα","","0.0283","0.0257","","0.0738","0.0713","","","","1.259","1.262","1.262","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007228","13.398","0.003","13.988","0.003","13.674","0.003","90","","104.24","0.02","90","","2483.9","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","zinc(II)tepa bisperchlorate","","","- C21 H24 Cl2 N4 O8 Zn -","- C21 H24 Cl2 N4 O8 Zn -","- C84 H96 Cl8 N16 O32 Zn4 -","4","1","FR1069","Xiaodong Xu; Craig S. Allen; Chang-lin Chuang; James W. Canary","A Tetrahedral Zinc(II) Complex of Tris(2-pyridylethyl)amine","Acta Crystallographica Section C","1998","54","5","600","601","10.1107/S0108270197017733","","","1.54178","CuKα","","0.0862","0.059","","0.184","0.1505","","","","1.142","1.086","1.086","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007229","6.7611","0.0011","16.889","0.003","7.7713","0.0013","90","","92.44","0.02","90","","886.6","0.3","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-amino-3,5-dichloropyridinium chloride","","- C5 H7 Cl3 N2 O -","- C5 H7 Cl3 N2 O -","- C20 H28 Cl12 N8 O4 -","4","1","FR1087","Anagnostis, Jason; Turnbull, Mark M.","2-Amino-3,5-dichloropyridinium Chloride Monohydrate","Acta Crystallographica Section C","1998","54","5","681","683","10.1107/S0108270197017344","","","0.71073","MoKα","","0.0365","0.0281","","0.0714","0.0692","","","","0.958","1.028","1.028","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007230","10.855","0.001","16.045","0.002","10.516","0.002","90","","90","","90","","1831.6","0.4","295","","295","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C18 H33 Cl Si -","- C18 H33 Cl Si -","- C72 H132 Cl4 Si4 -","4","0.5","FR1098","Lindfors, Britt E.; Male, Jonathan L.; Tyler, David R.; Weakley, Timothy J.R.","Chlorotricyclohexylsilane, C~18~H~33~ClSi","Acta Crystallographica Section C","1998","54","5","694","695","10.1107/S0108270197017745","","","0.71073","MoKα","","0.048","0.043","","0.077","0.073","","","","1.43","1.47","1.47","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007231","19.037","0.006","9.548","0.003","12.089","0.004","90","","90","","90","","2197.4","1.2","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","FULGID-1","2,3-diphenylbenzylidenesuccinic anhydride","","- C30 H20 O3 -","- C30 H20 O3 -","- C120 H80 O12 -","4","0.5","HA1200","Kaftory, Menahem; Goldberg, Yulia; Goldberg, Stephen, Z.; Botoshansky, Mark","2,3-Bis(diphenylmethylene)succinic Anhydride, (I), 2-(2-Adamantylidene)-3-(9-fluorenylidene)succinic Anhydride, (II), and 2-(9-Fluorenylidene)-3-(3,4,5-trimethoxybenzylidene)succinic Anhydride, (III)","Acta Crystallographica Section C","1998","54","5","683","687","10.1107/S0108270197018441","","","0.71069","MoKα","","0.1608","0.0868","","0.313","0.1742","","","","0.97","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007232","11.939","0.003","10.251","0.003","8.731","0.002","100.45","0.02","100.32","0.02","67.65","0.02","964.7","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","FULGID-2","2-fluorenylidene,3-(adamantylidene)succinic anhydride","","- C27 H22 O3 -","- C27 H22 O3 -","- C54 H44 O6 -","2","1","HA1200","Kaftory, Menahem; Goldberg, Yulia; Goldberg, Stephen, Z.; Botoshansky, Mark","2,3-Bis(diphenylmethylene)succinic Anhydride, (I), 2-(2-Adamantylidene)-3-(9-fluorenylidene)succinic Anhydride, (II), and 2-(9-Fluorenylidene)-3-(3,4,5-trimethoxybenzylidene)succinic Anhydride, (III)","Acta Crystallographica Section C","1998","54","5","683","687","10.1107/S0108270197018441","","","0.71069","MoKα","","0.1505","0.0783","","0.2773","0.1725","","","","0.238","0.228","0.228","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007233","10.2498","0.001","12.586","0.003","8.189","0.004","96.51","","87.9","","93.5","","1047.2","0.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","FULGID-3","2-fluorenylidene,3-(3,4,5-trimethoxybenzylidene) succinic anhydride","","- C27 H20 O6 -","- C27 H20 O6 -","- C54 H40 O12 -","2","1","HA1200","Kaftory, Menahem; Goldberg, Yulia; Goldberg, Stephen, Z.; Botoshansky, Mark","2,3-Bis(diphenylmethylene)succinic Anhydride, (I), 2-(2-Adamantylidene)-3-(9-fluorenylidene)succinic Anhydride, (II), and 2-(9-Fluorenylidene)-3-(3,4,5-trimethoxybenzylidene)succinic Anhydride, (III)","Acta Crystallographica Section C","1998","54","5","683","687","10.1107/S0108270197018441","","","0.71093","MoKα","","0.1268","0.0886","","0.2587","0.2019","","","","0.394","0.41","0.41","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007234","21.2245","0.0011","21.2245","0.0011","21.2245","0.0011","90","","90","","90","","9561.2","0.9","250","2","250","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","Disodium bis(methyl-α-D-mannopyranosidato(3-)) 5/3-bismutate(III) hydroxide dodecahydrate","","- C14 H47 Bi1.6667 Na2 O25 -","- C14 H22.6667 Bi1.66667 Na2 O25.0467 -","- C168 H272 Bi20 Na24 O300.56 -","12","1","JZ1224","Klüfers, Peter; Mayer, Peter","Polyol‒Metal Complexes. 26. A Three-Dimensional Triply-Connected Alkoxo‒Metal Net in a Carbohydrate‒Bismuth(III) Complex","Acta Crystallographica Section C","1998","54","5","583","586","10.1107/S0108270197011050","","","0.71073","MoKa","","0.026","0.022","","0.043","0.042","","","","0.983","1.006","1.006","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007235","8.9033","0.0008","6.3","0.003","10.717","0.002","90","","102.614","0.013","90","","586.6","0.3","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","β-Sodium succinate hexahydrate","","- C4 H16 Na2 O10 -","- C4 H16 Na2 O10 -","- C8 H32 Na4 O20 -","2","0.5","JZ1231","Montserrat, Noemí; Virtudes Moreno; Xavier Solans; Mercé Font-Bardía","A New Phase of Sodium Succinate Hexahydrate","Acta Crystallographica Section C","1998","54","5","578","580","10.1107/S0108270197017393","","","0.71069","MoKα","","0.0404","0.0289","","0.1076","0.0746","","","","1.059","1.08","1.08","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007236","11.085","0.003","7.7168","0.0006","13.006","0.002","90","","99.97","0.02","90","","1095.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-Amino-9-(carboxymethyl)-2-methoxypurine Methyl Ester","","- C9 H11 N5 O3 -","- C9 H11 N5 O3 -","- C36 H44 N20 O12 -","4","1","JZ1235","Sood, Geeta; Schwalbe, Carl H.; Fraser, William","6-Amino-9-(carboxymethyl)-2-methoxypurine Methyl Ester","Acta Crystallographica Section C","1998","54","5","659","661","10.1107/S0108270197015795","","","1.54178","CuKα","","0.041","0.038","","0.101","0.1","","","","1.381","1.408","1.408","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007237","9.2753","0.0006","11.3756","0.0008","21.72","0.002","90","","90","","90","","2291.7","0.3","293","2","293","2","","","","","","","","6","C m c m","-C 2c 2","63","","Bis(1,3,5-triamino-1,3,5-trideoxy-cis-inositol) Copper(II) Dichloride Tetrahydrate","","- C12 H38 Cl2 Cu N6 O10 -","- C12 H38 Cl2 Cu N6 O10 -","- C48 H152 Cl8 Cu4 N24 O40 -","4","0.25","JZ1250","Guido J. Reiß; Walter Frank; Kaspar Hegetschweiler; Dirk Kuppert","Bis(1,3,5-triamino-1,3,5-trideoxy-<i>cis</i>-inositol-κ^3^<i>N</i>)copper(II) Dichloride Tetrahydrate","Acta Crystallographica Section C","1998","54","5","614","616","10.1107/S0108270197018131","","","0.71073","MoKα","","0.0485","0.0273","","","","0.0586","","","","","","1.045","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007238","7.4845","0.0009","10.4936","0.001","6.2217","0.0005","90","","90","","90","","488.65","0.08","293","2","293","2","","","","","","","","5","I m m a","-I 2b 2","74","","lithium hexafluoro arsenate monohydrate","","- As F6 H2 Li O -","- As F6 H2 Li O -","- As4 F24 H8 Li4 O4 -","4","0.25","JZ1259","Loss, Sandra; Röhr, Caroline","Lithium Hexafluoroarsenate Monohydrate, LiAsF~6~.H~2~O","Acta Crystallographica Section C","1998","54","5","567","569","10.1107/S0108270197015497","","","0.7107","MoKα","","0.0381","0.021","","0.0558","0.0507","","","","1.085","1.122","1.122","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007239","8.107","0.003","8.53","0.003","7.339","0.003","90.11","0.03","98.44","0.03","94.859","0.003","500.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Crystal structure of 2,4 dichlorophenyloxy acetyl hydrazine","","- C8 H8 Cl2 N2 O2 -","- C8 H8 Cl2 N2 O2 -","- C16 H16 Cl4 N4 O4 -","2","1","KA1248","Lokanath, N.K.; Sridhar, M.A.; Shashidhara Prasad, J.; Nagaraja, H.S.; Mohan Rao, P.","(2,4-Dichlorophenoxy)acetohydrazide","Acta Crystallographica Section C","1998","54","5","669","670","10.1107/S0108270197018416","","","0.71069","MoKα","","0.0603","0.0439","","0.1539","0.1326","","","","1.166","1.22","1.22","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007240","4.644","0.003","16.559","0.005","7.007","0.003","90","","94.19","0.04","90","","537.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2'-bibenzoxazole","","- C14 H8 N2 O2 -","- C14 H8 N2 O2 -","- C28 H16 N4 O4 -","2","0.5","KA1251","F. Ekkehardt Hahn; Lutz Imhof; Thomas Lügger","2,2'-Bibenzoxazole","Acta Crystallographica Section C","1998","54","5","668","669","10.1107/S0108270197018143","","","0.71073","MoKα","","0.0533","0.0444","","","","0.1328","","","","","","1.084","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007241","7.1513","0.0006","8.2054","0.0006","8.3385","0.0006","117.264","0.006","96.049","0.006","100.497","0.006","417.56","0.06","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Ammonium saccharin","Ammonium o-sulfobenzoimide","","- C7 H8 N2 O3 S -","- C7 H8 N2 O3 S -","- C14 H16 N4 O6 S2 -","2","1","KA1255","Ng, Seik Weng","Ammonium Saccharin","Acta Crystallographica Section C","1998","54","5","649","651","10.1107/S0108270197014868","","","0.71073","MoKα","","0.037","0.033","","0.101","0.097","","","","1.067","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007242","7.855","0.002","9.982","0.002","11.589","0.002","90","","90","","90","","908.7","0.3","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Phenyl-2-pyridylketone","","- C12 H9 N O -","- C12 H9 N O -","- C48 H36 N4 O4 -","4","1","LN1015","Sievert, Mark; Dienelt, Ruediger; Bock, Hans","Phenyl 2-Pyridyl Ketone at 150K","Acta Crystallographica Section C","1998","54","5","674","676","10.1107/S0108270197017940","","","0.71073","MoKα","","0.0441","0.0373","","0.106","0.0968","","","","1.036","1.028","1.028","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007243","7.655","0.002","10.867","0.002","12.082","0.002","103.44","0.02","102.75","0.02","105.89","0.02","895.7","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,2-Bis(5-methyl-4-methylthio-1,3-dithiolium-2-ylidene)-1,2-diphenylethane Triiodide","","- C24 H22 I6 S6 -","- C24 H22 I6 S6 -","- C24 H22 I6 S6 -","1","0.5","LN1043","Rimbaud, Christian; Le Magueres, Pierre; Ouahab, Lahcene; Lorcy, Dominique; Robert, Albert","1,2-Bis(5-methyl-4-methylthio-1,3-dithiolium-2-ylidene)-1,2-diphenylethane Bis(triiodide) and 1,2-Bis(4-methoxyphenyl)-1,2-bis(5-methyl-4-methylthio-1,3-dithiolium-2-ylidene)ethane Diperchlorate","Acta Crystallographica Section C","1998","54","5","679","681","10.1107/S010827019701768X","","","0.71073","MoKα","","0.1005","0.0346","","0.1007","0.0819","","","","1.006","1.087","1.087","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007244","11.087","0.005","10.4329","0.001","14.325","0.009","90","","104.32","0.02","90","","1605.5","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(4-methoxylphenyl)-1,2-bis(5-methyl-4-methylthio-1,3-dithiolium-2-ylidene) ethane Perchlorate","","- C26 H26 Cl2 O10 S6 -","- C26 H26 Cl2 O10 S6 -","- C52 H52 Cl4 O20 S12 -","2","0.5","LN1043","Rimbaud, Christian; Le Magueres, Pierre; Ouahab, Lahcene; Lorcy, Dominique; Robert, Albert","1,2-Bis(5-methyl-4-methylthio-1,3-dithiolium-2-ylidene)-1,2-diphenylethane Bis(triiodide) and 1,2-Bis(4-methoxyphenyl)-1,2-bis(5-methyl-4-methylthio-1,3-dithiolium-2-ylidene)ethane Diperchlorate","Acta Crystallographica Section C","1998","54","5","679","681","10.1107/S010827019701768X","","","0.71073","MoKα","","0.0697","0.0384","","0.1096","0.0948","","","","1.019","1.053","1.053","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007245","33.354","0.007","10.26","0.002","17.4","0.004","90","","90","","90","","5954","2","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","1-Phenyl-3,3-bis(triethylphosphine)-1,2-dicarba-3-platina-closo-dodecaborane","","- C20.5 H46 B9 Cl P2 Pt -","- C20.5 H46 B9 Cl P2 Pt -","- C164 H368 B72 Cl8 P16 Pt8 -","8","2","MU1341","Thomas, Rhodri Ll.; Welch, Alan J.; Kyd, Gwenda O.","1-Phenyl-3,3-bis(triethylphosphine)-1,2-dicarba-3-platina-<i>closo</i>-dodecaborane 0.5-Dichloromethane Solvate","Acta Crystallographica Section C","1998","54","5","588","591","10.1107/S0108270197017204","","","0.71073","MoKα","","0.051","0.033","","0.08","0.075","","","","1.063","1.088","1.088","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007246","8.873","0.001","12.921","0.001","24.812","0.003","90","","100.16","0.01","90","","2800","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","10-Chloro-6,7-dihydro-5H benzo[6,7]cyclohepta[1,2-b]quinoline","","- C18 H14 Cl N -","- C18 H14 Cl N -","- C144 H112 Cl8 N8 -","8","2","MU1348","Jayanta Kumar Ray; Tapan Kumar Mahato; Kandasamy Chinnakali; Ibrahim Abdul Razak; Hoong-Kun Fun","10-Chloro-6,7-dihydro-5<i>H</i>-benzo[6,7]cyclohepta[1,2-<i>b</i>]quinoline and 10-Methyl-6,7-dihydro-5<i>H</i>-benzo[6,7]cyclohepta[1,2-<i>b</i>]quinoline","Acta Crystallographica Section C","1998","54","5","641","643","10.1107/S0108270197017654","","","0.71073","MoKα","","0.114","0.0433","","0.1031","0.0871","","","","0.798","1.036","1.036","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007247","8.972","0.005","12.973","0.004","24.699","0.009","90","","98.41","0.03","90","","2844","2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","10-Methyl-6,7-dihydro-5H[benzo][6,7]cyclohepta[1,2-b]qinoline","","- C19 H17 N -","- C19 H17 N -","- C152 H136 N8 -","8","2","MU1348","Jayanta Kumar Ray; Tapan Kumar Mahato; Kandasamy Chinnakali; Ibrahim Abdul Razak; Hoong-Kun Fun","10-Chloro-6,7-dihydro-5<i>H</i>-benzo[6,7]cyclohepta[1,2-<i>b</i>]quinoline and 10-Methyl-6,7-dihydro-5<i>H</i>-benzo[6,7]cyclohepta[1,2-<i>b</i>]quinoline","Acta Crystallographica Section C","1998","54","5","641","643","10.1107/S0108270197017654","","","0.71073","MoKα","","0.167","0.0537","","0.1326","0.1006","","","","0.81","1.077","1.077","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007248","9.965","0.002","21.188","0.004","16.792","0.003","90","","93.1","0.03","90","","3540.2","1.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H20 I2 N10 Zr -","- C40 H20 I2 N10 Zr -","- C160 H80 I8 N40 Zr4 -","4","1","MU1357","Kubiak, Ryszard; Ejsmont, Krzysztof","(1,2-Benzenedicarbonitrile-κ<i>N</i>)diiodo(phthalocyaninato-κ^4^<i>N</i>)zirconium(IV)","Acta Crystallographica Section C","1998","54","5","572","574","10.1107/S0108270197017691","","","0.71073","MoKα","","0.1228","0.0467","","0.0889","0.0741","","","","1.018","1.151","1.151","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007249","17.786","0.002","14.504","0.001","7.437","0.003","90","","90","","90","","1918.5","0.8","295","0.1","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","bis{μ-chloro-[chloro-2-ammoniobenzenethiolato]mercury(II)}","","- C12 H14 Cl4 Hg2 N2 S2 -","- C12 H14 Cl4 Hg2 N2 S2 -","- C48 H56 Cl16 Hg8 N8 S8 -","4","0.5","MU1360","Davidović, Naka; Matković-Čalogović, Dubravka; Popović, Zora; Vedrina-Dragojević, Irena","Di-μ-chloro-bis[(2-ammoniobenzenethiolato-<i>S</i>)chloromercury(II)]","Acta Crystallographica Section C","1998","54","5","574","576","10.1107/S0108270197016788","","","0.71073","MoKα","","0.0778","0.0368","","","","0.0772","","","","","","1.038","","","","has coordinates","207948","2020-10-21","18:00:00",""
"2007250","7.8069","0.0012","15.768","0.004","16.398","0.003","90","","90","","90","","2018.6","0.7","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","[3-(2-pyridyl)-1H-pyrazole]dichloropalladium(II)","","- C8 H7 Cl2 N3 Pd -","- C8 H7 Cl2 N3 Pd -","- C64 H56 Cl16 N24 Pd8 -","8","1","MU1365","Ward, Michael D.; Fleming, James S.; Psillakis, Elefteria; Jeffery, John C.; McCleverty, Jon A.","[Pd(H<i>L</i>)Cl~2~] and [Pd<i>L</i>~2~], where H<i>L</i> is 2-(3-Pyrazolyl)pyridine","Acta Crystallographica Section C","1998","54","5","609","612","10.1107/S0108270197016399","","","0.71073","MoKα","","0.0284","0.0236","","0.0632","0.0619","","","","1.108","1.169","1.169","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007251","11.752","0.003","5.1373","0.0008","12.288","0.002","90","","104.62","0.02","90","","717.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis[3-(2-pyridyl)pyrazolato]palladium(II)","","- C16 H12 N6 Pd -","- C16 H12 N6 Pd -","- C32 H24 N12 Pd2 -","2","0.5","MU1365","Ward, Michael D.; Fleming, James S.; Psillakis, Elefteria; Jeffery, John C.; McCleverty, Jon A.","[Pd(H<i>L</i>)Cl~2~] and [Pd<i>L</i>~2~], where H<i>L</i> is 2-(3-Pyrazolyl)pyridine","Acta Crystallographica Section C","1998","54","5","609","612","10.1107/S0108270197016399","","","0.71073","MoKα","","0.0216","0.0177","","0.0501","0.0495","","","","1.043","1.152","1.152","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007252","13.186","0.006","5.279","0.001","27.288","0.004","90","","90","","90","","1899.5","1","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Diaquachlorobis(pyridinioacetato)copper(II) perchlorate","","- C14 H18 Cl2 Cu N2 O10 -","- C14 H18 Cl2 Cu N2 O10 -","- C56 H72 Cl8 Cu4 N8 O40 -","4","1","MU1368","Wu, Yu-Luan; Tong, Ye-Xiang; Chen, Xiao-Ming; Mak, Thomas C. W.","Diaquachlorobis(4-pyridinioacetate-<i>O</i>)copper(II) Perchlorate","Acta Crystallographica Section C","1998","54","5","606","608","10.1107/S0108270197017216","","","0.71073","MoKα","","0.0442","0.0346","","0.0827","0.0773","","","","1.077","1.092","1.092","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007253","6.081","0.001","6.957","0.001","19.707","0.004","90","","95.46","0.03","90","","829.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 Cl N2 O2 -","- C7 H7 Cl N2 O2 -","- C28 H28 Cl4 N8 O8 -","4","1","MU1371","Ejsmont, Krzysztof; Kyzioł, Janusz; Daszkiewicz, Zdzisław; Bujak, Maciej","4-Chloro-<i>N</i>-methyl-<i>N</i>-nitroaniline","Acta Crystallographica Section C","1998","54","5","672","674","10.1107/S0108270197017708","","","0.71073","MoKα","","0.0845","0.0673","","0.2322","0.2044","","","","1.106","1.167","1.167","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007254","12.206","0.005","15.259","0.003","20.718","0.008","90","","100.51","0.03","90","","3794","2","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","mono methylcyclopentadienyl bis(2,6-ditertbutyl-4-methylphenoxo) ytterbium tetrafuranate","","- C40 H61 O3 Yb -","- C40 H61 O3 Yb -","- C160 H244 O12 Yb4 -","4","1","NA1292","Yao, Yingming; Shen, Qi; Sun, Jie; Xue, Feng","Bis(2,6-di-<i>tert</i>-butyl-4-methylphenolato-<i>O</i>)(η^5^-methylcyclopentadienyl)(tetrahydrofuran-<i>O</i>)ytterbium","Acta Crystallographica Section C","1998","54","5","625","627","10.1107/S0108270197015205","","","0.71069","MoKα","","","0.029","","","0.039","","","","","1.34","1.34","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007255","19.033","0.002","13.661","0.001","9.546","0.001","90","","95.72","0.01","90","","2469.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-bis[2'hydroxy-3'-(N-ethylimino)-5'-methylbenzyl]-piperazine","","- C26 H36 N4 O2 -","- C26 H34.5 N4 O2 -","- C104 H138 N16 O8 -","4","1","NA1317","R.Thirumurugan; S.Shanmuga Sundara Raj; G.Shanmugam; Hoong-Kun Fun; M.Marappan; M.Kandaswamy","1,4-Bis[3-(<i>N</i>-ethyliminomethyl)-2-hydroxy-5-methylbenzyl]piperazine","Acta Crystallographica Section C","1998","54","5","644","645","10.1107/S0108270197017514","","","0.71073","MoKα","","0.0888","0.0445","","0.1359","0.1171","","","","0.908","1.097","1.097","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007256","9.855","0.007","28.479","0.009","6.28","0.001","90","","90","","90","","1762.5","1.4","298","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","L-leucine 3,4-dimethylbenzenesulfonate monohydrate","","- C14 H25 N O6 S -","- C14 H25 N O6 S -","- C56 H100 N4 O24 S4 -","4","1","OA1024","Hasegawa, Kazuhiro; Ishikawa, Kohki; Kawaoka, Rie; Sano, Chiaki; Iitani, Kinzo; Komatsu, Hiroshi; Nagashima, Nobuya","Complexes Between <small>L</small>-Leucine and its Precipitants","Acta Crystallographica Section C","1998","54","5","637","641","10.1107/S0108270197018106","","","1.5418","CuKα","","","0.044","","","0.044","","","","","2.392","2.392","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2007257","6.163","0.001","10.199","0.009","14.14","0.009","90","","94.112","0.009","90","","886.5","1","298","","","","","","","","","","","5","P 1 21 1","","","","L-leucine 2,5-dimethylbenzenesulfonate monohydrate","","- C14 H25 N O6 S -","- C14 H25 N O6 S -","- C28 H50 N2 O12 S2 -","2","1","OA1024","Hasegawa, Kazuhiro; Ishikawa, Kohki; Kawaoka, Rie; Sano, Chiaki; Iitani, Kinzo; Komatsu, Hiroshi; Nagashima, Nobuya","Complexes Between <small>L</small>-Leucine and its Precipitants","Acta Crystallographica Section C","1998","54","5","637","641","10.1107/S0108270197018106","","","1.5418","CuKα","","","0.049","","","0.06","","","","","3.729","3.729","","","","","has coordinates","190596","2020-10-21","18:00:00",""
"2007258","9.866","0.002","28.201","0.009","6.25","0.002","90","","90","","90","","1738.9","0.9","298","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","L-leucine 4-methylbenzenesulfonate monohydrate","","- C13 H23 N O6 S -","- C13 H23 N O6 S -","- C52 H92 N4 O24 S4 -","4","1","OA1024","Hasegawa, Kazuhiro; Ishikawa, Kohki; Kawaoka, Rie; Sano, Chiaki; Iitani, Kinzo; Komatsu, Hiroshi; Nagashima, Nobuya","Complexes Between <small>L</small>-Leucine and its Precipitants","Acta Crystallographica Section C","1998","54","5","637","641","10.1107/S0108270197018106","","","1.5418","CuKα","","","0.047","","","0.055","","","","","2.86","2.86","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2007259","5.264","0.003","10.084","0.004","24.758","0.003","90","","93.02","0.04","90","","1312.4","0.9","298.2","","298.2","","","","","","","","","4","P 1 21 1","P 2yb","4","1-phenyl-1,2,3,4-tetrahydroisoquinolinine monohydrochloride","","","- C15 H16 Cl N -","- C15 H16 Cl N -","- C60 H64 Cl4 N4 -","4","2","OA1027","Nakahara, Hideaki; Takeuchi, Makoto; Naito, Ryo; Kurihara, Hiroyuki; Nagano, Noriaki; Isomura, Yasuo; Mase, Toshiyasu","Absolute Configuration of (+)-1-Phenyl-1,2,3,4-tetrahydroisoquinoline Hydrochloride","Acta Crystallographica Section C","1998","54","5","651","653","10.1107/S0108270197018581","","","1.54184","CuKα","","","0.059","","","0.077","","","","","1.16","1.16","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007260","10.797","0.003","11.933","0.003","12.939","0.003","82.457","0.001","66.762","0.001","70.985","0.001","1448.2","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H100 Al2 Er2 O14 -","- C42 H100 Al2 Er2 O14 -","- C42 H100 Al2 Er2 O14 -","1","0.5","OS1001","Kritikos, Mikael; Wijk, Maria; Westin, Gunnar","[Er~2~Al~2~(O^<i>i^</i>Pr)~12~(HO^<i>i^</i>Pr)~2~], a Novel Heterobimetallic Alkoxide","Acta Crystallographica Section C","1998","54","5","576","578","10.1107/S0108270197017460","","","0.71073","MoKα","","0.025","0.0237","","0.0626","","0.0618","","","1.088","1.095","1.095","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007261","20.252","0.002","13.638","0.001","13.132","0.001","90","","100.401","0.008","90","","3567.4","0.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","hexakis(N,N-dimethylformamide)aluminium(III) perchlorate","","- C18 H42 Al Cl3 N6 O18 -","- C18 H42 Al Cl3 N6 O18 -","- C72 H168 Al4 Cl12 N24 O72 -","4","0.5","OS1003","Suzuki, Honoh; Ishiguro, Shin-ichi","<i>N</i>,<i>N</i>-Dimethylformamide Complex of Aluminium(III) Perchlorate","Acta Crystallographica Section C","1998","54","5","586","588","10.1107/S0108270197018817","","","1.54184","CuKα","","0.0603","0.0556","","0.1695","0.1625","","","","1.089","1.106","1.106","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007262","9.012","0.002","13.492","0.002","16.808","0.002","90","","95.991","0.001","90","","2032.5","0.6","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 Br N O4 S -","- C22 H16 Br N O4 S -","- C88 H64 Br4 N4 O16 S4 -","4","1","PT1045","Govindasamy, L.; Velmurugan, D.; Ravikumar, K.; Mohanakrishnan, A.K.","(3-Bromo-1-phenylsulfonyl-2-indolyl)methyl Benzoate","Acta Crystallographica Section C","1998","54","5","635","637","10.1107/S0108270197016995","","","0.71073","MoKα","","0.0909","0.0509","","0.1311","0.1101","","","","1.069","1.125","1.125","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007263","8.6696","0.0007","11.1396","0.0007","21.1975","0.0007","90","","92.49","0.02","90","","2045.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H25 N O3 -","- C26 H25 N O3 -","- C104 H100 N4 O12 -","4","1","PT1052","V.K. Ganesh; S.Banumathi; D.Velmurugan; N. Ramasubbu; V.T.Ramakrishnan","9-(4-Methoxyphenyl)-10-phenyl-3,4,6,7,9,10-hexahydro-1,8(2<i>H</i>,5<i>H</i>)-acridinedione","Acta Crystallographica Section C","1998","54","5","633","635","10.1107/S0108270197017009","","","1.5418","CuKα","","0.0722","0.0511","","0.1762","0.1522","","","","0.61","0.612","0.612","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007264","18.1623","0.0007","9.5124","0.0003","17.8745","0.0007","90","","106.063","0.003","90","","2967.56","0.19","150","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Triphenylphosphine sulfide","","- C18 H15 P S -","- C18 H15 P S -","- C144 H120 P8 S8 -","8","2","QA0032","Foces-Foces, C.; Llamas-Saiz, A.L.","Triphenylphosphine Sulfide: a Redetermination at 150K","Acta Crystallographica Section C","1998","54","5","IUC9800013","","10.1107/S0108270198099673","","","1.5418","CuKα","","0.04","0.036","","0.045","0.043","","","","0.989","0.99","0.99","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007265","14.247","0.002","11.371","0.002","16.727","0.003","90","","90.33","0.01","90","","2709.8","0.8","293","2","293","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","(μ-dicyclohexylphosphido)(μ-trifluormethyl-mercury)-octacarbonyl-dirhenium","","- C21 H22 F3 Hg O8 P Re2 -","- C21 H22 F3 Hg O8 P Re2 -","- C84 H88 F12 Hg4 O32 P4 Re8 -","4","0.5","QA0033","Flörke, Ulrich; Haupt, Hans-Jürgen","Octacarbonyl(μ-dicyclohexylphosphanido)(μ-trifluoromethylmercury)dirhenium","Acta Crystallographica Section C","1998","54","5","IUC9800015","","10.1107/S0108270198099727","","","0.71073","MoKα","","0.0626","0.0364","","0.0861","0.074","","","","0.99","1.041","1.041","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007266","9.722","0.002","11.36","0.002","13.123","0.003","66.16","0.02","87.77","0.02","75.19","0.02","1278.2","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-cyclohexylphosphido)-octacarbonyl-manganese-rhenium","","- C20 H24 Mn O8 P2 Re -","- C20 H22 Mn O8 P2 Re -","- C40 H44 Mn2 O16 P4 Re2 -","2","1","QA0035","Flörke, Ulrich","Octacarbonylbis(μ-cyclohexylphosphanido)manganeserhenium","Acta Crystallographica Section C","1998","54","5","IUC9800016","","10.1107/S0108270198099715","","","0.71073","MoKα","","0.066","0.0394","","0.0944","0.0848","","","","1.102","1.166","1.166","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007267","10.228","0.004","25.01","0.009","10.823","0.005","90","","114.59","0.03","90","","2517.5","1.9","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(μ-dicyclohexyl)(μ-chloro)bis(triphenylphosphane-tricarbonyl-rhenium)","","- C54 H52 Cl O6 P3 Re2 -","- C54 H49 Cl O6 P3 Re2 -","- C108 H98 Cl2 O12 P6 Re4 -","2","0.5","QA0036","Flörke, Ulrich","μ-Chloro-(μ-dicyclohexylphosphanido)bis[tricarbonyl(triphenylphosphine)rhenium]","Acta Crystallographica Section C","1998","54","5","IUC9800017","","10.1107/S0108270198099703","","","0.71073","MoKα","","0.0959","0.0469","","0.1347","0.0903","","","","1.045","1.023","1.023","","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2007268","8.282","0.0002","7.8396","0.0001","20.2459","0.0004","90","","99.613","0.001","90","","1296.06","0.04","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-hydroxy-N-(4-nitrophenyl)phenethylamine","","- C14 H14 N2 O3 -","- C14 H14 N2 O3 -","- C56 H56 N8 O12 -","4","1","QA0037","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan","β-Hydroxy-<i>N</i>-(4-nitrophenyl)phenethylamine","Acta Crystallographica Section C","1998","54","5","IUC9800012","","10.1107/S0108270198099685","","","0.71073","MoKα","","0.0634","0.046","","0.1225","0.1101","","","","1.038","1.084","1.084","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007269","15.9935","0.0007","17.3378","0.0006","17.5073","0.0007","90","","101.542","0.005","90","","4756.5","0.3","148","","148","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(tetrabutylammonium) Nonadecaoxohexamolybdenum(VI)","","- C32 H72 Mo6 N2 O19 -","- C32 H72 Mo6 N2 O19 -","- C128 H288 Mo24 N8 O76 -","4","0.5","QB0032","Boyle, Paul D.; Stauffer, Thad C.; Wirgau, Joseph I.; Cornman, Charles R.","Bis(tetra-<i>n</i>-butylammonium) Nonadecaoxohexamolybdenum(VI): a Redetermination at 148K","Acta Crystallographica Section C","1998","54","5","IUC9800011","","10.1107/S0108270198099739","","","0.71073","MolybdenumKα","","0.035","0.035","","0.043","0.042","","","","","1.14","1.14","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007270","5.999","0.001","5.999","0.001","5.999","0.001","90","","90","","90","","215.89","0.06","293","2","293","2","","","","","","","","3","F m -3 m","-F 4 2 3","225","lithium tantalum phosphide","","","- Li7.5 P4 Ta0.5 -","- Li7.5072 P4 Ta0.4896 -","- Li7.5072 P4 Ta0.4896 -","1","0.00520833","QB0037","Monconduit, Laure; Belin, Claude; Tillard, Monique","The New Mixed Lithium Tantalum Phosphide Li~8{-~<i>x</i>}Ta~<i>x~</i>P~4~ (<i>x</i> = 0.5)","Acta Crystallographica Section C","1998","54","5","IUC9800014","","10.1107/S0108270198099740","","","0.71073","MoKα","","0.0304","0.0304","","","","0.0707","","","","","","1.104","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007271","6.5694","0.0015","8.917","0.002","13.696","0.003","90","","96.14","0.03","90","","797.7","0.3","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-bis(2-aminobenzyl)-1,4-diazacyclohexane","","- C18 H24 N4 -","- C18 H24 N4 -","- C36 H48 N8 -","2","0.5","QB0038","Li, Wan-Sheung; Vatsadze, Sergei V.; Blake, Alexander J.; Mountford, Philip","1,4-Bis(2-aminobenzyl)-1,4-diazacyclohexane","Acta Crystallographica Section C","1998","54","5","IUC9800019","","10.1107/S0108270198099661","","","0.71073","MoKα","","0.0484","0.0357","","","","0.0919","","","","","","1.102","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007272","6.644","0.013","23.03","0.004","8.856","0.003","90","","99.64","0.02","90","","1336","3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-(2-nitrobenzyl)diethanolamine hydrobromide","N-(2-nitrobenzyl)diethanolammonium bromide","","- C11 H17 Br N2 O4 -","- C11 H17 Br N2 O4 -","- C44 H68 Br4 N8 O16 -","4","1","QB0039","Blake, Alexander J.; Champness, Neil R.; Li, Wan-Sheung; Mountford, Philip; Schröder, Martin; Wilson, Paul J.","Bis(2-hydroxyethyl)(2-nitrobenzyl)ammonium Bromide","Acta Crystallographica Section C","1998","54","5","IUC9800020","","10.1107/S0108270198098783","","","0.71073","MoKα","","0.0724","0.048","","","","0.1171","","","","","","1.029","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007273","9.739","0.001","9.739","0.001","16.921","0.001","90","","90","","90","","1604.9","0.3","198","","198","","","","","","","","","6","P -4 n 2","P -4 -2n","118","","","","- C20 H56 Li2 N2 O2 Si4 -","- C20 H56 Li2 N2 O2 Si4 -","- C40 H112 Li4 N4 O4 Si8 -","2","0.25","QC0002","Boyle, Timothy J.; Scott, Brian L.","Low-Temperature Structure of Lithium Bis(trimethylsilyl)amide Etherate, {[LiO(CH~2~CH~3~)~2~][N(Si(CH~3~)~3~)~2~]}~2~","Acta Crystallographica Section C","1998","54","5","IUC9800018","","10.1107/S0108270198099697","","","0.71073","MoKα","","0.0402","0.0358","","0.1063","0.1022","","","","1.323","1.326","1.326","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007274","14.135","0.002","9.884","0.001","10.877","0.001","90.01","0.01","118.95","0.01","90.004","0.001","1329.7","0.3","180","2","","","","","","","","","","5","C 1 c 1","C -2yc","9","","1-phenyl-2,5-dibromo-3,4-dimethyl-2,5-dihydrophosphole oxide","","- C12 H13 Br2 O P -","- C12 H13 Br2 O P -","- C48 H52 Br8 O4 P4 -","4","1","SK1134","Tissot, Olivier; Gouygou, Maryse; Daran, Jean-Claude; Balavoine, Gilbert","Key Intermediates in the Synthesis of 2,2'-Biphosphole","Acta Crystallographica Section C","1998","54","5","676","679","10.1107/S0108270197018179","","","0.71073","MoKα","","0.0378","0.0309","","0.0749","0.0727","","","","1.137","1.172","1.172","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007275","7.843","0.001","26.024","0.003","14.003","0.002","90","","96.95","0.02","90","","2837.1","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-phenyl-2,5-dibromo-3,4-dimethyl-2,5-dihydrophosphole sulfide","","- C12 H13 Br2 P S -","- C12 H13 Br2 P S -","- C96 H104 Br16 P8 S8 -","8","2","SK1134","Tissot, Olivier; Gouygou, Maryse; Daran, Jean-Claude; Balavoine, Gilbert","Key Intermediates in the Synthesis of 2,2'-Biphosphole","Acta Crystallographica Section C","1998","54","5","676","679","10.1107/S0108270197018179","","","0.71073","MoKα","","0.0908","0.0509","","0.1495","0.1416","","","","1.193","1.531","1.531","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007276","7.3535","0.0015","7.9457","0.0017","11.731","0.002","92.61","0.02","96.96","0.02","109.53","0.02","638.5","0.2","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","1-phenyl-2-bromo-3,4-dimethylphosphole sulfide","","- C12 H12 Br P S -","- C12 H12 Br P S -","- C24 H24 Br2 P2 S2 -","2","1","SK1134","Tissot, Olivier; Gouygou, Maryse; Daran, Jean-Claude; Balavoine, Gilbert","Key Intermediates in the Synthesis of 2,2'-Biphosphole","Acta Crystallographica Section C","1998","54","5","676","679","10.1107/S0108270197018179","","","0.71073","MoKα","","0.0427","0.0364","","","0.095","0.0997","","","","","","1.072","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007277","7.2897","0.0005","19.692","0.003","7.523","0.002","90","","92.18","0.02","90","","1079.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Potassium 3-formyl-2,4-dinitrophenolate dihydrate","","- C7 H7 K N2 O8 -","- C7 H7 K N2 O8 -","- C28 H28 K4 N8 O32 -","4","1","SK1160","Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.; Gonsalves, A. M. D'A. Rocha; Serra, A.C.","Potassium 3-Formyl-2,4-dinitrophenolate Dihydrate","Acta Crystallographica Section C","1998","54","5","618","621","10.1107/S0108270197017484","","","0.71073","MoKα","","0.0521","0.0317","","","0.0801","0.0889","","","","","","1.075","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007278","10.082","0.002","10.187","0.001","10.304","0.002","88.5","0.02","70.62","0.01","88.19","0.02","997.7","0.3","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","2,2'-Bis(1-cyclohexanol)-biphenyl","","- C24 H30 O2 -","- C24 H30 O2 -","- C48 H60 O4 -","2","1","SK1161","Nieger, Martin; Hupfer, Heike; Bolte, Michael","Structural Investigation of Biphenyl Derivatives","Acta Crystallographica Section C","1998","54","5","656","659","10.1107/S0108270197017939","","","0.71069","MoKα","","0.0642","0.0466","","","","0.1226","","","","","","1.061","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007279","10.062","0.001","16.307","0.001","11.398","0.002","90","","97.83","0.01","90","","1852.8","0.4","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","","2,2,7,7-Bis(pentamethylene)-dibenzo[c;e]-dihydro-oxepin","","- C24 H28 O -","- C24 H28 O -","- C96 H112 O4 -","4","2","SK1161","Nieger, Martin; Hupfer, Heike; Bolte, Michael","Structural Investigation of Biphenyl Derivatives","Acta Crystallographica Section C","1998","54","5","656","659","10.1107/S0108270197017939","","","0.71069","MoKα","","0.0473","0.0392","","","","0.0907","","","","","","1.096","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007280","5.308","0.001","7.781","0.001","10.453","0.001","99.38","0.01","95.87","0.01","99.93","0.01","415.78","0.11","295","2","295","2","","","","","","","","2","P -1","-P 1","2","","4,5-9,10-Dicyclodexapyrene","","- C24 H26 -","- C24 H26 -","- C24 H26 -","1","0.5","SK1161","Nieger, Martin; Hupfer, Heike; Bolte, Michael","Structural Investigation of Biphenyl Derivatives","Acta Crystallographica Section C","1998","54","5","656","659","10.1107/S0108270197017939","","","0.71069","MoKα","","0.0567","0.045","","","","0.1254","","","","","","1.066","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007281","13.3409","0.001","5.8353","0.0005","15.0408","0.001","90","","100.142","0.008","90","","1152.6","0.15","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Δ^4^-7,7-ethylenedioxy-10-methyl-octal-1-one","","- C13 H18 O3 -","- C13 H18 O3 -","- C52 H72 O12 -","4","1","SX1036","Branco, Marcelo Cardoso; Rodrigues, Ana Maria Goncalves D.; Gambardella, Maria Teresa do P.; Muzzi, Rosana M.; Ferraz, Helena M. C.","Δ^4^-7,7-Ethylenedioxy-10-methyloctal-1-one","Acta Crystallographica Section C","1998","54","5","664","666","10.1107/S0108270197019173","","","0.71073","MoKα","","0.1224","0.053","","0.1737","0.1389","","","","1.023","1.12","1.12","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007282","8.313","0.005","17.486","0.007","10.566","0.005","90","","90","","90","","1535.9","1.3","301","","298","","","","","","","","","5","P n a 21","P 2c -2n","33","","Tetraethylammonium Dicopper Triiodide","","- C8 H20 Cu2 I3 N -","- C8 H20 Cu2 I3 N -","- C32 H80 Cu8 I12 N4 -","4","1","SX1046","Aliya K. Nurtaeva; Gary Hu; Elizabeth M. Holt","Tetraethylammonium Dicopper(I) Triiodide and (18-Crown-6)potassium Dicopper(I) Triiodide","Acta Crystallographica Section C","1998","54","5","597","600","10.1107/S0108270197017496","","","0.71073","MoKα","","","0.047","","","","0.053","","","","","","1.11","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007283","15.44","0.007","17.635","0.006","8.422","0.003","90","","97.14","0.04","90","","2275.4","1.5","301","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Potassium 18-Crown-6 Dicopper Triiodide","","- C12 H24 Cu2 I3 K O6 -","- C22 H44 Cu2 I3 K O12 -","- C88 H176 Cu8 I12 K4 O48 -","4","1","SX1046","Aliya K. Nurtaeva; Gary Hu; Elizabeth M. Holt","Tetraethylammonium Dicopper(I) Triiodide and (18-Crown-6)potassium Dicopper(I) Triiodide","Acta Crystallographica Section C","1998","54","5","597","600","10.1107/S0108270197017496","","","0.71073","MoKα","","","0.086","","","","0.218","","","","","","0.892","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007284","25.19","0.03","11.177","0.012","16.86","0.03","90","","120.36","0.07","90","","4096","10","301","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Cesium 15-crown-5 Dicopper(I) Triiodide","","- C10 H20 Cs Cu2 I3 O5 -","- C10 H20 Cs Cu2 I3 O5 -","- C80 H160 Cs8 Cu16 I24 O40 -","8","1","SX1047","Aliya K. Nurtaeva; Elizabeth M. Holt","(15-Crown-5)caesium Dicopper(I) Triiodide, (15-Crown-5)potassium Dicopper(I) Triiodide and (15-Crown-5)rubidium Dicopper(I) Triiodide","Acta Crystallographica Section C","1998","54","5","594","597","10.1107/S0108270197017502","","","0.71073","MoKα","","","0.0595","","","","0.0685","","","","","","1.36","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007285","23.818","0.014","10.956","0.006","17.071","0.01","90","","119.75","0.02","90","","3868","4","298","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Potassium 15-crown-5 Dicopper(I) Triiodide","","- C10 H20 Cu2 I3 K O5 -","- C10 H20 Cu2 I3 K O5 -","- C80 H160 Cu16 I24 K8 O40 -","8","1","SX1047","Aliya K. Nurtaeva; Elizabeth M. Holt","(15-Crown-5)caesium Dicopper(I) Triiodide, (15-Crown-5)potassium Dicopper(I) Triiodide and (15-Crown-5)rubidium Dicopper(I) Triiodide","Acta Crystallographica Section C","1998","54","5","594","597","10.1107/S0108270197017502","","","0.71073","MoKα","","","0.0586","","","","0.0694","","","","","","1.36","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007286","24.613","0.003","11.17","0.001","17.211","0.003","90","","119.9","0.01","90","","4102","1","301","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Rubidium 15-Crown-5 Dicopper Triiodide","","- C10 H20 Cu2 I3 O5 Rb -","- C10 H20 Cu2 I3 O5 Rb -","- C80 H160 Cu16 I24 O40 Rb8 -","8","1","SX1047","Aliya K. Nurtaeva; Elizabeth M. Holt","(15-Crown-5)caesium Dicopper(I) Triiodide, (15-Crown-5)potassium Dicopper(I) Triiodide and (15-Crown-5)rubidium Dicopper(I) Triiodide","Acta Crystallographica Section C","1998","54","5","594","597","10.1107/S0108270197017502","","","0.71073","MoKα","","","0.0584","","","","0.0575","","","","","","0.93","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007287","11.027","0.003","12.1065","0.0012","13.199","0.003","90","","106.45","0.02","90","","1689.9","0.6","292","","292","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Trans-3-methoxy-4-nitro-3'4'5'-trimethoxy stilbene","(E)-1-(3'-methoxy-4'-nitrophenyl)-2-(3'',4'',5''-trimethoxyphenyl) ethene","","- C18 H19 N O6 -","- C18 H19 N O6 -","- C72 H76 N4 O24 -","4","1","SX1050","Mullica, Donald F.; Pinney, Kevin G.; Mejia, Pilar; Rosenquist, Brent E.; Sappenfield, Eric L.","(<i>E</i>)-1-(3-Methoxy-4-nitrophenyl)-2-(3,4,5-trimethoxyphenyl)ethene","Acta Crystallographica Section C","1998","54","5","695","697","10.1107/S0108270197019902","","","0.71073","MoKα","","0.066","0.045","","0.531","","0.071","","","","","","1.805","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007288","10.898","0.004","8.807","0.002","14.189","0.002","90","","94.14","0.02","90","","1358.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(N-Methylphenazinium)tetranitropalladate(II)","","- C26 H22 N8 O8 Pd -","- C26 H22 N8 O8 Pd -","- C52 H44 N16 O16 Pd2 -","2","0.5","TA1144","Namgung, Hae; Kim, Seung-Bin; Suh, Il-Hwan","Bis[<i>N</i>-methylphenazinium(1+)] Tetranitropalladate(II)","Acta Crystallographica Section C","1998","54","5","612","614","10.1107/S0108270197007208","","","0.71073","MoKα","","0.0554","0.0293","","0.0617","0.0577","","","","1.102","1.253","1.253","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007289","9.19","0.005","9.232","0.002","9.66","0.002","79.15","0.01","85.82","0.03","65.39","0.04","731.8","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","biammonium trisodium nonadecaoxo(tritungsto)trivanadate dodecahydrate","","- H32 N2 Na3 O31 V3 W3 -","- N2 Na3 O31 V3 W3 -","- N2 Na3 O31 V3 W3 -","1","0.5","TA1182","Xu, Yan; Xu, Ji-Qing; Yang, Guo-Yu; Wang, Tie-Gang; Xing, Yan; Lin, Yong-Hua; Jia, Heng-Qing","(NH~4~)~2~Na~3~(V~3~W~3~O~19~).12H~2~O","Acta Crystallographica Section C","1998","54","5","563","565","10.1107/S0108270197016417","","","0.71073","MoKα","","0.073","0.0667","","0.1792","0.1598","","","","1.203","1.226","1.226","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007290","21.88","0.002","13.918","0.001","23.829","0.002","90","","105.745","0.001","90","","6984.3","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C60 H70 N12 Ni2 O23 V4 -","- C60 H48 N12 Ni2 O23 V4 -","- C240 H192 N48 Ni8 O92 V16 -","4","0.5","TA1193","Guo-Yu Yang; Da-Wei Gao; Ying Chen; Ji-Qing Xu; Qing-Xin Zeng; Hao-Ran Sun; Zhi-Wu Pei; Qiang Su; Yan Xing; Yong-Hua Ling; Heng-Qing Jia","[Ni(C~10~H~8~N~2~)~3~]~2~[V~4~O~12~].11H~2~O","Acta Crystallographica Section C","1998","54","5","616","618","10.1107/S0108270197018751","","","0.71073","MoKα","","0.0528","0.0376","","0.1077","0.1016","","","","0.962","1.055","1.055","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007291","29.357","0.004","7.096","0.006","20.201","0.004","90","","128.472","0.008","90","","3295","3","293.2","","293.2","","","","","","","","","5","C 1 2/c 1","","","","","","- C18 H10 Cl2 N4 Pt -","- C27 H15 Cl3 N6 Pt1.5 -","- C216 H120 Cl24 N48 Pt12 -","8","1","TA1194","Kato, Masako; Kosuge, Chizuko; Yano, Shigenobu; Kimura, Masaru","Two-Dimensional Stacking of Dichloro(dipyridophenazine)platinum(II)","Acta Crystallographica Section C","1998","54","5","621","623","10.1107/S0108270197018052","","","0.7107","MoKα","","0.076","0.076","","0.103","0.103","","","","1.176","1.176","1.176","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007292","10.665","0.005","7.219","0.002","23.662","0.003","90","","90","","90","","1821.8","1","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Neodymium diselenite seleniousf acid dihydrate","","- H6 Nd2 O20 Se7 -","- H6 Nd2 O20 Se7 -","- H24 Nd8 O80 Se28 -","4","1","AB1466","Miluvka Stancheva; Rosica Petrova; Josef Macíček","Neodymium Diselenite Selenious Acid Dihydrate: Structure and Conformation of the Se~2~O~5~ Group","Acta Crystallographica Section C","1998","54","6","699","701","10.1107/S0108270197019318","","","0.71069","MoKα","","0.0321","0.0277","","","","0.0708","","","","","","0.897","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007293","16.675","0.003","7.163","0.001","8.1","0.002","90","","90","","90","","967.5","0.3","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","Trimethylammoniumnickel(II)chloridedihydrate","Trimethylammoniumdiaquodichloronickel(II)chloride","","- C3 H14 Cl3 N Ni O2 -","- C3 H14 Cl3 N Ni O2 -","- C12 H56 Cl12 N4 Ni4 O8 -","4","0.5","AB1508","Thiele, Gerhard; Wittenburg, Gunnar","Trimethylammonium Nickel(II) Chloride Dihydrate","Acta Crystallographica Section C","1998","54","6","764","766","10.1107/S0108270198000109","","","0.71069","MoKα","","0.0836","0.0271","","","","0.0789","","","","","","1.097","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007294","25.281","0.004","6.741","0.001","15.559","0.003","90","","101.92","0.03","90","","2594.4","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H14 N2 O -","- C16 H14 N2 O -","- C128 H112 N16 O8 -","8","1","AB1513","Gigmes, Didier; Siri, Didier; Reboul, Jean-Pierre; Redouane, Nourredine; Tordo, Paul; Pèpe, Gerard","2-Methyl-2-(10-phenoxazinyl)propiononitrile","Acta Crystallographica Section C","1998","54","6","822","824","10.1107/S010827019701932X","","","0.71073","MoKα","","0.0455","0.044","","0.0896","0.0893","","","","0.961","1.156","1.156","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007295","11.2662","0.0013","9.8162","0.001","17.2773","0.0018","90","","102.47","0.01","90","","1865.6","0.4","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H17 Cl2 N3 -","- C21 H17 Cl2 N3 -","- C84 H68 Cl8 N12 -","4","1","AB1518","Kendi, Engin; Özbey, Süheyla; Tunçbilek, Meral; Göker, Hakan","1-Benzyl-2-(2,6-dichloroanilinomethyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section C","1998","54","6","854","856","10.1107/S0108270197019331","","","0.71073","MoKα","","","0.0336","","","0.039","","","","","0.71","0.71","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007296","9.716","0.003","10.447","0.004","16.303","0.006","87.56","0.03","89.14","0.03","88.1","0.03","1652.2","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","bis (guanidinium) (hydrogentriethylene tetraamine-hexaacetato) bismuthate III","","- C20 H45 Bi N10 O16 -","- C20 H37 Bi N10 O16 -","- C40 H74 Bi2 N20 O32 -","2","1","AB1531","Wullens, Hilda; Devillers, Michel; Tinant, Bernard; Declercq, Jean-Paul","Bis(guanidinium) (Hydrogen triethylenetetraminehexaacetato)bismuthate(III) Tetrahydrate","Acta Crystallographica Section C","1998","54","6","770","773","10.1107/S0108270198000882","","","0.71069","MoKα","","0.078","0.055","","0.126","","0.119","","","0.983","","","1.061","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007297","9.921","0.001","9.921","0.001","26.88","0.005","90","","90","","120","","2291.2","0.5","293","2","293","2","","","","","","","","6","P 31 2 1","P 31 2""","152","(2R,4S,6S)-(+)-2-N-benzylmethyl-amino-2-thio-4,6- dimethyl-1,3,2-dioxaphosphorinane","","","- C13 H20 N O2 P S -","- C13 H20 N O2 P S -","- C78 H120 N6 O12 P6 S6 -","6","1","BK1328","Hommer, Herbert; Domínguez, Zaira; Gordillo, Bárbara","(4<i>S</i>,6<i>S</i>,11<i>R</i>)-(+)-<i>trans</i>-4,6-Dimethyl-2-(1-phenylethylamino)-2-thio-1,3,2λ^5^-dioxaphosphorinane","Acta Crystallographica Section C","1998","54","6","832","834","10.1107/S0108270197020179","","","0.71073","MoKα","","0.055","0.037","","0.112","0.106","","","","1.137","1.262","1.262","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007298","12.861","0.002","14.328","0.002","23.929","0.002","90","","99.784","0.011","90","","4345.3","1","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","biphenyl-2-carboxylic acid","","","- C13 H10 O2 -","- C13 H10 O2 -","- C208 H160 O32 -","16","4","BK1371","Dobson, Allison J.; Gerkin, Roger E.","Biphenyl-2-carboxylic Acid: a Layered Structure","Acta Crystallographica Section C","1998","54","6","795","798","10.1107/S0108270197018738","","","0.71073","MoKα","","","0.052","","","","0.137","","","","","","1.12","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007299","9.889","0.002","10.208","0.003","9.466","0.006","85.81","0.04","79.79","0.03","79.14","0.02","922.8","0.7","293","","293","","","","","","","","","6","P -1","-P 1","2","Dibutyldichlorobis[(2-(phenylethylimino)methyl)phenol]tin(IV)","Dibutyldichlorobis[(2-(phenylethylimino)methyl)phenol]tin(IV)","","- C38 H48 Cl2 N2 O2 Sn -","- C38 H48 Cl2 N2 O2 Sn -","- C38 H48 Cl2 N2 O2 Sn -","1","0.5","BK1372","Yeap, Guan-Yeow; Ishizawa, Nobuo","Dibutyldichlorobis{2-[(phenylethylimino)methyl]phenol-<i>O</i>}tin(IV)","Acta Crystallographica Section C","1998","54","6","720","722","10.1107/S010827019701874X","","","0.7107","MoKα","","0.053","0.029","","0.022","0.02","","","","1.462","1.587","1.587","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007300","4.851","0.004","6.288","0.005","9.781","0.008","99.96","0.07","101.26","0.07","91.04","0.07","287.8","0.4","150","1","150","2","","","","","","","","4","P 1","P 1","1","3-acetamido-2-nitrobenzyl acetate","3-acetamido-2-nitrobenzyl acetate","","- C11 H12 N2 O5 -","- C11 H12 N2 O5 -","- C11 H12 N2 O5 -","1","1","BM1149","Mazurek, Jarosław; Lis, Tadeusz; Rusek, Grzegorz; Krajewski, Krzysztof","Nitro Derivatives of 3-Acetamidobenzyl Acetate","Acta Crystallographica Section C","1998","54","6","863","867","10.1107/S0108270197008123","","","0.71073","MoKα","","0.0454","0.0371","","0.1047","0.0971","","","","1.144","1.132","1.132","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007301","4.874","0.007","17.833","0.016","13.277","0.015","90","","92.35","0.1","90","","1153","2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Acetamido-6-nitrobenzyl acetate","","- C11 H12 N2 O5 -","- C11 H12 N2 O5 -","- C44 H48 N8 O20 -","4","1","BM1149","Mazurek, Jarosław; Lis, Tadeusz; Rusek, Grzegorz; Krajewski, Krzysztof","Nitro Derivatives of 3-Acetamidobenzyl Acetate","Acta Crystallographica Section C","1998","54","6","863","867","10.1107/S0108270197008123","","","0.71073","MoKα","","0.0702","0.0426","","0.1217","0.1095","","","","1.091","1.09","1.09","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007302","7.453","0.003","10.939","0.005","15.473","0.009","90","","93.84","0.03","90","","1258.7","1.1","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Acetamido-6-nitrobenzyl acetate monohydrate","","- C11 H14 N2 O6 -","- C11 H14 N2 O6 -","- C44 H56 N8 O24 -","4","1","BM1149","Mazurek, Jarosław; Lis, Tadeusz; Rusek, Grzegorz; Krajewski, Krzysztof","Nitro Derivatives of 3-Acetamidobenzyl Acetate","Acta Crystallographica Section C","1998","54","6","863","867","10.1107/S0108270197008123","","","0.71069","MoKα","","0.0746","0.0441","","0.1386","0.1185","","","","1.058","1.095","1.095","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007303","8.58","0.001","13.901","0.002","19.977","0.003","90","","98.57","0.02","90","","2356.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H29 N3 O2 -","- C27 H29 N3 O2 -","- C108 H116 N12 O8 -","4","1","BM1178","Luccioni-Houzé, Barbara; Giusti, Gerard; Pèpe, Gérard","5'-[2-(<i>N</i>-<i>tert</i>-Butylethanal nitrone)]-1,3,3-trimethylspiro[indoline-2,3'-naphtho[2,1-<i>b</i>][1,4]oxazine]","Acta Crystallographica Section C","1998","54","6","824","825","10.1107/S0108270197012882","","","0.71069","MoKα","","0.046","0.036","","0.066","0.065","","","","0.923","0.991","0.991","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007304","9.0996","0.0007","10.9985","0.0009","11.3214","0.0008","98.956","0.007","109.026","0.006","103.602","0.006","1007.29","0.15","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","5-Amino-8-cyano-2,4-diphenyl-7-(pyrrolidin-1yl)-1,6-naphthyridine","","- C25 H21 N5 -","- C25 H21 N5 -","- C50 H42 N10 -","2","1","BM1213","Kandasamy Chinnakali; Hoong-Kun Fun; Ibrahim Abdul Razak; Periyasamy Murugan; Vayalakkavoor T.Ramakrishnan","5-Amino-2,4-diphenyl-7-(pyrrolidin-1-yl)-1,6-naphthyridine-8-carbonitrile","Acta Crystallographica Section C","1998","54","6","781","783","10.1107/S0108270197019574","","","0.71073","MoKα","","0.0738","0.0448","","0.1341","0.1207","","","","0.938","1.078","1.078","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007305","5.7358","0.0015","14.693","0.002","13.112","0.0012","90","","98.87","0.04","90","","1091.8","0.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-amino-5-nitrobenzophenone","","- C13 H10 N2 O3 -","- C13 H10 N2 O3 -","- C52 H40 N8 O12 -","4","1","BM1214","Philip J. Cox; Abu T. Md. Anisuzzaman; R. Howard Pryce-Jones; Graham G. Skellern; Alastair J. Florence; Norman Shankland","2-Amino-5-nitrobenzophenone and 2'-Fluoro-2-methylamino-5-nitrobenzophenone","Acta Crystallographica Section C","1998","54","6","856","859","10.1107/S0108270197018969","","","0.7107","MoKα","","0.0693","0.0378","","0.0768","0.0718","","","","0.757","0.957","0.957","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007306","4.215","0.0017","13.602","0.0018","21.547","0.007","90","","94.748","0.0011","90","","1231.1","0.7","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-methylamino-9-fluoro-5-nitrobenzophenone","","- C14 H11 F N2 O3 -","- C14 H11 F N2 O3 -","- C56 H44 F4 N8 O12 -","4","1","BM1214","Philip J. Cox; Abu T. Md. Anisuzzaman; R. Howard Pryce-Jones; Graham G. Skellern; Alastair J. Florence; Norman Shankland","2-Amino-5-nitrobenzophenone and 2'-Fluoro-2-methylamino-5-nitrobenzophenone","Acta Crystallographica Section C","1998","54","6","856","859","10.1107/S0108270197018969","","","0.7107","MoKα","","0.1122","0.0334","","","","0.0682","","","","","","0.496","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007307","13.409","0.003","12.6654","0.0009","8.9671","0.0011","90","","90.308","0.012","90","","1522.9","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-(1-Naphthoyl)-5,8-dihydronaphthalene-1-ol","","- C21 H16 O2 -","- C21 H16 O2 -","- C84 H64 O8 -","4","1","BM1218","Chinnakali, Kandasamy; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vayalakkavoor T.","2-(1-Naphthoyl)-5,8-dihydronaphthalen-1-ol","Acta Crystallographica Section C","1998","54","6","783","785","10.1107/S010827019800050X","","","0.71073","MoKα","","0.151","0.037","","0.079","0.061","","","","0.727","1.059","1.059","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007308","10.2947","0.001","16.368","0.002","10.3822","0.001","90","","96.845","0.01","90","","1737","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,4,7,10-Tetraoxacyclododecane Di(benzenesulfonyl)amine (1:2)","","- C32 H38 N2 O12 S4 -","- C32 H38 N2 O12 S4 -","- C64 H76 N4 O24 S8 -","2","0.5","BM1226","Wijaya, Karna; Moers, Oliver; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CI. 1,4,7,10-Tetraoxacyclododecane‒Di(benzenesulfonyl)amine (1/2)","Acta Crystallographica Section C","1998","54","6","818","820","10.1107/S0108270198002376","","","0.71073","MoKα","","0.037","0.028","","0.073","0.07","","","","1.037","1.109","1.109","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007309","10.179","0.001","10.179","0.001","11.674","0.002","90","","90","","120","","1047.5","0.2","293","2","293","2","","","","","","","","2","R -3 :H","-R 3","148","","Hexamolybdenum Octatelluride","","- Mo6 Te8 -","- Mo6 Te8 -","- Mo18 Te24 -","3","0.166667","BR1198","Miller, Gordon J.; Smith, Mark","Hexamolybdenum Octatelluride, Mo~6~Te~8~","Acta Crystallographica Section C","1998","54","6","709","710","10.1107/S0108270197017812","","","0.71073","MoKα","","0.0405","0.0387","","0.1097","","0.1091","","","1.171","1.187","1.187","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2007310","7.269","0.001","8.03","0.002","11.055","0.002","90","","103.76","0.03","90","","626.8","0.2","293","2","295","","","","","","","","","3","P 1 21 1","P 2yb","4","","(1R*,2R*,4R*,5S*,1'E)-1,2,4-trichloro-5-(2'-chloroethenyl-1,5- dimethylcyclohexane)","","- C10 H14 Cl4 -","- C10 H14 Cl4 -","- C20 H28 Cl8 -","2","1","BS1027","Rivera, Patricio; Manríquez, Victor; Wittke, Oscar","Absolute Configuration of a Tetrachloro Monoterpene from <i>Plocamium cartilagineum</i>","Acta Crystallographica Section C","1998","54","6","816","818","10.1107/S0108270197017976","","","0.71073","MoKα","","0.0266","0.0258","","0.0724","0.0713","","","","1.09","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007311","11.4731","0.0004","12.2009","0.0004","17.6234","0.0007","72.477","0.003","75.764","0.003","62.294","0.002","2066.3","0.14","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","5-5'-diacetyl-2-2'-diethoxy-3-3'-dimethoxy-1,1'-biphenyl","","- C22 H26 O6 -","- C22 H26 O6 -","- C88 H104 O24 -","4","2","BS1044","Ferreira, Márcia A.; Costa, Márcia D. D.; Mendes, Isolda M. C.; Drumond, Mariza G.; Piló-Veloso, Dorila; Fernandes, Nelson G.","Lignin Model Compounds: 4,4'-<i>O</i>-Dimethyldehydrodiacetovanillone and 4,4'-<i>O</i>-Diethyldehydrodiacetovanillone","Acta Crystallographica Section C","1998","54","6","837","840","10.1107/S0108270197018015","","","0.71073","MoKα","","0.0775","0.0488","","0.0601","0.0562","","","","2.099","2.305","2.305","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007312","20.09","0.002","7.0879","0.0006","15.414","0.001","90","","124.513","0.004","90","","1808.6","0.3","298","","298","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","5,5'-diacetyl-2,2',3,3'-tetramethoxy-1,1'-biphenyl","","- C20 H22 O6 -","- C20 H22 O6 -","- C80 H88 O24 -","4","0.5","BS1044","Ferreira, Márcia A.; Costa, Márcia D. D.; Mendes, Isolda M. C.; Drumond, Mariza G.; Piló-Veloso, Dorila; Fernandes, Nelson G.","Lignin Model Compounds: 4,4'-<i>O</i>-Dimethyldehydrodiacetovanillone and 4,4'-<i>O</i>-Diethyldehydrodiacetovanillone","Acta Crystallographica Section C","1998","54","6","837","840","10.1107/S0108270197018015","","","0.71073","MoKα","","0.0602","0.0602","","0.0886","0.0886","","","","1.8505","1.8505","1.8505","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007313","9.256","0.004","11.917","0.004","23.489","0.008","90","","94.74","0.03","90","","2582.1","1.7","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H36 O7 -","- C30 H36 O7 -","- C120 H144 O28 -","4","1","CF1215","Pajunen, Aarne; Pirkko Karhunen; Gösta Brunow","7-(4-Hydroxy-3-methoxyphenyl)-6-hydroxymethyl-4,10-dimethoxy-2,8-dipropyl-<i>cis</i>-6,7-dihydrodibenzo[<i>b</i>,<i>d</i>]oxepin-11-ol","Acta Crystallographica Section C","1998","54","6","885","887","10.1107/S0108270197019811","","","0.71073","MoKα","","0.082","0.064","","0.194","0.181","","","","0.927","0.985","0.985","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007314","8.7829","0.0007","9.622","0.002","9.8535","0.0011","90","","92.948","0.008","90","","831.6","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","N-(tert-Butoxycarbonyl)-3-Amino-4-(Trimethylstannyl)pyridine","","- C13 H22 N2 O2 Sn -","- C13 H22 N2 O2 Sn -","- C26 H44 N4 O4 Sn2 -","2","1","CF1218","Crous, Renier; Holzapfel, Cedric W.; Kruger, Gert J.","[3-(<i>tert</i>-Butoxycarbonylamino)-4-pyridyl]trimethyltin(IV), a Tetraorganotin Compound Containing an Unexpected Intramolecular Sn···O Interaction","Acta Crystallographica Section C","1998","54","6","760","762","10.1107/S0108270197017459","","","0.7107","MoKα","","0.0278","0.0269","","","","0.0691","","","","","","1.114","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007315","8.825","0.002","16.518","0.002","7.368","0.002","90","","111.39","0.02","90","","1000.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5,5'-Dibromo-2,2'-dihydroxy-3,3'-(piperazine-1,4-diyldimethylene) dibenzaldehyde","","- C20 H20 Br2 N2 O4 -","- C20 H20 Br2 N2 O4 -","- C40 H40 Br4 N4 O8 -","2","0.5","CF1222","R.Thirumurugan; S.Shanmuga Sundara Raj; G.Shanmugam; Hoong-Kun Fun; K.Chinnakali; Suchada Chantrapromma; M.Marappan; M.Kandaswamy","5,5'-Dibromo-2,2'-dihydroxy-3,3'-(piperazine-1,4-diyldimethylene)dibenzaldehyde","Acta Crystallographica Section C","1998","54","6","780","781","10.1107/S0108270198000614","","","0.71073","MoKα","","0.0653","0.034","","0.098","0.0805","","","","0.935","1.028","1.028","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007316","7.102","0.0004","12.7094","0.0006","28.213","0.002","90","","92.076","0.001","90","","2544.9","0.3","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(8-methylaminoquinolinium) dimethyltetrachlorostannate(IV)","","- C22 H28 Cl4 N4 Sn -","- C22 H28 Cl4 N4 Sn -","- C88 H112 Cl16 N16 Sn4 -","4","1","CF1224","Hazell, Alan; Khoo, Lian Ee; Ouyang, Jiexiang; Rausch, Bernhard J.; Tavares, Zara Miravent","8-Methylaminoquinolinium Salts of Tetrachlorodimethylstannate(IV) and Tetrachlorodiphenylstannate(IV)","Acta Crystallographica Section C","1998","54","6","728","732","10.1107/S0108270198000626","","","0.71073","MoKα","","","0.034","","","0.048","","","","","1.324","1.324","","","","","has coordinates,has Fobs","190732","2020-10-21","18:00:00",""
"2007317","13.7689","0.0006","12.087","0.0005","18.7926","0.0008","90","","92.641","0.001","90","","3124.2","0.2","296","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(8-methylaminoquinolinium) diphenyltetrachlorostannate(IV)","","- C32 H32 Cl4 N4 Sn -","- C32 H32 Cl4 N4 Sn -","- C128 H128 Cl16 N16 Sn4 -","4","0.5","CF1224","Hazell, Alan; Khoo, Lian Ee; Ouyang, Jiexiang; Rausch, Bernhard J.; Tavares, Zara Miravent","8-Methylaminoquinolinium Salts of Tetrachlorodimethylstannate(IV) and Tetrachlorodiphenylstannate(IV)","Acta Crystallographica Section C","1998","54","6","728","732","10.1107/S0108270198000626","","","0.71073","MoKα","","","0.02","","","0.033","","","","","1.198","1.198","","","","","has coordinates,has Fobs","190732","2020-10-21","18:00:00",""
"2007318","7.753","0.002","11.126","0.002","18.281","0.003","90","","90","","90","","1576.9","0.6","220","2","220","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[1-(4-Chlorophenyl)-3-(4-methoxyphenyl)pyrazol-5-yl]acetonitrile","","- C18 H14 Cl N3 O -","- C18 H14 Cl N3 O -","- C72 H56 Cl4 N12 O4 -","4","1","CF1231","Malhotra, Sanjay; Vats, Archana; Parmar, Virinder S.; Errington, William","[1-(4-Chlorophenyl)-3-(4-methoxyphenyl)pyrazol-5-yl]acetonitrile","Acta Crystallographica Section C","1998","54","6","844","846","10.1107/S0108270198000717","","","0.71073","MoKα","","0.0407","0.032","","","","0.08","","","","","","1.037","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007319","26.3","0.006","15.596","0.002","16.936","0.004","90","","90","","90","","6947","2","295","1","295","1","","","","","","","","6","C 2 2 21","C 2c 2","","Compound Cubpsac","","","- C34 H28 Cu N6 O8 S2 -","- C34 H28 Cu N6 O8 S2 -","- C272 H224 Cu8 N48 O64 S16 -","8","1","CF1234","Grupče, Orhideja; Jovanovski, Gligor; Šoptrajanov, Bojan; Hergold-Brundić, Antonija","Structure of Bis(2,2'-bipyridyl)(saccharinato-<i>N</i>)copper(II) Saccharinate Dihydrate. Addendum","Acta Crystallographica Section C","1998","54","6","890","891","10.1107/S0108270198005897","","","1.54178","CuKα","","","0.063","","","0.083","","","","","0.704","0.704","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2007320","14.669","0.007","10.722","0.008","10.802","0.006","90","","99.55","0.08","90","","1675.4","1.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2-(N-Oxido-N'-hydroxydiazinyl)-3-methylbutyl)octanamide","","- C13 H27 N3 O3 -","- C13 H27 N3 O3 -","- C52 H108 N12 O12 -","4","1","DE1075","Chang, Rakwoo; Shin, Whanchul","<i>N</i>-[2-(<i>N</i>'-Hydroxy-<i>N</i>-oxidodiaziniumyl)-3-methylbutyl]octanamide","Acta Crystallographica Section C","1998","54","6","827","829","10.1107/S0108270198000729","","","1.5418","CuKα","","0.111","0.067","","0.198","0.159","","","","1.028","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007321","9.686","0.003","17.868","0.004","9.636","0.004","87.27","0.02","116.3","0.03","92.66","0.02","1492.8","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Hexa(p-Anisidinium) Cyclohexaphosphate Tétrahydrate","","- C42 H68 N6 O28 P6 -","- C41.98 H56 N6 O28 P6 -","- C41.98 H56 N6 O28 P6 -","1","0.5","DU1176","Ould Abdellahi, Mohamed; Ben Amor, Fatma; Driss, Ahmed; Jouini, Tahar","Hexakis(<i>p</i>-anisidinium) <i>cyclo</i>-Hexaphosphate Tétrahydrate","Acta Crystallographica Section C","1998","54","6","813","816","10.1107/S0108270197011888","","","1.54178","CuKα","","0.058","0.048","","0.141","0.132","","","","1.068","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007322","8.291","0.001","26.735","0.005","8.567","0.001","90","","114.49","0.02","90","","1728.1","0.5","293","2","291","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H2 F16 -","- C18 H2 F16 -","- C72 H8 F64 -","4","1","FG1361","Swenson, Dale C.; Yamamoto, Michiharu; Burton, Donald J.","3,4,5,6-Tetrafluoro-1,2,7,8-tetrakis(trifluoromethyl)phenanthrene and 3,4,7,8-Tetrafluoro-1,2,5,6-tetrakis(trifluoromethyl)anthracene","Acta Crystallographica Section C","1998","54","6","846","849","10.1107/S0108270197019951","","","0.7107","MoKα","","0.08","0.044","","0.14","0.11","","","","1.1","1.065","1.065","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007323","8.268","0.001","8.469","0.002","8.274","0.002","126.06","0.02","110.62","0.02","90.19","0.02","421","0.2","291","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H2 F16 -","- C18 H2 F16 -","- C18 H2 F16 -","1","0.5","FG1361","Swenson, Dale C.; Yamamoto, Michiharu; Burton, Donald J.","3,4,5,6-Tetrafluoro-1,2,7,8-tetrakis(trifluoromethyl)phenanthrene and 3,4,7,8-Tetrafluoro-1,2,5,6-tetrakis(trifluoromethyl)anthracene","Acta Crystallographica Section C","1998","54","6","846","849","10.1107/S0108270197019951","","","0.7107","MoKα","","0.045","0.036","","0.117","0.104","","","","1.11","1.112","1.112","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007324","9.386","0.002","27.5","0.001","10.316","0.002","90","","115.51","0.02","90","","2403.1","0.8","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","α,α',α''-trimethyl-1,3,5-benzenetrimethanol","","","- C12 H18 O3 -","- C12 H18 O3 -","- C96 H144 O24 -","8","2","FG1397","Blackburn, Anthony C.; Gerkin, Roger E.","Hydrogen-Bonding Patterns in a Centrosymmetric Structure with <i>Z</i>' = 2: α,α',α''-Trimethyl-1,3,5-benzenetrimethanol","Acta Crystallographica Section C","1998","54","6","792","795","10.1107/S0108270197019975","","","0.71073","MoKα","","","0.071","","","","0.083","","","","","","2.11","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007325","10.8768","0.0015","11.238","0.002","11.6786","0.0008","97.929","0.008","110.895","0.007","109.635","0.009","1201","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","adduct of 1,10-Phenanthroline and 1,1'-Binaphthyl-2,2'-diol","","- C32 H22 N2 O2 -","- C32 H22 N2 O2 -","- C64 H44 N4 O4 -","2","1","FG1399","García-Martínez, Emilia; Vázquez-López, Ezequiel M.; Tuck, Dennis G.","Hydrogen Bonding in the 1:1 Adduct of 1,10-Phenanthroline and 1,1'-Binaphthyl-2,2'-diol","Acta Crystallographica Section C","1998","54","6","840","842","10.1107/S0108270197019987","","","1.54184","CuKα","","0.1","0.042","","","","0.129","","","","","","1.016","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007326","9.8504","0.0007","15.1177","0.001","11.9574","0.0008","90","","95.831","0.001","90","","1771.4","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Chloro(1,4,8,12- tetraazacyclopentadecane-N,N',N'',N''')zinc(II) Perchlorate","","- C11 H26 Cl2 N4 O4 Zn -","- C11 H26 Cl2 N4 O4 Zn -","- C44 H104 Cl8 N16 O16 Zn4 -","4","1","FG1404","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Pariya, Chandi; Liao, Fen-Ling; Chung, Chung-Sun","Chloro(1,4,8,12-tetraazacyclopentadecane-κ^4^<i>N</i>)zinc(II) Perchlorate","Acta Crystallographica Section C","1998","54","6","712","714","10.1107/S0108270197019999","","","0.71073","MoKα","","0.115","0.063","","0.131","0.112","","","","1.083","1.182","1.182","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007327","7.663","0.001","11.833","0.003","29.452","0.007","90","","90","","90","","2670.6","1","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C29 H46 O6 -","- C29 H46 O6 -","- C116 H184 O24 -","4","1","FG1407","Liu, Huiyou; Bélanger-Gariépy, Francine; Akram, Mehdi; Moskova, Mariana; Zhu, Xiao-Xia","Methyl 7α,12α-Dihydroxy-3α-methacryloyloxy-5β-cholan-24-oate","Acta Crystallographica Section C","1998","54","6","801","803","10.1107/S0108270197020003","","","1.54178","CuKα","","0.093","0.04","","0.081","","0.068","","","0.665","","","0.888","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007328","11.667","0.003","7.292","0.002","15.275","0.003","90","","97.02","0.02","90","","1289.8","0.5","200","1","200","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","macrocyclic lactone","7-Oxa-spiro[5,9]pentadecane-1,8,13-trione","","- C14 H20 O4 -","- C14 H20 O4 -","- C56 H80 O16 -","4","1","FG1408","Parvez, Masood; Sultana, Naheed; Sarfaraz, Tahira B.; Husain, Shaheen A.","7-Oxaspiro[5.9]pentadecane-1,8,13-trione","Acta Crystallographica Section C","1998","54","6","789","790","10.1107/S0108270197019847","","","0.71069","MoKα","","0.066","0.037","","0.139","0.107","","","","1.16","1.171","1.171","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007329","7.712","0.003","11.579","0.004","11.416","0.004","90","","106.11","0.03","90","","979.4","0.6","143","2","143","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-Dicyanomethylene-5,6-dimethyl-3-cyano-1,2-dihydropyridine","","- C11 H8 N4 -","- C11 H8 N4 -","- C44 H32 N16 -","4","1","FG1411","Elgemeie, Galal E. H.; Hanfy, Nadia; Hopf, Henning; Jones, Peter G.","2-Dicyanomethylene-5,6-dimethyl-1,2-dihydropyridine-3-carbonitrile","Acta Crystallographica Section C","1998","54","6","820","822","10.1107/S0108270197019835","","","0.71073","MoKα","","0.09","0.054","","0.143","0.123","","","","1.018","1.084","1.084","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007330","18.871","0.007","18.871","","16.249","0.011","90","","90","","90","","5787","4","210","2","210","2","","","","","","","","4","I -4","I -4","82","","","","- C29.25 H40.25 Br2 Cl0.75 -","- C29.25 H40.25 Br2 Cl0.75 -","- C234 H322 Br16 Cl6 -","8","1","FG1412","Mario Leclerc; Maxime Ranger; Francine Bélanger-Gariépy","2,7-Dibromo-9,9-dioctylfluorene‒Chloroform (1/0.25)","Acta Crystallographica Section C","1998","54","6","799","801","10.1107/S0108270197020015","","","1.54178","CuKα","","0.052","0.044","","0.113","","0.106","","","1.003","","","1.042","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2007331","9.938","0.004","11.876","0.005","13.611","0.005","90","","91.96","0.01","90","","1605.5","1.1","293","1","293","1","","","","","","","","4","P 1 21 1","P 2yb","4","14-O-Benzoyl-8-methoxy- and 14-O-Benzoyl-8-ethoxy- Bikhaconines","[1α,6α,14α,16β]-20-ethyl-1,6,16-trimethoxy-4-methoxymethyl- 13-hydroxyaconitane-8,14-diyl 8-methoxy 14-benzoate and [1α,6α,14α,16β]-20-ethyl-1,6,16-trimethoxy-4-methoxymethyl- 13-hydroxyaconitane-8,14-diyl 8-ethoxy 14-benzoate.","","- C33.35 H47.7 N O8 -","- C33.35 H47.7 N O8 -","- C66.7 H95.4 N2 O16 -","2","1","FG1415","Parvez, Masood; Gul, Waseem; Anwar, Saeed","14-<i>O</i>-Benzoyl-8-ethoxybikhaconine and 14-<i>O</i>-Benzoyl-8-methoxybikhaconine","Acta Crystallographica Section C","1998","54","6","790","792","10.1107/S0108270198000171","","","1.54178","CuKα","","0.067","0.062","","0.171","0.161","","","","1.009","0.99","0.99","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007332","14.14","0.002","9.167","0.001","7.263","0.001","90","","90","","90","","941.4","0.2","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","(+\-)-3-indanone-1-acetic acid","(+\-)-2,3-dihydro-3-oxo-1H-indeneacetic Acid","","- C11 H10 O3 -","- C11 H10 O3 -","- C44 H40 O12 -","4","1","FG1417","Thompson, Hugh W.; Brunskill, Andrew P. J.; Lalancette, Roger A.","(±)-3-Indanone-1-acetic Acid: Heterochiral Catemeric Hydrogen Bonding in a δ-Keto Acid","Acta Crystallographica Section C","1998","54","6","829","831","10.1107/S0108270197019823","","","0.71073","MoKα","","0.07","0.05","","0.129","0.117","","","","1.05","1.1","1.1","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007333","12.698","0.003","5.6022","0.0011","21.041","0.004","90","","106.387","0.004","90","","1436","0.5","160","2","160","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-cyano-4'-(4R-5-epoxypentyloxy)biphenyl","","- C18 H17 N O2 -","- C18 H17 N O2 -","- C72 H68 N4 O8 -","4","2","FG1424","Clegg, William; Coles, Simon J.; Fallis, Ian A.; Griffiths, Paul M.; Teat, Simon J.","4-Cyano-4'-[(4<i>R</i>)-4,5-epoxypentyloxy]biphenyl: a Pseudosymmetry Problem Solved with Synchrotron Data","Acta Crystallographica Section C","1998","54","6","882","885","10.1107/S0108270197020027","","","0.6956","Synchrotron","","0.058","0.046","","","","0.133","","","","","","1.034","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007334","10.95","0.0012","12.2333","0.0009","7.1453","0.0006","90.242","0.007","106.042","0.007","85.257","0.008","916.55","0.15","173","1","173","1","","","","","","","","5","P -1","-P 1","2","","2,6,6-trimethyl-3-carbethoxy-4-(fluorophenyl)-5-oxo- 1,4,5,6,7,8-hexahydroquinoline","","- C21 H24 F N O3 -","- C21 H24 F N O3 -","- C42 H48 F2 N2 O6 -","2","1","FG1427","Linden, Anthony; Şafak, Cihat; Şimşek, Rahime","Racemic Ethyl 4-(2-Fluorophenyl)-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate","Acta Crystallographica Section C","1998","54","6","879","882","10.1107/S0108270198000195","","","0.71069","MoKα","","0.067","0.052","","","","0.16","","","","","","1.05","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007335","10.2","0.001","10.243","0.001","11.23","0.001","63.7","0.01","87.54","0.01","69.45","0.01","976","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","tetrasodium triethylenetetraminehexaacetic acid dilead nitrate decahydrate","tetrasodium [μ~2~-[3,6,9,12-tetrakis(carboxymethyl)-3,6,9,12-tetraazatetradecanedioato-] ]-dilead dinitrate decahydrate","","- C18 H44 N6 Na4 O28 Pb2 -","- C18 H44 N6 Na4 O28 Pb2 -","- C18 H44 N6 Na4 O28 Pb2 -","1","0.5","FR1076","Thompson, Julia A.; Scott, Brian L.; Sauer, Nancy N.","Triethylenetetraminehexaacetic Acid Complex of Lead","Acta Crystallographica Section C","1998","54","6","734","736","10.1107/S0108270197018428","","","0.71073","MoKα","","0.0365","0.0308","","0.0786","0.0752","","","","1.079","1.081","1.081","","","","","has coordinates","194538","2020-10-21","18:00:00",""
"2007336","10.6443","0.0001","10.9621","0.0001","16.1129","0.0002","86.01","0.001","81.937","0.001","61.998","0.001","1643.59","0.03","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H30 N4 O2 -","- C42 H30 N4 O2 -","- C84 H60 N8 O4 -","2","1","FR1078","Ramaiah, D.; Rath, Nigam P.; George, M. V.","Three Cycloadducts Formed by the Reaction of Bis(phenylazo)stilbene with Acetylenic and Olefinic Dipolarophiles","Acta Crystallographica Section C","1998","54","6","872","875","10.1107/S0108270197017332","","","0.71073","MoKα","","0.0775","0.0465","","0.1294","0.1124","","","","1.032","1.117","1.117","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007337","9.2081","0.0001","10.962","0.0001","13.2238","0.0001","67.053","0.001","84.532","0.001","68.754","0.001","1143.98","0.02","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","","","- C29 H23 N5 -","- C29 H23 N5 -","- C58 H46 N10 -","2","1","FR1078","Ramaiah, D.; Rath, Nigam P.; George, M. V.","Three Cycloadducts Formed by the Reaction of Bis(phenylazo)stilbene with Acetylenic and Olefinic Dipolarophiles","Acta Crystallographica Section C","1998","54","6","872","875","10.1107/S0108270197017332","","","0.71073","MoKα","","0.0665","0.0452","","0.1301","0.1188","","","","1.015","1.141","1.141","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007338","11.1257","0.0001","15.4692","0.0002","18.7765","0.0001","90","","91.135","0.001","90","","3230.91","0.05","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H32 N4 O2 -","- C42 H32 N4 O2 -","- C168 H128 N16 O8 -","4","1","FR1078","Ramaiah, D.; Rath, Nigam P.; George, M. V.","Three Cycloadducts Formed by the Reaction of Bis(phenylazo)stilbene with Acetylenic and Olefinic Dipolarophiles","Acta Crystallographica Section C","1998","54","6","872","875","10.1107/S0108270197017332","","","0.71073","MoKα","","0.0578","0.0429","","0.1062","0.0976","","","","1.019","1.062","1.062","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007339","9.8829","0.0001","12.3755","0.0001","12.0482","0.0001","90","","95.869","0.001","90","","1465.84","0.02","208","2","208","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H36 Co3 N8 O8 -","- C20 H36 Co3 N8 O8 -","- C40 H72 Co6 N16 O16 -","2","0.5","FR1108","Mareque Rivas, Juan C.; Brammer, Lee","Bis[tris(2-aminoethyl)amine]cobalt(II) Bis[tetracarbonylcobaltate(1‒)]","Acta Crystallographica Section C","1998","54","6","757","760","10.1107/S0108270198000900","","","0.71073","MoKα","","0.04","0.029","","0.078","0.072","","","","1.019","1.05","1.05","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2007340","7.393","0.002","13.069","0.004","17.855","0.005","90","","90","","90","","1725.1","0.9","120","2","120","2","","","","","","","","3","P n a 21","P 2c -2n","33","FULGID-4","ethyl 3,3-dimethyl-2-(3-phenyl-1-indenone-2-yl)acrylate","","- C22 H20 O3 -","- C22 H20 O3 -","- C88 H80 O12 -","4","1","HA1199","Kaftory, Menahem; Goldberg, Yulia; Goldberg, Stephen, Z.; Botoshansky, Mark","Ethyl 3,3-Dimethyl-2-(1-oxo-3-phenylinden-2-yl)acrylate","Acta Crystallographica Section C","1998","54","6","849","851","10.1107/S010827019701843X","","","0.71073","MoKα","","0.082","0.063","","0.171","0.149","","","","1.069","1.119","1.119","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007341","10.456","0.002","11.277","0.002","12.676","0.003","90","","112.4","0.03","90","","1381.9","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(2-thienyl)-3-(5-phenyl-2-furyl)propenenitrile","","- C17 H11 N O S -","- C17 H11 N O S -","- C68 H44 N4 O4 S4 -","4","1","JZ1199","Lokaj, Ján; Štetinová, Jarmila; Kada, Rudolf; Kettmann, Viktor; Warda, Salam A.","<i>trans</i>-2-(2-Thienyl)-3-(5-phenyl-2-furyl)propenenitrile","Acta Crystallographica Section C","1998","54","6","787","788","10.1107/S0108270197010585","","","1.54178","CuKα","","0.0681","0.061","","0.1461","0.1415","","","","1.073","1.095","1.095","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007342","13.4806","0.0013","7.6909","0.0006","18.1758","0.0015","90","","90","","90","","1884.4","0.3","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","Tetra-Rubidium-Di-Tantalum-Undeca-Sulfide","","","- Rb4 S11 Ta2 -","- Rb4 S11 Ta2 -","- Rb16 S44 Ta8 -","4","1","JZ1249","Dürichen, Peter; Bensch, Wolfgang","New Compounds Containing the Complex Anion [Ta~2~S~11~]^4{-^}; <i>A</i>~4~Ta~2~S~11~ (<i>A</i> = Rb, Cs)","Acta Crystallographica Section C","1998","54","6","706","708","10.1107/S0108270197018404","","","0.71073","MoKα","","0.057","0.035","","0.092","0.085","","","","1.027","1.064","1.064","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007343","13.913","0.004","7.989","0.002","18.327","0.005","90","","90","","90","","2037.1","1","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","Tetra-Caesium-Di-Tantalum-Undeca-Sulfide","","","- Cs4 S11 Ta2 -","- Cs4 S11 Ta2 -","- Cs16 S44 Ta8 -","4","1","JZ1249","Dürichen, Peter; Bensch, Wolfgang","New Compounds Containing the Complex Anion [Ta~2~S~11~]^4{-^}; <i>A</i>~4~Ta~2~S~11~ (<i>A</i> = Rb, Cs)","Acta Crystallographica Section C","1998","54","6","706","708","10.1107/S0108270197018404","","","0.71073","MoKα","","0.043","0.038","","0.104","0.101","","","","1.07","1.09","1.09","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007344","7.171","0.001","7.171","0.001","5.944","0.003","90","","90","","120","","264.71","0.14","293","2","293","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","Caesium nickel chloride","Caesium nickel(II) chloride'","","- Cl3 Cs Ni -","- Cl3 Cs Ni -","- Cl6 Cs2 Ni2 -","2","0.0833333","JZ1253","Sassmannshausen, Markus; Lutz, Heinz Dieter","Caesium Nickel(II) Trichloride, CsNiCl~3~, and Tricaesium Nickel(II) Pentachloride, Cs~3~NiCl~5~","Acta Crystallographica Section C","1998","54","6","704","706","10.1107/S0108270197019598","","","0.71069","MoKα","","0.0164","0.0144","","0.0312","0.0304","","","","1.437","1.465","1.465","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007345","9.224","0.002","9.224","0.002","14.551","0.008","90","","90","","90","","1238","0.8","293","2","293","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","Caesium nickel chloride","Tricaesium nickel(II) chloride","","- Cl5 Cs3 Ni -","- Cl5 Cs3 Ni -","- Cl20 Cs12 Ni4 -","4","0.125","JZ1253","Sassmannshausen, Markus; Lutz, Heinz Dieter","Caesium Nickel(II) Trichloride, CsNiCl~3~, and Tricaesium Nickel(II) Pentachloride, Cs~3~NiCl~5~","Acta Crystallographica Section C","1998","54","6","704","706","10.1107/S0108270197019598","","","0.71069","MoKα","","0.0874","0.0488","","0.1319","0.1115","","","","1.07","1.156","1.156","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007346","9.172","0.0002","12.2492","0.0003","12.94","0.0003","90.7376","0.0005","104.776","0.0004","101.34","0.0006","1375.24","0.06","293","2","","","","","","","","","","7","P -1","-P 1","2","","","","- C30 H28 N3 Ni O2 P S -","- C30 H28 N3 Ni O2 P S -","- C60 H56 N6 Ni2 O4 P2 S2 -","2","1","KA1226","Bogdanović, Goran A.; Spasojević-de Biré, Anne; Prelesnik, Bogdan V.; Leovac, Vukadin M.","Transition Metal Complexes with Thiosemicarbazide-Based Ligands. 33. [4-(2-Diphenylphosphino-α-ethoxybenzyl-<i>P</i>)-3-methyl-1-salicylideneisothiosemicarbazido-<i>N</i>^1^,<i>N</i>^4^,<i>O</i>]nickel(II)","Acta Crystallographica Section C","1998","54","6","766","768","10.1107/S0108270197019677","","","0.71073","MoKα","","","0.049","","","0.0986","","","","","1.244","1.244","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2007347","7.711","0.002","7.711","0.002","17.076","0.002","90","","90","","90","","1015.3","0.4","293","2","293","2","","","","","","","","6","P 42/m","-P 4c","84","","Trans-dichloro-[(1RS,4RS,5SR,7RS,8SR,11SR,12RS,14SR)-5,7,12,14- tetramethyl-1,4,8,11-tetraazacyclotetradecane]cobalt(III) perchlorate","","- C14 H32 Cl3 Co N4 O4 -","- C14 H32 Cl3 Co N4 O4 -","- C28 H64 Cl6 Co2 N8 O8 -","2","0.25","KA1261","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Tung, Shu-Fang; Liu, Guey-Sung; Chi, Ta-Yung; Chung, Chung-Sun","<i>trans</i>-Dichloro[(1<i>RS</i>,4<i>RS</i>,5<i>SR</i>,7<i>RS</i>,8<i>SR</i>,11<i>SR</i>,12<i>RS</i>,14<i>SR</i>)-5,7,12,14-tetramethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>]cobalt(III) Perchlorate","Acta Crystallographica Section C","1998","54","6","714","716","10.1107/S0108270197019690","","","0.71073","MoKα","","0.06","0.039","","0.133","0.116","","","","1.318","1.325","1.325","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007348","24.58","0.002","24.58","0.002","21.5609","0.0011","90","","90","","120","","11281.4","1.4","210","3","210","3","","","","","","","","6","R -3 :H","-R 3","148","","Dodekakis{tris(2-aminoethyl)amin}heptacadmium(II)-perchlorate","","- C72 H216 Cd7 Cl14 N48 O56 -","- C72 H216 Cd7 Cl14 N48 O56.06 -","- C216 H648 Cd21 Cl42 N144 O168.18 -","3","0.166667","LN1016","Klüfers, Peter; Mayer, Peter","A Star-Shaped Heptanuclear Tetramine Cadmium(II) Complex","Acta Crystallographica Section C","1998","54","6","722","725","10.1107/S0108270197019355","","","0.71069","MoKα","","0.045","0.037","","0.098","0.095","","","","1.049","1.118","1.118","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007349","10.181","0.005","13.047","0.007","14.751","0.007","101.6","0.03","101.9","0.04","99.86","0.05","1831.3","1.7","210","2","210","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H48 N4 O5 Zn -","- C36 H48 N4 O5 Zn -","- C72 H96 N8 O10 Zn2 -","2","1","LN1020","Mickler, Wulfhard; Reich, Annett; Sawusch, Stefan; Schilde, Uwe; Uhlemann, Erhard","Aquabis(3-methyl-4-octanoyl-1-phenyl-5-pyrazolonato-<i>O</i>,<i>O</i>')zinc(II) and Bis(ethanol-<i>O</i>)bis(3-methyl-1-phenyl-4-stearoyl-5-pyrazolonato-<i>O</i>,<i>O</i>')cadmium(II)","Acta Crystallographica Section C","1998","54","6","776","779","10.1107/S0108270197019215","","","0.71073","MoKα","","0.0965","0.0505","","0.1381","0.1166","","","","0.968","1.054","1.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007350","8.817","0.006","9.361","0.007","19.06","0.02","101.48","0.07","99.58","0.09","99.1","0.09","1490","2","210","2","210","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H98 Cd N4 O6 -","- C60 H98 Cd N4 O6 -","- C60 H98 Cd N4 O6 -","1","0.5","LN1020","Mickler, Wulfhard; Reich, Annett; Sawusch, Stefan; Schilde, Uwe; Uhlemann, Erhard","Aquabis(3-methyl-4-octanoyl-1-phenyl-5-pyrazolonato-<i>O</i>,<i>O</i>')zinc(II) and Bis(ethanol-<i>O</i>)bis(3-methyl-1-phenyl-4-stearoyl-5-pyrazolonato-<i>O</i>,<i>O</i>')cadmium(II)","Acta Crystallographica Section C","1998","54","6","776","779","10.1107/S0108270197019215","","","0.71073","MoKα","","0.0484","0.042","","0.102","0.0961","","","","0.973","0.983","0.983","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007351","8.514","0.006","19.39","0.012","21.94","0.012","90","","90","","90","","3622","4","301","2","301","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","3-methyl-r-2,c-3,c-5-triphenylpyrrolidine","","- C23 H23 N -","- C23 H23 N -","- C184 H184 N8 -","8","1","LN1033","Lucjan B. Jerzykiewicz; Tadeusz Lis; Janusz Baran; Danuta Dziewońska-Baran","Racemic 3-Methyl-<i>r</i>-2,<i>c</i>-3,<i>c</i>-5-triphenylpyrrolidine and 3-Methyl-<i>r</i>-2,<i>t</i>-3,<i>c</i>-5-triphenylpyrrolidine","Acta Crystallographica Section C","1998","54","6","867","870","10.1107/S0108270197018155","","","0.71073","MoKα","","0.1405","0.0458","","0.1325","0.1061","","","","1.026","1.301","1.301","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007352","24.52","0.02","6.369","0.006","22.4","0.02","90","","90","","90","","3498","5","100","2","100","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","3-methyl-r-2,t-3,c-5-triphenylpyrrolidine","","- C23 H23 N -","- C23 H23 N -","- C184 H184 N8 -","8","2","LN1033","Lucjan B. Jerzykiewicz; Tadeusz Lis; Janusz Baran; Danuta Dziewońska-Baran","Racemic 3-Methyl-<i>r</i>-2,<i>c</i>-3,<i>c</i>-5-triphenylpyrrolidine and 3-Methyl-<i>r</i>-2,<i>t</i>-3,<i>c</i>-5-triphenylpyrrolidine","Acta Crystallographica Section C","1998","54","6","867","870","10.1107/S0108270197018155","","","0.71073","MoKα","","0.108","0.058","","0.154","0.1355","","","","1.012","1.124","1.124","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007353","11.739","0.002","10.092","0.002","20.652","0.004","90","","99.53","0.03","90","","2412.9","0.8","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(μ-azathioprine-N3,N9)tetrachlorocopper(II) dimethylformamide solvate","","- C15 H21 Cl2 Cu N9 O4 S -","- C30 H42 Cl4 Cu2 N18 O8 S2 -","- C60 H84 Cl8 Cu4 N36 O16 S4 -","2","0.5","LN1050","Zhu, Fu-Chun; Schmalle, Helmut W.; Dubler, Erich","A Dinuclear Complex of the Thiopurine Drug Azathioprine: [Cu~2~Cl~4~(μ-azathioprine)~2~].4DMF","Acta Crystallographica Section C","1998","54","6","773","776","10.1107/S0108270197019203","","","0.71073","MoKα","","0.2391","0.0769","","0.1694","0.1235","","","","1.045","1.223","1.223","","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2007354","7.7418","0.0006","20.242","0.003","9.4443","0.0007","90","","109.561","0.006","90","","1394.6","0.3","220","2","220","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H32 Cl2 Co N4 O6 -","- C24 H32 Cl2 Co N4 O6 -","- C48 H64 Cl4 Co2 N8 O12 -","2","0.5","MU1364","Buchanan, Colin; Parsons, Simon; Winpenny, Richard E.P.","<i>trans</i>-Diaquadichlorobis(6-methyl-2-pyridone-<i>O</i>)cobalt(II) Bis(6-methyl-2-pyridone) Solvate","Acta Crystallographica Section C","1998","54","6","762","764","10.1107/S0108270198000523","","","0.71073","MoKα","","0.0835","0.042","","0.079","0.0684","","","","1.026","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007355","9.109","0.001","10.74","0.002","16.04","0.001","90","","99","0.1","90","","1549.9","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,4-Dimethyl-2-[(Z)-(2-N-p-anisyl-3,3,3-trifluoro)propenyl]-2-oxazoline.","","- C15 H17 F3 N2 O2 -","- C15 H17 F3 N2 O2 -","- C60 H68 F12 N8 O8 -","4","1","NA1290","Liu-Gonzalez, Malva; Sanz-Ruíz, Francisco; Navarro-Martinez, Antonio; García de la Torre, Marta; Fustero-Lardies, Santos","2-[(<i>Z</i>)-2-(<i>p</i>-Anisidino)-3,3,3-trifluoropropenyl]-4,4-dimethyl-2-oxazoline","Acta Crystallographica Section C","1998","54","6","875","877","10.1107/S0108270197017228","","","0.71073","MoKα","","0.1614","0.0409","","","","0.1295","","","","","","0.878","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007356","11.905","0.004","12.337","0.003","14.218","0.004","88.17","0.02","80.5","0.03","84.52","0.02","2049.9","1","293","2","293","","","","","","","","","6","P -1","-P 1","2","","tris(tert-butylcyclopentadienyl) praseodymium-μ-bromo-tris(tetrahydrofuran) lithium","","- C39 H63 Br Li O3 Pr -","- C39 H63 Br Li O3 Pr -","- C78 H126 Br2 Li2 O6 Pr2 -","2","1","NA1291","Luo, Yunjie; Yao, Yingming; Shen, Qi; Sun, Jie; Xue, Feng","Tris(<i>tert</i>-butylcyclopentadienyl)praseodymium-μ-bromo-tris(tetrahydrofuran)lithium","Acta Crystallographica Section C","1998","54","6","711","712","10.1107/S0108270197015199","","","0.71069","MoKα","","0.095","0.0388","","0.1108","0.0861","","","","1.099","1.067","1.067","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007357","10.404","0.002","9.743","0.002","19.096","0.003","90","","95.7","0.02","90","","1926.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-ethoxycarbonyl-3,5-dimethyl-cis-2,6-diphenyl piperidin-4-one","","- C22 H25 N O3 -","- C22 H25 N O3 -","- C88 H100 N4 O12 -","4","1","NA1307","Suresh Kumar, M.; Ponnuswamy, M. N.; Ponnuswamy, S.; Jeyaraman, R.; Paneerselvam, K.; Soriano-Garcia, Manuel","Ethyl 3,5-Dimethyl-4-oxo-<i>cis</i>-2,6-diphenylpiperidine-1-carboxylate","Acta Crystallographica Section C","1998","54","6","870","872","10.1107/S0108270198000201","","","1.54178","CuKα","","0.063","0.05","","0.157","0.138","","","","1.03","1.031","1.031","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007358","8.5287","0.0001","9.8554","0.0001","18.6719","0.0001","104.195","0.001","95.384","0.001","91.638","0.001","1512.64","0.03","143","","143","2","","","","","","","","4","P -1","-P 1","2","","4-Benzoyl-4-(2-cyano-ethyl)-heptanedinitrile","","- C17 H17 N3 O -","- C17 H17 N3 O -","- C68 H68 N12 O4 -","4","2","NA1313","Bolte, Michael; Scholtyssik, Maria","4-Benzoyl-4-(2-cyanoethyl)heptanedinitrile at 143K","Acta Crystallographica Section C","1998","54","6","852","854","10.1107/S010827019701723X","","","0.71073","MoKα","","0.1355","0.0584","","","","0.1487","","","","","","0.919","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007359","11.218","0.002","7.991","0.002","15.202","0.002","90","","94.95","0.01","90","","1357.7","0.5","296","","296","","","","","","","","","6","P 1 21 1","P 2yb","4","","bis(dimethylglyoximato)[(R)-1-methoxycarbonylethyl] (tricyanoethylphosphine)cobalt(III)","","- C21 H33 Co N7 O6 P -","- C21 H33 Co N7 O6 P -","- C42 H66 Co2 N14 O12 P2 -","2","1","NA1314","Arai, Yoshifusa; Hashizume, Daisuke; Kogo, Hidenori; Ohashi, Yuji; Ohgo, Yoshiaki","Bis(dimethylglyoximato-<i>N</i>,<i>N</i>')[methyl (<i>R</i>)-ethanoato-<i>C</i>^2^][tris(2-cyanoethyl)phosphine-<i>P</i>]cobalt(III)","Acta Crystallographica Section C","1998","54","6","739","741","10.1107/S0108270197020192","","","0.71069","MoKα","","0.043","0.035","","0.095","0.09","","","","1.05","1.07","1.07","","","","","has coordinates,has Fobs","198601","2020-10-21","18:00:00",""
"2007360","9.384","0.002","17.237","0.003","11.307","0.002","90","","94.5","0.03","90","","1823.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Cyanogold-phosphine","Cyanodi(phenyl)cyclohexylphosphinegold(I)","","- C19 H21 Au N P -","- C19 H21 Au N P -","- C76 H84 Au4 N4 P4 -","4","1","NA1329","Al-Arfaj, A.R.; Reibenspies, J.H.; Hussain, M. Sakhawat; Isab, A.A.","<i>R</i>~3~PAuCN Complexes: [{Ph~2~(cyclohexyl)P}AuCN] and [{(<i>m</i>-Tolyl)~3~P}AuCN]","Acta Crystallographica Section C","1998","54","6","716","719","10.1107/S0108270197017198","","","0.71073","MoKα","","0.0789","0.0466","","0.1315","0.1121","","","","1.042","1.057","1.057","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007361","11.312","0.002","12.996","0.003","13.308","0.003","90","","90","","90","","1956.4","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","cyanogold-phosphine","Cyano-tri-(m-tolyl)phosphinegold(I)","","- C22 H21 Au N P -","- C22 H21 Au N P -","- C88 H84 Au4 N4 P4 -","4","1","NA1329","Al-Arfaj, A.R.; Reibenspies, J.H.; Hussain, M. Sakhawat; Isab, A.A.","<i>R</i>~3~PAuCN Complexes: [{Ph~2~(cyclohexyl)P}AuCN] and [{(<i>m</i>-Tolyl)~3~P}AuCN]","Acta Crystallographica Section C","1998","54","6","716","719","10.1107/S0108270197017198","","","0.71073","MoKa","","0.0398","0.0325","","0.0905","0.078","","","","1.06","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007362","7.7869","0.0012","9.6947","0.0013","9.849","0.002","93.036","0.014","102.402","0.015","98.478","0.013","715.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl 2-(2'-methoxyphenyl)tetrahydro-1H-thieno[3,4-b]pyrrole-6a(6H)-carboxylate","","- C15 H19 N O3 S -","- C15 H19 N O3 S -","- C30 H38 N2 O6 S2 -","2","1","NA1332","Matos Beja, A.; Paixão, J. A.; Ramos Silva, M.; Alte da Veiga, L.; Gonsalves, A. M. A. D'A. Rocha; Pinho e Melo, T. M. V. D.; Cabral, A. M. T. D. P. V.","Methyl 2-(2-Methoxyphenyl)-2,3,3a,4,6,6a-hexahydro-1<i>H</i>-thieno[3,4-<i>b</i>]pyrrole-6a-carboxylate","Acta Crystallographica Section C","1998","54","6","803","805","10.1107/S0108270198000213","","","0.71069","MoKα","","0.046","0.033","","","","0.09","","","","","","1.027","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007363","7.8466","0.0003","13.6602","0.0004","12.2522","0.0005","90","","100.83","0.004","90","","1289.88","0.08","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(di-2-pyridylmethandiol)copper(II) diperchlorate","","- C22 H20 Cl2 Cu N4 O12 -","- C22 H20 Cl2 Cu N4 O12 -","- C44 H40 Cl4 Cu2 N8 O24 -","2","0.5","NA1335","Yang, Guang; Tong, Ming-Liang; Chen, Xiao-Ming; Ng, Seik Weng","Bis(di-2-pyridylmethanediol-<i>N</i>,<i>O</i>,<i>N</i>')copper(II) Diperchlorate","Acta Crystallographica Section C","1998","54","6","732","734","10.1107/S0108270198000225","","","0.71073","MoKα","","0.057","0.044","","0.131","0.12","","","","1.026","1.057","1.057","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007364","18.317","0.013","14.59","0.007","7.431","0.003","90","","90","","90","","1985.9","1.9","293","","293","","","","","","","","","5","P n m a","-P 2ac 2n","62","","pyridinium pentachloropyridinemolybdate(III)","","- C15 H17 Cl5 Mo N3 -","- C15 H17 Cl5 Mo N3 -","- C60 H68 Cl20 Mo4 N12 -","4","0.5","NA1339","Modec, Barbara; Papoular, Robert; Brenčič, Jurij V.","Bis(pyridinium) Pentachloro(pyridine-<i>N</i>)molybdate(III)","Acta Crystallographica Section C","1998","54","6","736","738","10.1107/S0108270198000237","","","0.71073","MoKα","","0.095","0.039","","0.042","0.033","","","","1.274","1.459","1.459","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007365","17.02","0.004","13.906","0.003","5.811","0.001","90","","90","","90","","1375.3","0.5","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C13 H14 N4 O3 -","- C13 H14 N4 O3 -","- C52 H56 N16 O12 -","4","1","","Modec, Barbara; Papoular, Robert; Brenčič, Jurij V.","Bis(pyridinium) Pentachloro(pyridine-N)molybdate(III)","Acta Crystallographica Section C","1998","54","","736","738","","","","","","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2007366","7.791","0.001","9.197","0.001","7.688","0.001","95.31","0.01","107.04","0.01","66.98","0.01","484.6","0.11","300","","","","","","","","","","","4","P -1","-P 1","2","","Magnesium bis (dihydrogenorthophosphate) tetrahydrate","","- H12 Mg O12 P2 -","- H12 Mg O12 P2 -","- H24 Mg2 O24 P4 -","2","1","OH1110","Miyake, Michihiro; Matsuda, Nobuyuki; Sato, Shoichi; Matsuda, Motohide; Nakagawa, Souhei; Ochiai, Junko","Mg(H~2~PO~4~)~2~.4H~2~O","Acta Crystallographica Section C","1998","54","6","702","703","10.1107/S0108270198000262","","","0.71069","MoKα","","","0.022","","","","0.033","","","","","","1.88","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007367","11.686","0.008","3.956","0.002","20.404","0.013","90","","106.06","0.07","90","","906.5","1","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-(1-Methyl-1,2-dihydropyridine-2-iminomethylene)propanedinitrile","","- C10 H8 N4 -","- C10 H8 N4 -","- C40 H32 N16 -","4","1","OS1002","Ján Lokaj; Viktor Kettmann; Viktor Milata; Rudolf Kada; Jordis Ulrich","2-(1-Methyl-1,2-dihydro-2-pyridylideneaminomethylene)propanedinitrile","Acta Crystallographica Section C","1998","54","6","785","787","10.1107/S0108270197017472","","","0.7107","MoKα","","0.1101","0.0502","","0.1303","0.0975","","","","1.004","1.105","1.105","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007368","10.098","0.002","18.902","0.004","16.71","0.003","90","","90","","90","","3189.5","1.1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","[2,5-diméthylpyrrolidin-2-yl] phosphonate de diisopropyle","","- C12 H26 N O3 P -","- C12 H26 N O3 P -","- C96 H208 N8 O24 P8 -","8","1","PA1253","Roubaud, Valerie; Siri, Didier; Tordo, Paul; Hdii, Fathia; Reboul, Jean-Pierre","(2,5-Diméthylpyrrolidin-2-yl)phosphonate de Diisopropyle","Acta Crystallographica Section C","1998","54","6","825","827","10.1107/S0108270197008408","","","0.7107","MoKα","","0.05","0.045","","0.09","0.089","","","","1.082","1.426","1.426","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007369","10.904","0.006","13.404","0.006","13.683","0.006","88.97","0.04","69.05","0.04","77.88","0.04","1822.5","1.6","126","2","126","2","","","","","","","","5","P -1","-P 1","2","","7-Nitro-5,10,15,20-tetraphenylporphyrin","","- C45 H31 Cl2 N5 O2 -","- C45 H31 Cl2 N5 O2 -","- C90 H62 Cl4 N10 O4 -","2","1","QA0038","Senge, Mathias O.","7-Nitro-5,10,15,20-tetraphenylporphyrin Dichloromethane Solvate","Acta Crystallographica Section C","1998","54","6","IUC9800022","","10.1107/S0108270198099648","","","0.71073","MoKα","","","0.0597","","","","0.1532","","","","","","1.036","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007370","9.9862","0.0005","12.3722","0.0005","16.0829","0.0007","90","","92.777","0.002","90","","1984.73","0.15","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-naphthylamino-2-benzoyl-3-phenyl-3-hydroxy-2-propene-1-one","","- C26 H19 N O3 -","- C26 H19 N O3 -","- C104 H76 N4 O12 -","4","1","QA0039","Sema Öztürk; Hoong-Kun Fun; Mehmet Akkurt; Mehmet Sönmez; Kandasamy Chinnakali","2-Benzoyl-3-hydroxy-1-naphthylamino-3-phenyl-2-propen-1-one","Acta Crystallographica Section C","1998","54","6","IUC9800023","","10.1107/S0108270198099636","","","0.71073","MoKα","","0.1538","0.0667","","0.1555","0.1192","","","","1.033","1.143","1.143","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007371","5.013","0.003","6.915","0.003","9.271","0.004","90","","90","","90","","321.4","0.3","130","2","130","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Ethane-1,2-diol","Ethane-1,2-diol","","- C2 H6 O2 -","- C2 H6 O2 -","- C8 H24 O8 -","4","1","QA0040","Boese, Roland; Weiss, Hans-Christoph","1,2-Ethanediol (Ethylene Glycol) at 130K","Acta Crystallographica Section C","1998","54","6","IUC9800024","","10.1107/S0108270198099624","","","0.71073","MoKα","","0.0544","0.0527","","0.1284","0.1254","","","","1.121","1.117","1.117","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007372","8.5553","0.0011","9.2494","0.0011","9.3431","0.0008","66.011","0.009","72.016","0.009","86.618","0.01","640.58","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Diethylenetriammonium oxalate hydrate (2:3:4)","","- C14 H40 N6 O16 -","- C14 H40 N6 O16 -","- C14 H40 N6 O16 -","1","0.5","QB0014","Barnes, John C.; Weakley, Timothy J.R.","Hydrogen Bonding in Two Forms of Bis(diethylenetriammonium) Trioxalate Tetrahydrate","Acta Crystallographica Section C","1998","54","6","IUC9800025","","10.1107/S0108270198099612","","","0.71069","MoKα","","0.0547","0.0341","","","","0.103","","","","","","0.912","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2007373","19.3069","0.0016","6.6698","0.0009","12.0449","0.0009","90","","120.166","0.007","90","","1341","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diethylenetriammonium oxalate hydrate (2:3:4)","","- C14 H40 N6 O16 -","- C14 H36 N6 O16 -","- C28 H72 N12 O32 -","2","0.5","QB0014","Barnes, John C.; Weakley, Timothy J.R.","Hydrogen Bonding in Two Forms of Bis(diethylenetriammonium) Trioxalate Tetrahydrate","Acta Crystallographica Section C","1998","54","6","IUC9800025","","10.1107/S0108270198099612","","","0.71073","MoKα","","0.1548","0.0627","","","","0.2179","","","","","","0.967","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2007374","10.235","0.004","8.6448","0.0012","10.495","0.002","90","","118.586","0.015","90","","815.4","0.4","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Ce H2 O9 Rb S2 -","- Ce H2 O9 Rb S2 -","- Ce4 H8 O36 Rb4 S8 -","4","1","QB0042","Robinson, Paul D.; Jasty, Shashi","Rubidium Cerium Sulfate Monohydrate, RbCe(SO~4~)~2~.H~2~O","Acta Crystallographica Section C","1998","54","6","IUC9800021","","10.1107/S010827019809965X","","","0.71069","MoKα","","0.023","0.0191","","","","0.0507","","","","","","1.104","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007375","12.984","0.002","6.893","0.001","17.224","0.002","90","","90","","90","","1541.5","0.4","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C17 H20 N2 O2 -","- C17 H20 N2 O2 -","- C68 H80 N8 O8 -","4","0.5","SK1089","Işik, Şamil; Aygün, Muhittin; Kocaokutgen, Hasan; Tahir, M. Nawaz; Büyükgüngör, Orhan; Erdönmez, Ahmet","3-<i>tert</i>-Butyl-2hydroxy-5-methoxyazobenzene","Acta Crystallographica Section C","1998","54","6","859","860","10.1107/S0108270198000286","","","0.71069","MoKα","","0.0792","0.044","","0.113","0.1032","","","","1.055","1.219","1.219","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007376","13.0786","0.0008","12.174","0.0007","9.9027","0.0009","90","","94.354","0.008","90","","1572.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(2,4-dimethylpyridine((N-salicylideneglycinato)copper(II)","","- C16 H18 Cu N2 O4 -","- C16 H18 Cu N2 O4 -","- C64 H72 Cu4 N8 O16 -","4","1","SK1096","Warda, Salam A.","Aqua(2,4-dimethylpyridine-<i>N</i>)(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1998","54","6","768","770","10.1107/S0108270197019367","","","0.71073","MoKα","","0.0507","0.0373","","0.101","","","","","1.075","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007377","10.9539","0.0012","8.1317","0.0011","17.9391","0.0014","90","","105.566","0.004","90","","1539.3","0.3","295","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H13 N3 Ni O2 -","- C19 H13 N3 Ni O2 -","- C76 H52 N12 Ni4 O8 -","4","1","SK1106","Ülkü, Dinçer; Tahir, M. Nawaz; Nazır, Hasan; Yilmaz, Hamza","[2,3-Bis(salicylideneamino-<i>O</i>,<i>N</i>)pyridinato]nickel(II)","Acta Crystallographica Section C","1998","54","6","725","726","10.1107/S0108270197019379","","","0.71073","MoKα","","","0.052","","","0.056","","","","","0.88","0.88","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007378","10.817","0.002","12.908","0.003","14.08","0.003","105.13","0.03","105.77","0.04","103.46","0.04","1726","1","90","2","90","2","","","","","","","","7","P -1","-P 1","2","","(Nitrito-O,O')bis(triphenylphosphine)silver(I)‒dichloromethane","","- C37 H32 Ag Cl2 N O2 P2 -","- C37 H32 Ag Cl2 N O2 P2 -","- C74 H64 Ag2 Cl4 N2 O4 P4 -","2","1","SK1123","Belaj, Ferdinand; Trnoska, Andreas; Nachbaur, Edgar","(Nitrito-<i>O</i>,<i>O</i>')bis(triphenylphosphine-<i>P</i>)silver(I) Dichloromethane Solvate","Acta Crystallographica Section C","1998","54","6","727","728","10.1107/S0108270197020039","","","0.71069","MoKα","","0.06","0.047","","0.134","0.122","","","","1.044","1.061","1.061","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007379","9.168","0.001","9.313","0.003","16.59","0.009","90","","105.88","0.02","90","","1362.4","0.9","295","1","295","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","dibenz[c,e]azepine","±-6,7-Dihydro-1,6,11-trimethyl-5H-dibenz[c,e]azepine","","- C17 H19 N -","- C17 H19 N -","- C68 H76 N4 -","4","1","SK1156","Mrvoš-Sermek, Draginja; Lončar-Tomašković, Linda; Hergold-Brundić, Antonija; Mintas, Mladen; Nagl, Ante","(±)-6,7-Dihydro-1,6,11-trimethyl-5<i>H</i>-dibenz[<i>c</i>,<i>e</i>]azepine","Acta Crystallographica Section C","1998","54","6","877","879","10.1107/S0108270198000936","","","0.71073","MoKα","","0.0814","0.046","","0.146","0.1232","","","","1.028","1.112","1.112","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007380","8.003","0.005","11.253","0.005","18.461","0.005","90","0.005","90","0.005","90","0.005","1662.6","1.4","292","2","292","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","dimethyl 2-((1S)-1-((4S)-2,2-dimethyl-1,3-dioxolan-4-yl)-2-methyl-2- nitropropyl) malonate","","- C14 H23 N O8 -","- C14 H23 N O8 -","- C56 H92 N4 O32 -","4","1","SK1167","Baudoux, Guy; Norberg, Bernadette; Provins, Laurent; Froidbize, Alexandre; Krief, Alain; Evrard, Guy","Three Intermediates in the Synthesis of Chrysanthemic Acid","Acta Crystallographica Section C","1998","54","6","834","837","10.1107/S0108270198000298","","","1.54178","CuKα","","0.052","0.052","","","","0.124","","","","","","1.062","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007381","10.693","0.001","8.446","0.001","11.992","0.001","90","","101.268","0.005","90","","1062.16","0.18","292","2","292","2","","","","","","","","4","P 1 21 1","P 2yb","4","","methyl (3S)-2-acetyl-3-((4S)-2,2-dimethyl-1,3-dioxolan-4-yl)-4-methyl- (phenylsulfonyl) pentanoate","","- C20 H28 O8 S -","- C20 H28 O8 S -","- C40 H56 O16 S2 -","2","1","SK1167","Baudoux, Guy; Norberg, Bernadette; Provins, Laurent; Froidbize, Alexandre; Krief, Alain; Evrard, Guy","Three Intermediates in the Synthesis of Chrysanthemic Acid","Acta Crystallographica Section C","1998","54","6","834","837","10.1107/S0108270198000298","","","1.54178","CuKα","","0.032","0.03","","","","0.077","","","","","","1.083","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007382","7.3201","0.0001","10.719","0.001","19.39","0.001","90","0.006","90","0.004","90","0.005","1521.42","0.16","292","2","292","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","dimethyl (3S)-3-((4S)-2,2-dimethyl-1,3-dioxolan-4-yl)-2,2- dimethylcyclopropane-1,1-dicarboxylate","","- C14 H22 O6 -","- C14 H22 O6 -","- C56 H88 O24 -","4","1","SK1167","Baudoux, Guy; Norberg, Bernadette; Provins, Laurent; Froidbize, Alexandre; Krief, Alain; Evrard, Guy","Three Intermediates in the Synthesis of Chrysanthemic Acid","Acta Crystallographica Section C","1998","54","6","834","837","10.1107/S0108270198000298","","","1.54178","CuKα","","0.054","0.049","","","","0.142","","","","","","1.082","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007383","11.17","0.005","12.181","0.004","9.366","0.004","90.75","0.04","105.24","0.04","112.92","0.03","1122.9","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Irbesartan","","","- C25 H28 N6 O -","- C25 H28 N6 O -","- C50 H56 N12 O2 -","2","1","SX1039","Böcskei, Zsolt; Simon, Kálmán; Rao, Renée; Caron, Antoine; Rodger, Charles A.; Bauer, Michel","Irbesartan Crystal Form B","Acta Crystallographica Section C","1998","54","6","808","810","10.1107/S0108270197019884","","","1.5418","CuKα","","0.077","0.062","","0.204","0.17","","","","1.029","1.06","1.06","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007384","7.554","0.0008","7.3473","0.0006","11.8146","0.0011","90","","107.148","0.008","90","","626.58","0.11","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","desmethyl selegiline","","","- C12 H16 Cl N -","- C12 H16 Cl N -","- C24 H32 Cl2 N2 -","2","1","SX1040","Simon, Kálmán; Harmat, Veronika; Hermecz, István","Isostructural Metabolites of Two Anti-Parkinson Drugs","Acta Crystallographica Section C","1998","54","6","811","813","10.1107/S0108270197019896","","","1.54178","CuKα","","0.095","0.077","","0.256","0.218","","","","1.156","1.154","1.154","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007385","7.481","0.002","7.447","0.002","11.8743","0.0009","90","","107.48","0.009","90","","631","0.2","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","p-fluoro-dezmethyl-selegiline","","","- C12 H15 Cl F N -","- C12 H15 Cl F N -","- C24 H30 Cl2 F2 N2 -","2","1","SX1040","Simon, Kálmán; Harmat, Veronika; Hermecz, István","Isostructural Metabolites of Two Anti-Parkinson Drugs","Acta Crystallographica Section C","1998","54","6","811","813","10.1107/S0108270197019896","","","1.54178","CuKα","","0.078","0.06","","0.184","0.166","","","","1.108","1.141","1.141","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007386","11.922","0.001","18.963","0.002","12.826","0.001","90","","90.83","0.01","90","","2899.4","0.5","293","","293","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","8-Chloro-5-(4-chlorophenyl)-5H-indeno[1,2d]pyrimidine","","- C17 H10 Cl2 N2 -","- C17 H10 Cl2 N2 -","- C136 H80 Cl16 N16 -","8","2","SX1053","Caruso, Francesco; Rossi, Miriam","8-Chloro-5-(4-chlorophenyl)-5<i>H</i>-indeno-[1,2-<i>d</i>]pyrimidine","Acta Crystallographica Section C","1998","54","6","842","844","10.1107/S0108270198000572","","","1.54178","CuKα","","0.044","0.044","","0.056","0.056","","","","0.986","0.986","0.986","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2007387","13.068","0.003","13.715","0.003","14.312","0.003","84.48","0.02","65.25","0.02","86.76","0.02","2318.3","1","158","2","158","2","","","","","","","","5","P -1","-P 1","2","","(Dicyclohexylammonium succinatotributylstannate)^.^1/2(dicyclohexylammonium succinate) hydrate","","- C84 H166 N4 O14 Sn2 -","- C84 H166 N4 O14 Sn2 -","- C84 H166 N4 O14 Sn2 -","1","0.5","SX1058","Ng, Seik Weng; Holeček, Jaroslav","2[(C~6~H~11~)~2~NH~2~]^+^.[Sn(O~2~CCH~2~CH~2~CO~2~)(C~4~H~9~)~3~]^{-^}.1/2(O~2~CCH~2~CH~2~CO~2~)^2{-^}.H~2~O, an Organostannate Consisting of Linear Polyanionic Tributyl(succinato)stannate Chains Hydrogen Bonded into Layers by a [Tetrakis(dicyclohexylammonium) Succinate Dihydrate] Dicationic Network","Acta Crystallographica Section C","1998","54","6","750","752","10.1107/S010827019701888X","","","0.71073","MoKα","","0.1292","0.069","","0.1602","0.1255","","","","1.032","1.079","1.079","","","","","has coordinates","249787","2020-10-21","18:00:00",""
"2007388","9.535","0.002","19.225","0.002","9.76","0.002","90","","102.98","0.01","90","","1743.4","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(triphenyltin) succinate","μ-Succinatobis(triphenyltin)","","- C40 H34 O4 Sn2 -","- C40 H34 O4 Sn2 -","- C80 H68 O8 Sn4 -","2","0.5","SX1059","Ng, Seik Weng","Bis(triphenyltin) Succinate and its Complex with Dimethyl Sulfoxide and Ethanol, and its Complex with Hexamethylphosphoramide","Acta Crystallographica Section C","1998","54","6","745","750","10.1107/S0108270197018908","","","0.71073","MoKα","","0.0504","0.0366","","0.0941","0.0869","","","","1.127","1.174","1.174","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007389","14.206","0.002","15.777","0.001","20.198","0.002","67.565","0.006","74.546","0.008","70.904","0.008","3901.7","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","[Bis(triphenyltin) succinate]^.^[bis(triphenyltin) succinate^.^sesqui(dimethylsulfoxide)^.^hemiethanol]","","- C84 H80 O10 S1.5 Sn4 -","- C84 H80 O10 S1.5 Sn4 -","- C168 H160 O20 S3 Sn8 -","2","1","SX1059","Ng, Seik Weng","Bis(triphenyltin) Succinate and its Complex with Dimethyl Sulfoxide and Ethanol, and its Complex with Hexamethylphosphoramide","Acta Crystallographica Section C","1998","54","6","745","750","10.1107/S0108270197018908","","","0.71073","MoKα","","0.0549","0.0373","","0.101","0.09","","","","1.041","1.053","1.053","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007390","12.488","0.001","14.068","0.002","14.182","0.004","72.11","0.02","81.76","0.02","78.55","0.01","2314.8","0.8","298","2","298","2","","","","","","","","6","P -1","-P 1","2","[bis(triphenyltin) succinate][bis(triphenyltin) succinate^.^2HMPA]","[μ-succinatobis(triphenyltin)]^.^[μ- succinatobis(triphenyltin)^.^bis(hexamethylphosphoramide)]","","- C92 H104 N6 O10 P2 Sn4 -","- C92 H104 N6 O10 P2 Sn4 -","- C92 H104 N6 O10 P2 Sn4 -","1","0.5","SX1059","Ng, Seik Weng","Bis(triphenyltin) Succinate and its Complex with Dimethyl Sulfoxide and Ethanol, and its Complex with Hexamethylphosphoramide","Acta Crystallographica Section C","1998","54","6","745","750","10.1107/S0108270197018908","","","0.71073","MoKα","","0.0509","0.0417","","0.1167","0.1092","","","","1.06","1.085","1.085","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007391","12.442","0.002","12.516","0.003","22.163","0.005","88.01","0.06","78.48","0.03","77.88","0.01","3306.3","1.3","158","2","158","2","","","","","","","","5","P -1","-P 1","2","Bis[1,1,3,3-tetrabutyl-1,3-bis(picolinato-N-oxide)distannoxane] hydrate","","","- C56 H90 N4 O15 Sn4 -","- C56 H90 N4 O15 Sn4 -","- C112 H180 N8 O30 Sn8 -","2","1","SX1060","Ng, Seik Weng","Octabutyl-1κ^2^<i>C</i>,2κ^2^<i>C</i>,3κ^2^<i>C</i>,4κ^2^<i>C</i>-bis-μ~3~-oxo-1:2:3κ^3^<i>O</i>;1:3:4κ^3^<i>O</i>-tetrakis[μ-(2-pyridinecarboxylato <i>N</i>-oxide)]-1κ^2^<i>O</i>,<i>O</i>':2κ<i>O</i>;2κ<i>O</i>:3κ^2^<i>O</i>,<i>O</i>';3κ^2^<i>O</i>,<i>O</i>':4κ<i>O</i>;1κ^2^<i>O</i>,<i>O</i>':4κ<i>O</i>-tetratin Hydrate","Acta Crystallographica Section C","1998","54","6","752","755","10.1107/S010827019701891X","","","0.71073","MoKα","","0.0786","0.0486","","0.1331","0.1216","","","","0.9","1.035","1.035","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007392","5.7473","0.0003","7.6109","0.0007","9.0705","0.0009","70.19","0.008","85.259","0.006","78.188","0.006","365.34","0.06","296","","","","","","","","","","","3","P 1","P 1","1","","","","- C15 H22 O5 -","- C15 H21.92 O5 -","- C15 H21.92 O5 -","1","1","SX1065","Thalji, Reema K.; Pentes, Howard G.; Fischer, Nikolaus H.; Fronczek, Frank R.","8-Desacetoxy-11β<i>H</i>,13-dihydroperoxyferolide, a Sesquiterpene Lactone Hydroperoxide","Acta Crystallographica Section C","1998","54","6","861","863","10.1107/S0108270197020088","","","1.54184","CuKα","","","0.04","","","0.054","","","","","1.94","1.94","","","","","has coordinates","208347","2020-10-21","18:00:00",""
"2007393","17.789","0.004","16.927","0.005","11.751","0.002","90","","101.18","0.02","90","","3471.2","1.4","293","1","293","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","racemic-1,1,6,6-tetramethyl-1,6-distannatetranaphtho [2,1-b;1',2'-d;2"",1""-g;1""',2""'-i]cyclodeca-2,4,7,9-tetraene","","- C44 H36 Sn2 -","- C44 H36 Sn2 -","- C176 H144 Sn8 -","4","1","TA1135","Tani, Kazuhide; Yamagata, Tsuneaki; Hironori Tashiro","Racemic 1,1,6,6-Tetramethyl-1,6-distannatetranaphtho[2,1-<i>b</i>;1',2'-<i>d</i>;2'',1''-<i>g</i>;1''',2'''-<i>i</i>]cyclodeca-2,4,7,9-tetraene","Acta Crystallographica Section C","1998","54","6","755","757","10.1107/S0108270197007750","","","0.71069","MoKα","","0.126","0.057","","0.086","0.071","","","","0.842","0.986","0.986","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007394","17.492","0.004","10.839","0.002","5.753","0.001","90","","90","","90","","1090.7","0.4","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C10 H8 N2 Se2 -","- C10 H8 N2 Se2 -","- C40 H32 N8 Se8 -","4","1","TA1189","Dunne, Simon, J.; von Nagy-Felsobuki, Ellak, I.; Mackay, Maureen, F.","An Orthorhombic Polymorph of 2,2'-Dipyridyl Diselenide","Acta Crystallographica Section C","1998","54","6","887","889","10.1107/S0108270197018118","","","1.5418","CuKα","","0.0331","0.0321","","0.0878","0.0867","","","","1.108","1.124","1.124","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007395","16.964","0.003","18.972","0.004","21.063","0.003","90","","90","","90","","6779","2","298","2","153","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","O,O'-trifluoroacetatobis(triphenylphosphine)silver(I)","","- C38 H30 Ag F3 O2 P2 -","- C38 H30 Ag F3 O2 P2 -","- C304 H240 Ag8 F24 O16 P16 -","8","1","TA1203","Ng, Seik Weng","(Trifluoroacetato-<i>O</i>,<i>O</i>')bis(triphenylphosphine-<i>P</i>)silver(I)","Acta Crystallographica Section C","1998","54","6","743","744","10.1107/S0108270198000304","","","0.71073","MoKα","","0.0796","0.066","","0.133","0.1275","","","","1.334","1.38","1.38","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007396","18.4645","0.0009","8.0647","0.0006","21.9392","0.0009","90","","90","","90","","3267","0.3","300","2","300","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3,5-Bis(2-pyridyl)-4-p-bromophenyl-1,2,4-triazole","","- C18 H12 Br N5 -","- C18 H12 Br N5 -","- C144 H96 Br8 N40 -","8","1","TA1205","Chen, Wei; Wang, Z. X.; Jian, F. F.; Bai, Z. P.; You, X. Z.","4-(<i>p</i>-Bromophenyl)-3,5-bis(2-pyridyl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","1998","54","6","851","852","10.1107/S0108270198000316","","","0.71073","MoKα","","0.127","0.059","","0.121","0.103","","","","0.925","1.134","1.134","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007397","15.575","0.005","8.455","0.005","22.745","0.005","90","","90","","90","","2995","2","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","(Bis(pyridine-2-ylmethyl)amine)iron(III)chloride","","- C12 H13 Cl3 Fe N3 -","- C12 H13 Cl3 Fe N3 -","- C96 H104 Cl24 Fe8 N24 -","8","2","VJ1072","K. R. Justin Thomas; Marappan Velusamy; Mallayan Palaniandavar","A Polymorph of Bis(2-pyridylmethyl)amine Iron(III) Chloride","Acta Crystallographica Section C","1998","54","6","741","743","10.1107/S0108270197016624","","","0.71073","MoKα","","0.0525","0.0332","","0.1475","0.0863","","","","1.109","0.986","0.986","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007398","8.42","0.0007","12.908","0.002","7.9874","0.0009","94.902","0.011","93.311","0.008","104.834","0.008","833.25","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Chloro(2,3-dimethylbutane-2,3-diolato-O,O'(2-))(2,3-dimethylbutane-2,3- diolato-O,O'-(1-))oxotungsten(VI)","","- C12 H25 Cl O5 W -","- C12 H25 Cl O5 W -","- C24 H50 Cl2 O10 W2 -","2","1","AB1506","Lehtonen, Ari; Sillanpää, Reijo","Chloro[2,3-dimethylbutane-2,3-diolato(2 ‒)-<i>O</i>,<i>O</i>'][2,3-dimethylbutane-2,3-diolato(1 ‒)-<i>O</i>,<i>O</i>']oxotungsten(VI)","Acta Crystallographica Section C","1998","54","7","935","937","10.1107/S0108270198000705","","","0.71069","MoKα","","0.024","0.02","","0.045","0.045","","","","1.096","1.112","1.112","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007399","6.739","0.001","10.731","0.001","11.606","0.001","100.96","0.001","98.01","0.001","105.11","0.01","779.55","0.16","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H18 O2 -","- C21 H18 O2 -","- C42 H36 O4 -","2","1","AB1522","Puviarasan, Krishnan.; Govindasamy, Lakshmanan.; Velmurugan, Devadesan.; Shanmuga Sundara Raj, Sivanantha Perumal.; Shanmuga sundaram, Muthian.; Raghunathan, Raghavachary.; Hoong-Kun Fun","3-Phenylspiro[bicyclo[2.2.1]hept-5-ene-2,3'-chroman]-4'-one","Acta Crystallographica Section C","1998","54","7","961","963","10.1107/S0108270198000110","","","0.71073","MoKα","","0.0561","0.0415","","","","0.1298","","","","","","1.054","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007400","14.8109","0.0004","9.6159","0.0003","12.2536","0.0004","90","","91.705","0.001","90","","1744.39","0.09","198","2","198","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-ethylene-bis(salicylideneaminato)-nitrido-chromium(V)","","- C17 H17 Cr N4 O4 -","- C17 H17 Cr N4 O4 -","- C68 H68 Cr4 N16 O16 -","4","1","AB1529","Jesper Bendix; Scott R. Wilson; Teresa Prussak-Wieckowska","The Improved Synthesis of [Cr(N)(salen)].CH~3~NO~2~","Acta Crystallographica Section C","1998","54","7","923","925","10.1107/S0108270198000870","","","0.71073","MoKα","","0.06","0.042","","0.108","0.094","","","","1.116","1.102","1.102","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007401","16.886","0.003","12.481","0.002","11.521","0.002","90","","90","","90","","2428.1","0.7","293","2","293","2","","","","","","","","5","C m c a","-C 2ac 2","64","","bis-(μ-(3,4-dimethylphospholyl))-octacarbonyl-dimanganese","","- C20 H16 Mn2 O8 P2 -","- C20 H16 Mn2 O8 P2 -","- C80 H64 Mn8 O32 P8 -","4","","AB1530","Flörke, Ulrich; Krampe, Olaf; Haupt, Hans-Jürgen","Bis(μ-3,4-dimethylphosphol-1-yl)bis(tetracarbonylmanganese)","Acta Crystallographica Section C","1998","54","7","918","920","10.1107/S0108270198001036","","","0.71073","MoKα","","0.0543","0.0345","","0.0932","","0.0745","","","1.063","","","1.017","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007402","23.437","0.003","11.8595","0.0013","17.898","0.002","90","","97.418","0.01","90","","4933.1","1","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5,17-Dinitro-11,23-diphthalimido-25,26,27,28-tetrapropoxycalix[4]arene","","- C56 H52 N4 O12 -","- C56 H52 N4 O12 -","- C224 H208 N16 O48 -","4","0.5","AB1536","Spek, Anthony L.; Boerrigter, Harold; Verboom, Willem; Reinhoudt, David N.","5,17-Dinitro-11,23-diphthalimido-25,26,27,28-tetrapropoxycalix[4]arene","Acta Crystallographica Section C","1998","54","7","1023","1025","10.1107/S0108270198001516","","","0.71073","MoKα","","0.095","0.05","","","","0.117","","","","","","1.004","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007403","10.01","0.002","10.737","0.002","10.512","0.002","90","","99.41","0.01","90","","1114.6","0.4","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","phenanthrene-4-carboxylic acid","","","- C15 H10 O2 -","- C15 H10 O2 -","- C60 H40 O8 -","4","1","BK1359","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Phenanthrene-4-carboxylic Acid and 1,2-Dihydrophenanthrene-4-carboxylic Acid","Acta Crystallographica Section C","1998","54","7","966","969","10.1107/S0108270198000122","","","0.71073","MoKα","","","0.049","","0.114","","0.114","","","","","","1.19","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007404","16.065","0.003","16.534","0.002","8.632","0.002","90","","90","","90","","2292.8","0.7","296","","296","","","","","","","","","3","P b c a","-P 2ac 2ab","61","1,2-dihydrophenanthrene-4-carboxylic acid","","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","BK1359","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Phenanthrene-4-carboxylic Acid and 1,2-Dihydrophenanthrene-4-carboxylic Acid","Acta Crystallographica Section C","1998","54","7","966","969","10.1107/S0108270198000122","","","0.71073","MoKα","","","0.043","","0.104","","0.104","","","1.25","","","1.25","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007405","8.574","0.001","30.57","0.009","7.0473","0.0008","90","","100.53","0.01","90","","1816","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H24 N2 O2 -","- C21 H24 N2 O2 -","- C84 H96 N8 O8 -","4","1","BK1361","S. Selladurai; R. Chandrasekaran; L. Govindasamy; Il-Hwan Suh","9-(4-Dimethylaminophenyl)-3,4,6,7,9,10-hexahydro-1,8(2<i>H</i>,5<i>H</i>)-acridinedione","Acta Crystallographica Section C","1998","54","7","957","959","10.1107/S0108270198001401","","","0.71069","MoKα","","0.116","0.049","","0.291","","0.291","","","1.616","","","1.091","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007406","28.048","0.002","7.9501","0.0014","13.6096","0.001","90","","90","","90","","3034.7","0.6","293","2","293","2","","","","","","","","7","P 21 21 2","P 2 2ab","18","","","","- C22 H52 Cl4 N4 O12 Pd4 S7 -","- C22 H52 Cl4 N4 O12 Pd4 S7 -","- C44 H104 Cl8 N8 O24 Pd8 S14 -","2","0.5","BM1182","Chen, Xiao-hua; Zhu, Long-gen; Duan, Chun-ying; Liu, Yong-jiang; Kostic, Nenad M.","A Tetranuclear Complex of Palladium(II) with Cysteine","Acta Crystallographica Section C","1998","54","7","909","911","10.1107/S0108270198001012","","","0.71073","MoKα","","0.1136","0.0668","","0.2384","0.1713","","","","1.204","1.466","1.466","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007407","14.574","0.008","6.5096","0.0016","10.103","0.005","90","","109.82","0.04","90","","901.7","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4,4a,5,6,7,8,8a-octahydro-8a-hydroxy-2-quinolone","","- C9 H15 N O2 -","- C9 H15 N O2 -","- C36 H60 N4 O8 -","4","1","BM1184","Stefano Alini; Attilio Citterio; Alessandra Farina; Maria Cristina Fochi; Luciana Malpezzi","3,4,4a,5,6,7,8,8a-Octahydro-8a-hydroxy-2-quinolone and its 8a-Hydroperoxy Derivative","Acta Crystallographica Section C","1998","54","7","1000","1003","10.1107/S0108270198001565","","","1.54178","CuKα","","0.034","0.037","","","0.105","0.107","","","","","","1.07","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007408","6.912","0.001","10.905","0.002","12.848","0.002","90","","102.62","0.01","90","","945","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4,4a,5,6,7,8,8a-octahydro-8a-hydroperoxy-2-quinolone","","- C9 H15 N O3 -","- C9 H15 N O3 -","- C36 H60 N4 O12 -","4","1","BM1184","Stefano Alini; Attilio Citterio; Alessandra Farina; Maria Cristina Fochi; Luciana Malpezzi","3,4,4a,5,6,7,8,8a-Octahydro-8a-hydroxy-2-quinolone and its 8a-Hydroperoxy Derivative","Acta Crystallographica Section C","1998","54","7","1000","1003","10.1107/S0108270198001565","","","1.54178","CuKα","","0.055","0.044","","","0.119","0.127","","","","","","1.021","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007409","9.554","0.001","10.401","0.001","12.999","0.001","71.92","0.01","70.72","0.01","74.95","0.01","1141.2","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H22 N2 O2 -","- C30 H22 N2 O2 -","- C60 H44 N4 O4 -","2","1","BM1201","Puviarasan, K.; Govindasamy, L.; Velmurugan, D.; Shanmuga Sundara Raj, S.; Hoong-Kun Fun; Shanmuga Sundaram, M.; Raghunathan, R.","1,3,4,8-Tetraphenyl-7-oxa-1,2-diazaspiro[4.4]nona-2,8-dien-6-one","Acta Crystallographica Section C","1998","54","7","959","961","10.1107/S0108270197020180","","","0.71073","MoKα","","0.0812","0.0407","","","","0.1141","","","","","","0.783","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007410","11.999","0.002","15.45","0.002","13.197","0.002","90","","90","","90","","2446.5","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Ferrocenium μ-bromo-bis(dibromodimethylstannate(IV))","","- C14 H22 Br5 Fe Sn2 -","- C14 H22 Br5 Fe Sn2 -","- C56 H88 Br20 Fe4 Sn8 -","4","0.5","BM1212","Razak, Ibrahim Abdul; Fun, Hoong-Kun; Yamin, Bohari M.; Boshaala, Ahmed M. A.; Chinnakali, Kandasamy","Ferrocenium μ-Bromo-bis[dibromodimethylstannate(IV)]","Acta Crystallographica Section C","1998","54","7","912","914","10.1107/S0108270198002352","","","0.71073","MoKα","","0.2","0.043","","0.107","0.081","","","","0.704","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007411","10.7138","0.0011","11.5397","0.0014","18.747","0.003","90","","90","","90","","2317.8","0.5","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Methyl 5-deoxy-5-C-[(iododiphenylstannyl)methyl]-2,3-O-isopropylidene -α-D-lyxofuranoside","","- C22 H27 I O4 Sn -","- C22 H27 I O4 Sn -","- C88 H108 I4 O16 Sn4 -","4","1","BM1215","Charles C. C. Chibesakunda; Philip J. Cox; Helena Rufino; James L. Wardell","Methyl 5-Deoxy-5-<i>C</i>-[(iododiphenylstannyl)methyl]-2,3-<i>O</i>-isopropylidene-α-<small>D</small>-lyxofuranoside","Acta Crystallographica Section C","1998","54","7","925","927","10.1107/S0108270198001413","","","0.71073","MoKα","","0.04","0.038","","","","0.093","","","","","","1.12","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007412","7.638","0.008","10.885","0.012","10.845","0.012","60.832","0.01","69.164","0.01","79.24","0.01","735.7","1.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,4,6-Tri-2-pyridyl-1,3,5-Triazine","","- C18 H12 N6 -","- C18 H12 N6 -","- C36 H24 N12 -","2","1","BM1223","Drew, Michael G. B.; Hudson, Michael J.; Iveson, Peter B.; Russell, Mark L.; Madic, Charles","2,4,6-Tris(2-pyridyl)-1,3,5-triazine","Acta Crystallographica Section C","1998","54","7","985","987","10.1107/S0108270198001929","","","0.71073","MoKα","","0.058","0.05","","","","0.159","","","","","","1.092","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007413","8.052","0.003","6.632","0.005","9.815","0.002","90","","90","","90","","524.1","0.5","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- As Li3 S3 -","- As Li3 S3 -","- As4 Li12 S12 -","4","1","BR1180","Seung,Do-Young; Gravereau,Pierre; Trut,Louis; Levasseur,Alain","Li~3~AsS~3~","Acta Crystallographica Section C","1998","54","7","900","902","10.1107/S0108270198001103","","","0.7107","MoKα","","","0.051","","","","0.1017","","","","","","1.182","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007415","15.6684","0.0008","15.6684","0.0008","3.829","0.001","90","","90","","90","","940","0.3","298","","298","","","","","","","","","3","I 4/m","-I 4","87","","Nonaniobium arsenic pentacosaoxide,","","- As Nb9 O25 -","- As Nb9 O25 -","- As2 Nb18 O50 -","2","0.125","BR1199","Ulutagay, Mutlu; Schimek, George L.; Hwu, Shiou-Jyh","A Niobium(V) Arsenate: Nb~9~AsO~25~","Acta Crystallographica Section C","1998","54","7","898","900","10.1107/S0108270198000134","","","0.71073","MoKα","","0.0295","0.0259","","0.0528","0.0522","","","","","1.69","1.69","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007416","9.728","0.002","10.556","0.002","9.499","0.003","108.59","0.02","93.55","0.02","102.414","0.015","893.9","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H30 Br2.5 Cl1.5 O2 P2 Re -","- C36 H30 Br2.52 Cl1.52 O2 P2 Re -","- C36 H30 Br2.52 Cl1.52 O2 P2 Re -","1","0.5","CF1176","Harben, Spencer M.; Smith, Paul D.; Beddoes, Roy L.; Helliwell, Madeleine; Collison, David; Garner, C. David","Mixed-halide Complex <i>trans</i>-Tetrahalobis(triphenylphosphine oxide)rhenium(IV)","Acta Crystallographica Section C","1998","54","7","941","943","10.1107/S0108270197018027","","","1.54178","CuKα","","0.056","0.052","","0.148","0.1411","","","","1.095","1.084","1.084","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007417","8.483","0.001","19.174","0.003","7.1793","0.0008","90","","90","","90","","1167.7","0.3","123","","123","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H17 N O -","- C13 H17 N O -","- C52 H68 N4 O4 -","4","1","CF1221","Graham, Duncan; Kennedy, Alan R.","7-Methoxy-2,2,4-trimethyl-1,2-dihydroquinoline","Acta Crystallographica Section C","1998","54","7","978","980","10.1107/S0108270198001577","","","0.71069","MoKα","","0.076","0.036","","0.047","0.041","","","","","1.22","1.22","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007418","9.023","0.0005","17.894","0.002","24.469","0.002","90","","90","","90","","3950.7","0.6","299","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1α-(3'-furyl)-4β,4aβ-epoxy-5,8aα-dimethyl-3-oxohexahydro- 1H-2-benzopyran","","- C15 H16 O4 -","- C15 H16 O4 -","- C180 H192 O48 -","12","3","DA1000","Rajab, Mohamed S.; Fronczek, Frank R.; Rugutt, Joseph K.; Fischer, Nikolaus H.","Calodendrolide, a Degraded Limonoid from <i>Calodendrum capense</i>","Acta Crystallographica Section C","1998","54","7","950","952","10.1107/S0108270197015151","","","1.54184","CuKα","","","0.052","","","0.044","","","","","1.557","1.557","","","","","has coordinates,has Fobs","208466","2020-10-21","18:00:00",""
"2007419","11.159","0.002","16.21","0.003","16.807","0.003","87.58","0.03","81.48","0.03","80.65","0.03","2966.2","1","295","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C68 H79 N3 O11 -","- C68 H79 N3 O11 -","- C136 H158 N6 O22 -","2","1","DA1004","Nachtigall, Francine F.; Vencato, Ivo; Lazzarotto, Márcio; Nome, Faruk","Calix[4]arene Piperidinium Salt","Acta Crystallographica Section C","1998","54","7","1007","1010","10.1107/S0108270197019197","","","0.71073","MoKα","","0.1065","0.0567","","","","0.1917","","","","","","1.024","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007420","5.0283","0.0003","8.0427","0.0005","16.03","0.001","90","","90","","90","","648.27","0.07","295","","295","","","","","","","","","4","P b c a","-P 2ac 2ab","61","Lithium Ethylene Glyconate","mono lithium ethylene glyconate","","- C2 H5 Li O2 -","- C2 H5 Li O2 -","- C16 H40 Li8 O16 -","8","1","DA1011","Mamak, Marc; Zavalij, Peter Y.; Whittingham, M. Stanley","Layered Structure of Lithium Ethylene Glycolate, Li(OCH~2~CH~2~OH)","Acta Crystallographica Section C","1998","54","7","937","939","10.1107/S0108270198002121","","","0.71069","MoKα","","","0.036","","","0.055","","","","","1.63","1.63","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2007421","12.704","0.002","15.788","0.004","16.676","0.002","90","","107.7","0.01","90","","3186.4","1","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C19 H18 N2 O -","- C19 H18 N2 O -","- C152 H144 N16 O8 -","8","2","DE1064","R.V. Krishnakumar; S. Natarajan; V. Vijayabaskar; S. Perumal","Racemic 1-Acetyl-5-phenyl-3-styryl-2-pyrazoline","Acta Crystallographica Section C","1998","54","7","976","978","10.1107/S0108270198000146","","","0.71073","MoKα","","0.118","0.07","","0.148","0.135","","","","1.284","1.547","1.547","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007422","10.25","0.004","19.183","0.005","10.077","0.005","90","","99.05","0.03","90","","1956.7","1.3","288","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Cl F2 N O6 S2 -","- C17 H16 Cl F2 N O6 S2 -","- C68 H64 Cl4 F8 N4 O24 S8 -","4","1","DE1071","Masakazu Sato; Keita Matsumoto; Yutaka Kawashima; Kazuyuki Tomisawa","Methyl Ester of the Bioactive Metabolite of Thromboxane A2 Receptor Antagonist ON-579","Acta Crystallographica Section C","1998","54","7","982","984","10.1107/S0108270198000158","","","1.5418","CuKα","","","0.052","","","0.048","","","","","3.267","3.267","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007423","6.87","0.002","20.711","0.002","8.526","0.001","90","","100.69","0.01","90","","1192.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(±)-6,6'-Anhydro-2'-deoxy-6,6'b-dihydroxycarbacytidine","(±)-6,6'-Anhydro-2'-deoxy-6,6'b-dihydroxycarbacytidine","","- C10 H15 N3 O5 -","- C10 H15 N3 O5 -","- C40 H60 N12 O20 -","4","1","DE1077","Ohishi, Hirofumi; Urata, Hidehito; Akagi, Masao; Tomita, Ken-ichi","A (±)-Cyclocytidine Analogue with a Low-<i>anti</i> Conformation around the Glycosyl Bond","Acta Crystallographica Section C","1998","54","7","980","982","10.1107/S010827019800016X","","","1.5418","CuKα","","0.069","0.052","","0.143","0.134","","","","2.098","2.259","2.259","","","","","has coordinates,has disorder","194474","2020-10-21","18:00:00",""
"2007424","16.603","0.005","6.743","0.001","12.136","0.005","90","","130.77","0.02","90","","1029","0.6","291","2","291","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C11 H18 N2 -","- C11 H18 N2 -","- C44 H72 N8 -","4","1","FG1368","Jordan, Richard F.; Black, David G.; Swenson, Dale C.","(5a<i>R</i>,9a<i>R</i>)-2,4-Dimethyl-5a,6,7,8,9,9a-hexahydro-1<i>H</i>-1,5-benzodiazepine","Acta Crystallographica Section C","1998","54","7","1030","1033","10.1107/S0108270198001279","","","0.7107","MoKα","","0.0577","0.0439","","0.1092","0.103","","","","1.041","1.082","1.082","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007425","8.57","0.002","12.4127","0.0015","14.549","0.002","90","","106.502","0.015","90","","1483.9","0.5","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","sp-(R)-9-(o-t-Butylphenyl)-9-fluorenol-2-N- [(S)-α-methylbenzyl]carboamide^.^Acetone","","- C35 H37 N O3 -","- C35 H37 N O3 -","- C70 H74 N2 O6 -","2","1","FG1426","Hou, Yuqing; Meyers, Cal Y.; Robinson, Paul D.","<i>sp</i>-(<i>R</i>)-9-(<i>o</i>-<i>tert</i>-Butylphenyl)-9-hydroxy-<i>N</i>-[(<i>S</i>)-α-methylbenzyl]fluorene-2-carboxamide‒Acetone: a Novel 1:1 Cavitate","Acta Crystallographica Section C","1998","54","7","1013","1016","10.1107/S0108270198001280","","","0.71069","MoKα","","0.1349","0.0381","","0.1256","","0.0922","","","1.012","1.145","1.145","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007426","9.5604","0.0015","18.2218","0.0017","12.782","0.003","90","","107.536","0.017","90","","2123.2","0.7","293","1","293","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Doxylamine tetrachlorozincate(II)","","","- C17 H24 Cl4 N2 O Zn -","- C17 H24 Cl4 N2 O Zn -","- C68 H96 Cl16 N8 O4 Zn4 -","4","1","FG1429","Parvez, Masood; Sabir, Aaliya P.","Doxylaminium Tetrachlorozincate(II) and Doxylaminium Tetrachlorocobaltate(II)","Acta Crystallographica Section C","1998","54","7","933","935","10.1107/S0108270198001292","","","1.54178","CuKα","","0.0654","0.0429","","","","0.1099","","","","","","1.001","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007427","9.5279","0.0012","18.229","0.003","12.7795","0.0013","90","","107.313","0.009","90","","2119","0.5","170","1","170","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Doxylamine tetrachlorocobaltate(II)","","","- C17 H24 Cl4 Co N2 O -","- C17 H24 Cl4 Co N2 O -","- C68 H96 Cl16 Co4 N8 O4 -","4","1","FG1429","Parvez, Masood; Sabir, Aaliya P.","Doxylaminium Tetrachlorozincate(II) and Doxylaminium Tetrachlorocobaltate(II)","Acta Crystallographica Section C","1998","54","7","933","935","10.1107/S0108270198001292","","","0.71069","MoKα","","0.215","0.0484","","","","0.1673","","","","","","0.953","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007428","9.8769","0.0001","9.8769","0.0001","35.3642","0.0002","90","","90","","90","","3449.89","0.05","223","2","223","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C20 H18 N3 O -","- C20 H18 N3 O -","- C160 H144 N24 O8 -","8","1","FR1077","George, Mathew; Das, Suresh; Ashokan, C. V.; Rath, Nigam P.; George, M. V.","2-Phenyl-3-(5,6,7,7a-tetrahydro-1<i>H</i>,3<i>H</i>-pyrrolo[1,2-<i>c</i>]oxazol-3-ylidene)-1-propene-1,1-dicarbonitrile and 4-(4-Methoxyphenyl)-2,6-bis(methylthio)pyridine-3-carbonitrile","Acta Crystallographica Section C","1998","54","7","1033","1036","10.1107/S0108270197018398","","","0.71073","MoKα","","0.0784","0.0504","","0.1175","0.103","","","","1.043","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007429","10.598","0.002","7.5746","0.001","19.053","0.004","90","","103.026","0.011","90","","1490.1","0.5","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 N2 O S2 -","- C15 H14 N2 O S2 -","- C60 H56 N8 O4 S8 -","4","1","FR1077","George, Mathew; Das, Suresh; Ashokan, C. V.; Rath, Nigam P.; George, M. V.","2-Phenyl-3-(5,6,7,7a-tetrahydro-1<i>H</i>,3<i>H</i>-pyrrolo[1,2-<i>c</i>]oxazol-3-ylidene)-1-propene-1,1-dicarbonitrile and 4-(4-Methoxyphenyl)-2,6-bis(methylthio)pyridine-3-carbonitrile","Acta Crystallographica Section C","1998","54","7","1033","1036","10.1107/S0108270197018398","","","0.71073","MoKα","","0.0981","0.0495","","0.1136","0.0944","","","","1.015","1.112","1.112","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007430","7.425","0.002","9.568","0.003","14.035","0.004","90","","97.13","0.02","90","0.02","989.4","0.5","163","1","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,4-Dimethyltetrathiafulvalene","","- C8 H8 S4 -","- C8 H8 S4 -","- C32 H32 S16 -","4","1","FR1086","Uzelmeier, Calvin E.; Fourmigué, Marc; Dunbar, Kim R.","3,4-Dimethyltetrathiafulvalene","Acta Crystallographica Section C","1998","54","7","1047","1049","10.1107/S0108270198000894","","","0.71073","MoKα","","","0.035","","","","0.093","","","1.068","1.123","1.123","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007431","11.1046","0.0005","15.0729","0.0008","14.2998","0.0007","90","","100.205","0.001","90","","2355.6","0.2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H26 F24 N2 Ni2 O10 S2 -","- C38 H26 F24 N2 Ni2 O10 S2 -","- C76 H52 F48 N4 Ni4 O20 S4 -","2","0.5","FR1094","Dickman, Michael H.; Ward, Jeffrey P.; Villamena, Frederick A.; Crist, DeLanson R.","Bis(μ-{<i>N</i>-[(methylthio)phenylmethylene]methanamine <i>N</i>-oxide}-<i>O</i>:<i>O</i>)bis[bis(1,1,1,5,5,5,-hexafluoropentane-2,4-dionato-<i>O</i>, 4-dionato-<i>O</i>,<i>O</i>')nickel(II)]","Acta Crystallographica Section C","1998","54","7","929","930","10.1107/S0108270198000730","","","0.71073","MoKα","","0.041","0.031","","0.076","0.071","","","","1.03","1.055","1.055","","","","","has coordinates","197922","2020-10-21","18:00:00",""
"2007432","24.823","0.004","18.17","0.002","11.429","0.002","90","","110.61","0.01","90","","4824.9","1.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(quinoline)-1κN;2κN-di-(-bromine-1:2κ^4^Br- bis(triphenylphosphine)-1κP;2κP-di-copper(1)","","- C54 H44 Br2 Cu2 N2 P2 -","- C54 H44 Br2 Cu2 N2 P2 -","- C216 H176 Br8 Cu8 N8 P8 -","4","0.5","FR1096","Jin, Qiong-Hua; Long, De-Liang; Wang, Yu-Xian; Xin, Xin-Quan","Di-μ-bromo-1:2κ^4^<i>Br</i>-bis(quinoline)-1κ<i>N</i>,2κ<i>N</i>-bis(triphenylphosphine)-1κ<i>P</i>,2κ<i>P</i>-dicopper(I)","Acta Crystallographica Section C","1998","54","7","948","949","10.1107/S0108270198000997","","","0.71073","MoKα","","","0.036","","","0.072","","","","","1.051","1.051","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007433","7.863","0.003","8.171","0.002","13.415","0.003","78.11","0.02","74.4","0.03","85.12","0.03","811.9","0.4","294","","294","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H34 Mo2 O8 Si2 -","- C26 H34 Mo2 O8 Si2 -","- C26 H34 Mo2 O8 Si2 -","1","0.5","FR1100","Katharine J. Covert; Jonathan L. Male; David R. Tyler; Timothy J. R. Weakley","Hexacarbonyl-1κ^3^<i>C</i>,2κ^3^<i>C</i>-bis{1,2(η^5^)-1-[2-(trimethylsiloxy)ethyl]cyclopentadienyl}dimolybdenum(<i>Mo</i>—<i>Mo</i>)","Acta Crystallographica Section C","1998","54","7","943","945","10.1107/S0108270198000742","","","0.71073","MoKα","","","0.031","","","0.033","","","","","1.48","1.48","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007434","4.615","0.001","7.519","0.001","24.97","0.001","90","","90.65","0.02","90","","866.3","0.3","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","8-aminocaprylic acid","","","- C8 H17 N O2 -","- C8 H17 N O2 -","- C32 H68 N4 O8 -","4","1","","Dobson, Allison J.; Gerkin, Roger E.","8-Aminocaprylic Acid","Acta Crystallographica Section C","1998","54","7","969","972","10.1107/S0108270198001309","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2007435","17.964","0.002","8.716","0.001","8.172","0.001","90","","90","","90","","1279.5","0.3","296","","296","","","","","","","","","4","P b c a","-P 2ac 2ab","61","DL-3-aminoisobutyric acid monohydrate","","","- C4 H11 N O3 -","- C4 H11 N O3 -","- C32 H88 N8 O24 -","8","1","FR1106","Dobson, Allison J.; Gerkin, Roger E.","<small>DL</small>-3-Aminoisobutyric Acid Monohydrate","Acta Crystallographica Section C","1998","54","7","972","974","10.1107/S0108270198001310","","","0.71073","MoKα","","","0.04","","","","0.056","","","","","","1.87","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007436","3.7582","0.0004","14.5505","0.0015","6.2451","0.0006","90","","101.162","0.008","90","","335.05","0.06","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,5-diamino-dichloropyrazine","","- C4 H4 Cl2 N4 -","- C4 H4 Cl2 N4 -","- C8 H8 Cl4 N8 -","2","0.5","FR1107","Barclay, Tosha M.; Cordes, A. Wallace; Oakley, Richard T.; Preuss, Kathryn E.; Zhang, Hongzhou","2,5-Diamino-3,6-dichloropyrazine","Acta Crystallographica Section C","1998","54","7","1018","1019","10.1107/S0108270198001152","","","0.7107","MolybdenumKα","","0.033","0.033","","0.063","0.063","","","","","1.08","1.08","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007437","9.542","0.005","10.327","0.006","11.857","0.009","114.41","0.05","90.7","0.05","96.61","0.05","1054.6","1.2","296","1","296","1","","","","","","","","4","P -1","-P 1","2","","4-Benzoyl-6-(4-methoxybenzylidene)-3-phenyl-2-oxa-3-azabicyclo[3.3.0]oct-7-ene","","- C27 H23 N O3 -","- C27 H23 N O3 -","- C54 H46 N2 O6 -","2","1","GS1001","Kubicki, Marek M.; Blacque, Olivier; Djapa, Francis; Ciamala, Kabula; Vebrel, Joël","4-Benzoyl-6-(4-methoxybenzylidene)-3-phenyl-2-oxa-3-azabicyclo[3.3.0]oct-7-ene","Acta Crystallographica Section C","1998","54","7","1027","1028","10.1107/S0108270198001930","","","0.71073","MoKα","","0.165","0.048","","","","0.125","","","","","","0.994","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007438","7.3367","0.0007","7.7985","0.0008","8.396","0.0009","69.989","0.001","64.152","0.001","89.997","0.002","399.85","0.07","157","","157","","","","","","","","","4","P -1","-P 1","2","","3,4-Dimethylpyridinehydrobromide","","- C7 H10 Br N -","- C7 H10 Br N -","- C14 H20 Br2 N2 -","2","1","HA1209","Bolte, Michael; Kettner, Markus","The Twinned Crystal Structure of 3,4-Dimethylpyridine Hydrobromide at 157K","Acta Crystallographica Section C","1998","54","7","963","964","10.1107/S0108270198001164","","","0.71073","MoKα","","0.0718","0.0617","","0.1324","0.1274","0.1324","","","1.08","","","1.08","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007439","4.741","0.0009","15.293","0.005","19.61","0.005","90","","90","","90","","1421.8","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H11 Cl2 N O -","- C17 H11 Cl2 N O -","- C68 H44 Cl8 N4 O4 -","4","1","HA1210","Elmali, Ayhan; Elerman, Yalc̨in; Svoboda, Ingrid; Fuess, Hartmut","<i>N</i>-(3,5-Dichlorophenyl)naphthaldimine","Acta Crystallographica Section C","1998","54","7","974","976","10.1107/S0108270198001176","","","0.71093","MoKα","","0.0496","0.0358","","0.1034","0.0954","","","","1.077","1.084","1.084","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007440","9.9807","0.0007","7.5585","0.0006","17.0244","0.0012","90","","90.196","0.007","90","","1284.3","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-anilinyl-4-toluenesulfonate","","- C13 H13 N O3 S -","- C13 H13 N O3 S -","- C52 H52 N4 O12 S4 -","4","1","HA1211","Shyamaprosad Goswami; Ajit Kumar Mahapatra; Gur Dayal Nigam; Kandasamy Chinnakali; Ibrahim Abdul Razak; Hoong-Kun Fun","<i>m</i>-(<i>p</i>-Tolylsulfonyloxy)aniline","Acta Crystallographica Section C","1998","54","7","954","955","10.1107/S0108270198001425","","","0.71073","MoKα","","0.067","0.039","","0.107","0.097","","","","0.901","1.056","1.056","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007441","10.7523","0.0006","11.0208","0.0007","14.0493","0.0009","90","","90","","90","","1664.83","0.18","293","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1R,3S)-1-Trichloromethyl-1,2,3,4-tetrahydro-β-carboline-3-carboxamide methanol solvate","","- C14 H16 Cl3 N3 O2 -","- C14 H16 Cl3 N3 O2 -","- C56 H64 Cl12 N12 O8 -","4","1","JZ1190","Peters, Karl; Peters, Eva-Maria; Blank, Michael; Protzen, Jens-Achim; Feineis, Doris; God, Ralf; Bringmann, Gerhard","Endogenous Alkaloids in Man. 28. (1<i>R</i>,3<i>S</i>)-1-Trichloromethyl-1,2,3,4-tetrahydro-β-carboline-3-carboxamide Methanol Solvate, a Potential Synthetic Precursor to Enantiomerically Pure TaClo","Acta Crystallographica Section C","1998","54","7","1005","1007","10.1107/S0108270198001437","","","0.71073","MoKα","","","0.045","","","","0.115","","","","","","1.058","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007443","5.838","0.001","7.231","0.001","20.548","0.001","90","","90","","90","","867.4","0.2","223","2","223","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","9-Methyl-8,11,12-trioxatricyclo[7.2.1.0^2,7^]dodeca-2,4,6-trien-10-one","","- C10 H8 O4 -","- C10 H8 O4 -","- C40 H32 O16 -","4","1","JZ1270","Eilers, Frank; Bach, Thorsten; Fröhlich, Roland","9-Methyl-8,11,12-trioxatricyclo[7.2.1.0^2,7^]dodeca-2,4,6-trien-10-one","Acta Crystallographica Section C","1998","54","7","1011","1013","10.1107/S0108270198001528","","","1.54178","CuKα","","0.031","0.031","","0.09","0.09","","","","1.132","1.139","1.139","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007444","9.4468","0.0009","10.7321","0.0008","10.9452","0.0009","91.601","0.008","93.036","0.009","92.609","0.009","1106.45","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(3,5-dimethylpyrazole-N)(N-salicylidene-α-amino-2-methylpropanoato-O,N,O')- copper(II)","","- C21 H27 Cu N5 O3 -","- C21 H27 Cu N5 O3 -","- C42 H54 Cu2 N10 O6 -","2","1","JZ1275","Warda, Salam A.","Bis(3,5-dimethylpyrazole-<i>N</i>^2^)(2,2-dimethyl-<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1998","54","7","916","918","10.1107/S0108270198001942","","","0.71073","MoKα","","0.064","0.034","","","","0.059","","","","","","0.995","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007445","12.533","0.003","12.649","0.003","25.319","0.005","84.79","0.03","80.74","0.03","83.84","0.03","3927.6","1.6","150","2","150","2","","","","","","","","3","P -1","-P 1","2","Tetraundecylpentacyclooctacosadodecaeneoctol","2,8,14,20-Tetraundecylpentacyclo[19.3.1.1^3,7^.1^9,13^.1^15,19^] octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene -4,6,10,12,16,18,22,24-octol","","- C80 H136 O12 -","- C80 H136 O12 -","- C160 H272 O24 -","2","1","KA1222","Hibbs, David E.; Hursthouse, Michael B.; Malik, K. M. Abdul; Adams, Harry; Stirling, Charles J. M.; Davis, Frank","Tetraundecylpentacyclooctacosadodecaenoctol Tetraethanol Solvate, (I), and Tetraundecylpentacyclooctacosadodecaenedodecol Hydrate 2.5-Ethanol Solvate, (II)","Acta Crystallographica Section C","1998","54","7","987","992","10.1107/S0108270197019689","","","0.71069","MoKα","","0.144","0.074","","0.196","0.175","","","","0.783","1.157","1.157","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007446","11.9971","0.0014","12.7","0.002","25.742","0.004","80.06","0.02","84.22","0.02","82.372","0.009","3816.9","1","150","2","150","2","","","","","","","","3","P -1","-P 1","2","Tetraundecylpentacyclooctacosadodecaenedodecol","2,8,14,20-Tetraundecylpentacyclo[19.3.1.1^3,7^.1^9,13^.1^15,19^] octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene- 4,5,6,10,11,12,16,17,18,22,23,24-dodecol","","- C77 H129 O15.5 -","- C77 H123 O15.5 -","- C154 H246 O31 -","2","1","KA1222","Hibbs, David E.; Hursthouse, Michael B.; Malik, K. M. Abdul; Adams, Harry; Stirling, Charles J. M.; Davis, Frank","Tetraundecylpentacyclooctacosadodecaenoctol Tetraethanol Solvate, (I), and Tetraundecylpentacyclooctacosadodecaenedodecol Hydrate 2.5-Ethanol Solvate, (II)","Acta Crystallographica Section C","1998","54","7","987","992","10.1107/S0108270197019689","","","0.71069","MoKα","","0.15","0.084","","0.241","0.223","","","","0.882","1.339","1.339","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007447","8.387","0.001","12.511","0.002","11.806","0.003","90","","96.11","0.02","90","","1231.8","0.4","298","","298","","","","","","","","","5","P 1 21 1","P 2yb","4","dichloro(1,4,7-trithiacyclodecane)platinum","","","- C7 H14 Cl2 Pt S3 -","- C7.5 H17 Cl2 Pt S3.5 -","- C30 H68 Cl8 Pt4 S14 -","4","2","KA1253","Lee, Gene-Hsiang","Platinum Complexes of 1,4,7-Trithiacyclodecane","Acta Crystallographica Section C","1998","54","7","906","909","10.1107/S0108270197014509","","","0.71073","MoKα","","0.069","0.041","","0.042","0.041","","","","","1.76","1.76","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007448","17.998","0.004","11.627","0.002","13.69","0.003","90","","96.75","0.02","90","","2844.9","1","298","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","bis(1,4,7,-trithiacyclodecane)platinum dichloride heptahydrate","","","- C14 H42 Cl2 O7 Pt S6 -","- C14 H44 Cl O6 Oc2 Pt S6 -","- C56 H176 Cl4 O24 Oc8 Pt4 S24 -","4","0.5","KA1253","Lee, Gene-Hsiang","Platinum Complexes of 1,4,7-Trithiacyclodecane","Acta Crystallographica Section C","1998","54","7","906","909","10.1107/S0108270197014509","","","0.71073","MoKα","","0.042","0.029","","0.045","0.044","","","","","2.49","2.49","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007449","21.595","0.013","12.323","0.007","9.266","0.006","90","","98.9","0.05","90","","2436","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","1-(2-Benzothiazolyl)-3,3,3-trichloro-2-propanol","","- C10 H8 Cl3 N O S -","- C10 H8 Cl3 N O S -","- C80 H64 Cl24 N8 O8 S8 -","8","1","KA1264","Viktor Vrábel; Július Sivý; Drahomír Oktavec; Alexander Bartovič","1-(1,3-Benzothiazol-2-yl)-3,3,3-trichloro-2-propanol","Acta Crystallographica Section C","1998","54","7","984","985","10.1107/S0108270198001589","","","0.71069","MoKα","","0.12","0.039","","0.078","0.07","","","","0.851","1.149","1.149","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007450","11.834","0.002","8.841","0.002","12.889","0.002","90","","93.41","0.02","90","","1346.1","0.4","158","2","158","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Methylphenylammonium hydrogen dipicolinate","Methylphenylammonium hydrogen 2,6-pyridinecarboxylate","","- C14 H14 N2 O4 -","- C14 H14 N2 O4 -","- C56 H56 N8 O16 -","4","1","KA1269","Ng, Seik Weng; Turnbull, Mark M.","Methylphenylammonium Hydrogen 2,6-Pyridinedicarboxylate at 158K","Acta Crystallographica Section C","1998","54","7","1025","1027","10.1107/S0108270198001590","","","0.71073","MoKα","","0.103","0.042","","0.071","0.068","","","","0.737","0.955","0.955","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007451","5.96","0.003","8.312","0.005","32.8","0.03","90","","90","","90","","1625","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N, N'-methylene-bis(5-phenyl-oxazolidine)","","- C19 H22 N2 O2 -","- C19 H22 N2 O2 -","- C76 H88 N8 O8 -","4","1","LN1028","Lemoine, Pascale; Viossat, Bernard; Martin, Pierre-Guy; Aitken, David J.","<i>N</i>,<i>N</i>'-Methylenebis[(<i>S</i>)-5-phenyloxazolidine]","Acta Crystallographica Section C","1998","54","7","1036","1038","10.1107/S010827019701562X","","","0.71069","MoKα","","0.145","0.058","","0.2","0.094","","","","1.078","1.144","1.144","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007452","10.51","0.003","10.288","0.004","10.227","0.003","90","","117.6","0.02","90","","980","0.6","294","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H12 N2 O10 S2 -","- C18 H12 N2 O10 S2 -","- C36 H24 N4 O20 S4 -","2","0.5","LN1048","Bertault, Marcel; Even, Jacky; Toupet, Loic","Monomeric pNBS: Bis(<i>p</i>-nitrobenzenesulfonate) of 2,4-Hexadiyne","Acta Crystallographica Section C","1998","54","7","1028","1030","10.1107/S0108270198000754","","","0.71073","MoKα","","0.0998","0.034","","0.0954","0.077","","","","1.001","1.066","1.066","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007453","11.822","0.004","14.812","0.005","22.612","0.003","73.57","0.02","75.4","0.02","67.38","0.03","3459.5","1.9","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","bis(p-methoxyphenyl)tellurium(IV) diiodide","","- C14 H14 I2 O2 Te -","- C14.5 H12.5 I2 O2.5 Te -","- C116 H100 I16 O20 Te8 -","8","4","MU1363","Joan Farran; Angel Alvarez-Larena; Mario V. Capparelli; Joan F. Piniella; Gabriel Germain; Libardo Torres-Castellanos","Two Polymorphs of Bis(4-methoxyphenyl)tellurium(IV) Diiodide","Acta Crystallographica Section C","1998","54","7","995","1000","10.1107/S0108270197016387","","","0.71069","MoKα","","0.049","0.0365","","0.0942","0.0919","","","","1.066","1.172","1.172","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007454","10.334","0.001","13.091","0.001","14.588","0.001","110.237","0.007","100.875","0.006","100.272","0.008","1753.7","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","bis(p-methoxyphenyl)tellurium(IV) diiodide","","- C14 H14 I2 O2 Te -","- C14 H14 I2 O2 Te -","- C56 H56 I8 O8 Te4 -","4","2","MU1363","Joan Farran; Angel Alvarez-Larena; Mario V. Capparelli; Joan F. Piniella; Gabriel Germain; Libardo Torres-Castellanos","Two Polymorphs of Bis(4-methoxyphenyl)tellurium(IV) Diiodide","Acta Crystallographica Section C","1998","54","7","995","1000","10.1107/S0108270197016387","","","0.71069","MoKα","","0.049","0.0277","","0.0725","0.0706","","","","1.013","1.198","1.198","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007455","7.049","0.002","7.492","0.004","15.077","0.006","91.57","0.04","92.83","0.03","99.74","0.03","783.3","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2'-[1-(4-Fluorophenyl)ethyl]isonicotino-κN-hydrazide‒Cyanoborane","","- C15 H16 B F N4 O -","- C15 H16 B F N4 O -","- C30 H32 B2 F2 N8 O2 -","2","1","NA1320","Bruno, Giuseppe; Maccari, Rosanna; Nicoló, Francesco; Ottaná, Rosaria; Panzalorto, Manuela; Scopelliti, Rosario; Vigorita, Maria Gabriella","2'-[1-(4-Fluorophenyl)ethyl]isonicotino-κ<i>N</i>-hydrazide‒Cyanoborane","Acta Crystallographica Section C","1998","54","7","1038","1040","10.1107/S0108270198001681","","","0.71073","MoKα","","0.152","0.063","","0.187","0.152","","","","0.82","1.193","1.193","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007456","13.24","0.005","13.24","0.005","7.157","0.005","90","0.005","90","0.005","120","0.005","1086.5","1","173","2","173","2","","","","","","","","4","P 32","P 32","145","","(3R,4S)-N-Benzyl-4,5-dihydroxy-3-(hydroxyamino)-4,5-O-isopropylidene-1-pentyne","","- C15 H19 N O3 -","- C15 H19 N O3 -","- C45 H57 N3 O9 -","3","1","NA1331","Merino, Pedro; Merchan, Francisco L.; Tejero, Tomas; Franco, Santiago","Structures of Chiral Hydroxylamines. VI. (3<i>R</i>,4<i>S</i>)-<i>N</i>-Benzyl-4,5-dihydroxy-3-(hydroxyamino)-4,5-<i>O</i>-isopropylidene-1-pentyne","Acta Crystallographica Section C","1998","54","7","1003","1004","10.1107/S010827019800153X","","","0.71069","MoKα","","0.05","0.041","","0.108","","0.102","","","1.062","","","1.093","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007457","17.435","0.001","10.926","0.001","9.089","0.002","90","","93.01","0.01","90","","1729","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,6-Dimethyl-2-(4-phenylpiperazin-1-ylmethyl)isothiazolo[5,4-b]pyridin-3-(2H)- one","","- C19 H22 N4 O S -","- C19 H22 N4 O S -","- C76 H88 N16 O4 S4 -","4","1","NA1333","Karczmarzyk, Zbigniew; Malinka, Wiesław","4,6-Dimethyl-2-(4-phenylpiperazin-1-ylmethyl)isothiazolo[5,4-<i>b</i>]pyridin-3(2<i>H</i>)-one","Acta Crystallographica Section C","1998","54","7","992","994","10.1107/S0108270198001474","","","1.54178","CuKα","","0.057","0.041","","0.129","0.119","","","","1.085","1.148","1.148","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007458","8.664","0.001","10.64","0.002","8.822","0.001","90","","108.38","0.01","90","","771.8","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","cis,anti-7-phenyl-7a,8,9,10a-tetrahydro-6H,7H-furo[3',2':5,6]pyrano[3,2-c][1] benzopyran-6-one","","- C20 H16 O4 -","- C20 H16 O4 -","- C40 H32 O8 -","2","1","NA1342","Casalone, Gianluigi; Pilati, Tullio; Binello, Arianna","Five 3,4-Dihydro-2<i>H</i>,5<i>H</i>-pyrano[3,2-<i>c</i>][1]benzopyran-5-one Derivatives","Acta Crystallographica Section C","1998","54","7","1042","1047","10.1107/S0108270198000249","","","0.71073","MoKα","","0.074","0.041","","0.088","0.074","","","","1.114","1.15","1.15","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007459","11.987","0.002","10.028","0.002","13.413","0.002","90","","107.551","0.008","90","","1537.3","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","cis-3,4-dihydro-2-ethoxy-4-[2-furyl]-2H,5H-pyrano[3,2-c][1]benzopyran-5-one","","- C18 H16 O5 -","- C18 H16 O5 -","- C72 H64 O20 -","4","1","NA1342","Casalone, Gianluigi; Pilati, Tullio; Binello, Arianna","Five 3,4-Dihydro-2<i>H</i>,5<i>H</i>-pyrano[3,2-<i>c</i>][1]benzopyran-5-one Derivatives","Acta Crystallographica Section C","1998","54","7","1042","1047","10.1107/S0108270198000249","","","0.71073","MoKα","","0.057","0.036","","0.101","0.094","","","","0.962","1.103","1.103","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007460","11.682","0.001","11.101","0.001","12.61","0.001","90","","93.66","0.01","90","","1632","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","cis-3,4-dihydro-2-ethoxy-4-phenyl-2H,5H-pyrano[3,2-c][1]benzopyran-5-one","","- C20 H18 O4 -","- C20 H18 O4 -","- C80 H72 O16 -","4","1","NA1342","Casalone, Gianluigi; Pilati, Tullio; Binello, Arianna","Five 3,4-Dihydro-2<i>H</i>,5<i>H</i>-pyrano[3,2-<i>c</i>][1]benzopyran-5-one Derivatives","Acta Crystallographica Section C","1998","54","7","1042","1047","10.1107/S0108270198000249","","","0.71073","MoKα","","0.069","0.037","","0.096","0.087","","","","0.922","1.103","1.103","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007461","8.276","0.001","15.024","0.001","14.448","0.001","90","","98.68","0.01","90","","1775.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cis-3,4-dihydro-2-ethoxy-4-(2-nitrophenyl)-2H,5H-pyrano[3,2-c][1]benzopyran-5- one","","- C20 H17 N O6 -","- C20 H17 N O6 -","- C80 H68 N4 O24 -","4","1","NA1342","Casalone, Gianluigi; Pilati, Tullio; Binello, Arianna","Five 3,4-Dihydro-2<i>H</i>,5<i>H</i>-pyrano[3,2-<i>c</i>][1]benzopyran-5-one Derivatives","Acta Crystallographica Section C","1998","54","7","1042","1047","10.1107/S0108270198000249","","","0.71073","MoKα","","0.067","0.033","","0.079","0.071","","","","0.851","1.026","1.026","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007462","10.392","0.001","17.192","0.001","11.193","0.001","90","","107.394","0.006","90","","1908.3","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,4-dihydro-2-ethoxy-4-methoxycarbonyl-4-phenyl-2H,5H-pyrano[3,2-c][1]benzo pyran-5-one","","- C22 H20 O6 -","- C22 H20 O6 -","- C88 H80 O24 -","4","1","NA1342","Casalone, Gianluigi; Pilati, Tullio; Binello, Arianna","Five 3,4-Dihydro-2<i>H</i>,5<i>H</i>-pyrano[3,2-<i>c</i>][1]benzopyran-5-one Derivatives","Acta Crystallographica Section C","1998","54","7","1042","1047","10.1107/S0108270198000249","","","0.71073","MoKα","","0.072","0.04","","0.1","0.088","","","","1.014","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007463","12.5841","0.0008","12.5841","0.0008","18.993","0.002","90","","90","","120","","2604.8","0.4","203","2","203","2","","","","","","","","3","R -3 :H","-R 3","148","","Tris(selenophenyl)methane","","- C19 H16 Se3 -","- C19 H16 Se3 -","- C114 H96 Se18 -","6","0.333333","NA1344","Schulz Lang, Ernesto; Pradella Ziani, Juliana; Abram, Ulrich","Tris(phenylseleno)methane","Acta Crystallographica Section C","1998","54","7","1010","1011","10.1107/S0108270198001085","","","0.71073","MoKα","","0.048","0.029","","","","0.067","","","","","","1.073","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007464","23.63","0.006","10.985","0.001","9.779","0.003","90","","91.06","0.01","90","","2538","1","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","Co(DH)~2~(4-^t^Bu-Py)(PhS)","Bis(dimethylglyoximato)(benzenethiolato)(4-tert- butylpyridine)Cobalt(III)","","- C23 H32 Co N5 O4 S -","- C23 H32 Co N5 O4 S -","- C92 H128 Co4 N20 O16 S4 -","4","1","OA1029","Inouye, Yoshinobu; Kambe, Tohru; Tada, Masaru","(Benzenethiolato-<i>S</i>)(4-<i>tert</i>-butylpyridine-<i>N</i>)bis(dimethylglyoximato-<i>N</i>,<i>N</i>')cobalt(III) and (4-<i>tert</i>-Butylpyridine-<i>N</i>)bis(dimethylglyoximato-<i>N</i>,<i>N</i>')(4-methoxybenzenethiolato-<i>S</i>)cobalt(III)","Acta Crystallographica Section C","1998","54","7","945","947","10.1107/S0108270198001693","","","0.71073","MoKα","","0.054","0.034","","0.09","0.084","","","","1.076","1.1","1.1","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007465","12.898","0.001","18.482","0.002","11.412","0.001","90","","90","","90","","2720.4","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Co(DH)~2~(4-^t^Bu-Py)(4-MeO-PhS)","Bis(dimethylglyoximato)(4-methoxybenzenethiolato)(4-tert- butylpyridine)Cobalt(III)","","- C24 H34 Co N5 O5 S -","- C24 H34 Co N5 O5 S -","- C96 H136 Co4 N20 O20 S4 -","4","1","OA1029","Inouye, Yoshinobu; Kambe, Tohru; Tada, Masaru","(Benzenethiolato-<i>S</i>)(4-<i>tert</i>-butylpyridine-<i>N</i>)bis(dimethylglyoximato-<i>N</i>,<i>N</i>')cobalt(III) and (4-<i>tert</i>-Butylpyridine-<i>N</i>)bis(dimethylglyoximato-<i>N</i>,<i>N</i>')(4-methoxybenzenethiolato-<i>S</i>)cobalt(III)","Acta Crystallographica Section C","1998","54","7","945","947","10.1107/S0108270198001693","","","0.71073","MoKα","","0.06","0.035","","0.09","0.099","","","","1.028","1.021","1.021","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007466","13.367","0.003","10.019","0.002","15.554","0.002","90","","109.56","0.01","90","","1962.8","0.7","296","","296","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","2,2-diphenyl-1,3,6,9,12-pentaoxacyclotetradecane","","- C21 H26 O5 -","- C21 H26 O5 -","- C84 H104 O20 -","4","1","OA1043","Hatsue Tamura; Shinya Ueno; Kazuhide Ogawa; Toshikazu Nagai; Takumi Oshima","Benzophenone Crown Ether Acetals with 14- and 17-Membered Rings","Acta Crystallographica Section C","1998","54","7","1049","1052","10.1107/S010827019800170X","","","0.7107","MoKα","","","0.05","","","0.057","","","","","1.71","1.71","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007467","13.948","0.002","11.703","0.002","14.725","0.002","90","","116.753","0.008","90","","2146.3","0.6","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,2-diphenyl-1,3,6,9,12,15-hexaoxacycloheptadecane","","- C23 H30 O6 -","- C23 H28.494 O6 -","- C92 H113.976 O24 -","4","1","OA1043","Hatsue Tamura; Shinya Ueno; Kazuhide Ogawa; Toshikazu Nagai; Takumi Oshima","Benzophenone Crown Ether Acetals with 14- and 17-Membered Rings","Acta Crystallographica Section C","1998","54","7","1049","1052","10.1107/S010827019800170X","","","0.7107","MoKα","","0.17","0.051","","0.199","0.141","","","","1.01","1.16","1.16","","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007468","21.97","0.04","6.155","0.003","19.98","0.04","90","","122.08","0.09","90","","2289","7","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- I4 O Ta4 Te9 -","- I4 O Ta4 Te9 -","- I16 O4 Ta16 Te36 -","4","0.5","OH1092","Huang, Da-Ping; Huang, Chang-Cang; Liu, Shi-Xiong; Xu, Huai-Da; Huang, Jin-Ling","An Oxygen-Centred Tetranuclear Tantalum Cluster: Ta~4~O(Te~2~)~4~TeI~4~","Acta Crystallographica Section C","1998","54","7","893","895","10.1107/S0108270197018593","","","0.71069","MoKα","","","0.033","","","0.043","","","","","1.072","1.072","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007469","7.712","0.002","26.454","0.008","6.777","0.002","91.06","0.02","102.02","0.02","94.69","0.02","1346.9","0.7","296","","","","","","","","","","","3","P -1","-P 1","2","","","","- I10 Ta7 Te24 -","- I10 Ta7 Te24 -","- I10 Ta7 Te24 -","1","0.5","OH1093","Huang, Jin-Ling; Huang, Da-Ping; Liu, Shi-Xiong; Huang, Chang-Cang; Xu, Huai-Da","A New One-Dimensional Compound: (TaTe~4~)~6~I~4~(TaI~6~)","Acta Crystallographica Section C","1998","54","7","895","897","10.1107/S010827019701860X","","","0.71069","MoKα","","","0.0318","","","0.0554","","","","","1.44","1.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007470","7.7068","0.0011","10.1645","0.0012","9.691","0.002","90","","90","","90","","759.2","0.2","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C7 H12 O4 -","- C7 H12 O4 -","- C28 H48 O16 -","4","0.5","OS1000","Bromley, Mark K.; Looney, Mark G.; Solomon, David H.; Gable, Robert W.; Helliwell, Madeleine; Hodge, Philip","1,5,7,11-Tetraoxaspiro[5.5]undecane, 3,9-Dimethylidene-1,5,7,11-tetraoxaspiro[5.5]undecane and 1,5-Dioxa-7,11-dithiaspiro[5.5]undecane","Acta Crystallographica Section C","1998","54","7","1019","1023","10.1107/S0108270198000274","","","0.71069","MoKα","","0.048","0.035","","0.088","0.079","","","","1.147","1.193","1.193","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007471","10.175","0.002","9.6082","0.0014","9.577","0.002","90","","90","","90","","936.3","0.3","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C9 H12 O4 -","- C9 H12 O4 -","- C36 H48 O16 -","4","0.5","OS1000","Bromley, Mark K.; Looney, Mark G.; Solomon, David H.; Gable, Robert W.; Helliwell, Madeleine; Hodge, Philip","1,5,7,11-Tetraoxaspiro[5.5]undecane, 3,9-Dimethylidene-1,5,7,11-tetraoxaspiro[5.5]undecane and 1,5-Dioxa-7,11-dithiaspiro[5.5]undecane","Acta Crystallographica Section C","1998","54","7","1019","1023","10.1107/S0108270198000274","","","0.71069","MoKα","","0.084","0.043","","0.125","0.103","","","","1.042","1.113","1.113","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007472","6.1062","0.0012","8.404","0.002","17.721","0.003","90","","93.478","0.015","90","","907.7","0.3","293","1","293","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H12 O2 S2 -","- C7 H12 O2 S2 -","- C28 H48 O8 S8 -","4","1","OS1000","Bromley, Mark K.; Looney, Mark G.; Solomon, David H.; Gable, Robert W.; Helliwell, Madeleine; Hodge, Philip","1,5,7,11-Tetraoxaspiro[5.5]undecane, 3,9-Dimethylidene-1,5,7,11-tetraoxaspiro[5.5]undecane and 1,5-Dioxa-7,11-dithiaspiro[5.5]undecane","Acta Crystallographica Section C","1998","54","7","1019","1023","10.1107/S0108270198000274","","","0.71073","MoKα","","0.03","0.027","","0.074","0.072","","","","1.084","1.104","1.104","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007473","14.225","0.002","14.225","0.002","5.9","0.003","90","","90","","120","","1033.9","0.6","293","","","","","","","","","","","3","P 31","P 31","144","","(1R,2R,5S,7R,8R,9S)-2,6,6,8-tetramethyl tricyclo[5.3.1^1,7^.0^1,5^]undecane-8,9-diol","","- C15 H26 O2 -","- C15 H26 O2 -","- C45 H78 O6 -","3","1","QA0041","Yi-Lin Song; Yu-Bo Fan; Quan-Rui Wang; Zong-Biao Ding; Feng-Gang Tao; Ming-Qin Chen; Jie Sun","Cedranediol: a New Auxiliary for Asymmetric Homologation","Acta Crystallographica Section C","1998","54","7","IUC9800027","","10.1107/S0108270198099557","","","0.7107","MoKα","","","0.04","","","0.043","","","","","1.41","1.41","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007474","11.2771","0.001","11.3895","0.0011","13.715","0.002","90","","90","","90","","1761.6","0.3","133","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S,3R,4R,5R)-2-benzyl-N-(tert-butyloxycarbonyl)-3-hydroxy- 4,5-dimethyl-pyrrolidine","","- C18 H27 N O3 -","- C18 H27 N O3 -","- C72 H108 N4 O12 -","4","1","QA0042","Bats, Jan W.; Heinrich, Timo; Reggelin, Michael","(2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>R</i>)-2-Benzyl-<i>N</i>-(<i>tert</i>-butoxycarbonyl)-3-hydroxy-4,5-dimethylpyrrolidine at 133 K","Acta Crystallographica Section C","1998","54","7","IUC9800033","","10.1107/S010827019809951X","","","0.71073","Mo-Kα","","","0.033","","","0.037","","","","","1.475","1.475","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2007475","10.2091","0.0009","11.4381","0.0009","20.236","0.003","90","","93.831","0.009","90","","2357.7","0.4","294","1","294","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Bis(trimethylsilyl)amino-2-methoxy-3-methyl-6-(trimethylsilylamino)- pyrimidin-4(3H)-one","","- C15 H34 N4 O2 Si3 -","- C15 H34 N4 O2 Si3 -","- C60 H136 N16 O8 Si12 -","4","1","QA0044","Molina, Sebastian; Cobo, Justo; Nogueras, Manuel; Sanchez, Adolfo; Ferguson, George; Low, John N.","5-[Bis(trimethylsilyl)amino]-2-methoxy-3-methyl-6-(trimethylsilylamino)pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section C","1998","54","7","IUC9800030","","10.1107/S0108270198099533","","","0.7107","MolybdenumKα","","0.0951","0.0483","","","","0.1339","","","","","","0.988","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007476","9.1779","0.0008","9.5094","0.0007","29.07","0.002","90","","90","","90","","2537.1","0.3","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6,7-Dihydro-6-methyl-5-methoxy-3-beta-D-(tetra-O-acetyl)glucopyranosyl -7-oxo-1,2,3-triazolo[4,5-d]pyrimidine","","- C20 H25 N5 O11 -","- C20 H25 N5 O11 -","- C80 H100 N20 O44 -","4","1","QA0045","Ferguson, George; Low, John N.; Nogueras, M.; Cobo, J.; Lopez, M. Dolores; Quijano, M. Luisa; Sanchez, A.","6-Methyl-5-methoxy-3-(2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranos-1-yl)-3<i>H</i>-1,2,3-triazolo[4,5-<i>d</i>]pyrimidin-7(6<i>H</i>)-one","Acta Crystallographica Section C","1998","54","7","IUC9800031","","10.1107/S0108270198099521","","","0.7107","MolybdenumKα","","0.118","0.0522","","","","0.115","","","","","","0.923","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007477","15.311","0.001","11.41","0.001","14.561","0.001","90","","90","","90","","2543.8","0.3","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","the cholic acid methanol-water inclusion complex","","- C25 H46 O7 -","- C25 H46 O7 -","- C100 H184 O28 -","4","1","QB0013","Volkov, Anatoly; Huizhe, Zhu; Shuncheng, Liu; White, Mark A.; Coppens, Philip","The Cholic Acid-Methanol-Water Inclusion Complex","Acta Crystallographica Section C","1998","54","7","IUC9800026","","10.1107/S0108270198099569","","","0.71073","MoKα","","0.0551","0.0534","","","","0.1485","","","","","","1.063","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007478","8.995","0.002","11.35","0.004","9.724","0.003","90","","97.69","0.03","90","","983.8","0.5","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Sodium Hexacyanoferrate(II) Decahydrate","","","- C6 H20 Fe N6 Na4 O10 -","- C12 H40 Fe2 N12 Na8 O20 -","- C12 H40 Fe2 N12 Na8 O20 -","1","0.25","QB0040","Longridge, John J.; Rawson, Jeremy M.; Davies, John E.","Tetrasodium Hexacyanoferrate(II) Decahydrate","Acta Crystallographica Section C","1998","54","7","IUC9800028","","10.1107/S0108270198099582","","","0.71069","MoKα","","0.0564","0.0549","","","","0.1605","","","","","","1.141","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007479","10.465","0.002","11.418","0.002","12.705","0.003","90","","110.94","0.03","90","","1417.8","0.6","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(Benzoyloxy)methyl-2,2-dichloro-3,3-dimethylcyclobutanone","","- C14 H14 Cl2 O3 -","- C14 H14 Cl2 O3 -","- C56 H56 Cl8 O12 -","4","1","QB0048","Lee-Ruff, Edward; Ramnauth, Jailall","3,3-Dichloro-4,4-dimethyl-2-oxocyclobut-1-yl Benzoate","Acta Crystallographica Section C","1998","54","7","IUC9800029","","10.1107/S0108270198099545","","","0.71073","MoKα","","0.048","0.037","","","","0.096","","","","","","1.031","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007480","7.406","0.001","12.386","0.002","12.409","0.003","105.9","0.02","101.6","0.02","91.27","0.02","1068.8","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Lead(II)bis(2-fluorobenzoato)-bis(thiourea)monohydrate","(catena-(bis(μ-thiourea-S,S)-2-fluorobenzoato)-lead(II)) 2-fluorobenzoate - water (1/1)","","- C16 H18 F2 N4 O5 Pb S2 -","- C16 H18 F2 N4 O5 Pb S2 -","- C32 H36 F4 N8 O10 Pb2 S4 -","2","1","QC0003","Ragan, Colman; Jai-nhuknan, Jaran; Hughes, John M.; Cantrell, Joseph S.","Poly[[(2-fluorobenzoato)lead(II)-di-μ-thiourea-<i>S</i>:<i>S</i>] 2-Fluorobenzoate Monohydrate]","Acta Crystallographica Section C","1998","54","7","IUC9800032","","10.1107/S0108270198099570","","","0.71069","MoKα","","0.042","0.035","","0.08","0.076","","","","0.997","1.002","1.002","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007481","9.755","0.002","7.43","0.002","11.255","0.002","90","","99.8","0.1","90","","803.9","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Methanediyl bis(N,N-diethyldithiocarbamate).","","- C11 H22 N2 S4 -","- C11 H22 N2 S4 -","- C22 H44 N4 S8 -","2","1","SK1097","Marzotto, Armando; Clemente, Dore Augusto; Valle, Giovanni","A New Bis(dithioester): Methanediyl Bis(<i>N</i>,<i>N</i>-diethyldithiocarbamate), Derived from <i>cis</i>-Dichlorobis(<i>N</i>,<i>N</i>-diethyldithiocarbamato-<i>S</i>,<i>S</i>')tin(IV)","Acta Crystallographica Section C","1998","54","7","1040","1042","10.1107/S0108270198000924","","","0.71073","MoKα","","0.051","0.029","","0.076","0.069","","","","0.975","1.01","1.01","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007482","10.435","0.002","7.312","0.003","14.596","0.002","90","","101.29","0.02","90","","1092.1","0.5","292","","292","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Hexakis(urea)magnesium chlorate","","- C6 H24 Cl2 Mg N12 O12 -","- C6 H24 Cl2 Mg N12 O12 -","- C12 H48 Cl4 Mg2 N24 O24 -","2","0.5","SK1132","Todorov, Todor; Petrova, Rosica; Kossev, Krasimir; Macíček, Josef; Angelova, Olyana","Hexakis(urea-<i>O</i>)magnesium Dichlorate","Acta Crystallographica Section C","1998","54","7","927","929","10.1107/S0108270197018167","","","0.71073","MoKα","","","0.04","","","","0.048","","","","","","0.726","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007483","18.267","0.003","12.122","0.002","27.522","0.004","90","","108.26","0.02","90","","5787.4","1.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H40 P2 S15 Sb2 -","- C48 H40 P2 S15 Sb2 -","- C192 H160 P8 S60 Sb8 -","4","0.5","SK1145","Rijnberk, Herme; Näther, Christian; Schur, Michael; Jeß, Inke; Bensch, Wolfgang","[Ph~4~P]~2~[Sb~2~S~15~]","Acta Crystallographica Section C","1998","54","7","920","923","10.1107/S0108270198001188","","","0.71073","MoKα","","0.0465","0.0257","","0.0629","0.0577","","","","1.022","1.076","1.076","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007484","9.627","0.002","11.119","0.002","9.562","0.002","90","","90","","90","","1023.5","0.4","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Trirubidium niobium tetrasulfide","","","- Nb Rb3 S4 -","- Nb Rb3 S4 -","- Nb4 Rb12 S16 -","4","0.5","SK1159","Krause, Oliver; Näther, Christian; Jeß, Inke; Bensch, Wolfgang","Trirubidium Tetrathioniobate","Acta Crystallographica Section C","1998","54","7","902","904","10.1107/S0108270198001723","","","0.71073","MoKα","","0.0539","0.0292","","0.0748","0.0677","","","","1.016","1.052","1.052","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007485","18.618","0.002","18.618","0.002","18.618","0.002","118.34","0.01","118.34","0.01","118.34","0.01","2141","4","293","2","293","2","","","","","","","","4","R -3 :R","-P 3*","148","","2-(4-nitroanilino)-phenethylalcohol","","- C14 H14 N2 O3 -","- C14 H14 N2 O3 -","- C84 H84 N12 O18 -","6","1","SK1162","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vaylakkavoor T.Ramakrishnan","2-(4-Nitroanilino)-2-phenylethanol","Acta Crystallographica Section C","1998","54","7","955","957","10.1107/S0108270198001826","","","0.71073","MoKα","","0.1029","0.0446","","0.1246","0.1092","","","","0.798","1.069","1.069","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007486","9.68","0.003","17.611","0.004","10.076","0.002","90","","116.96","0.02","90","","1531","0.7","178","2","178","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(1R,2R)-Cyclopentane-1,2-diyl-bis[(4'S,5'S)-4',5'-diisopropoxycarbonyl- 1'3',2'-dioxaphospholane]","","- C25 H40 O12 P2 -","- C25 H40 O12 P2 -","- C50 H80 O24 P4 -","2","1","SK1170","Dahlenburg, Lutz; Kaunert, Anja","Chiral Bisphosphanes. IV. Tetraisopropyl 2,2'-[(1<i>R</i>,2<i>R</i>)-Cyclopentane-1,2-diyl]bis[(4<i>S</i>,5<i>S</i>)-1,3,2-dioxaphospholane-4,5-dicarboxylate]","Acta Crystallographica Section C","1998","54","7","1016","1017","10.1107/S010827019800119X","","","0.71069","MoKα","","0.0587","0.0526","","0.1414","","0.1399","","","1.051","","","1.041","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007487","9.9216","0.0006","11.2148","0.0006","12.1991","0.0007","90","","105.558","0.005","90","","1307.64","0.13","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(dichlorodimethyltin^.^3-methyl-4-nitropyridine N-oxide)","","- C8 H12 Cl2 N2 O3 Sn -","- C8 H12 Cl2 N2 O3 Sn -","- C32 H48 Cl8 N8 O12 Sn4 -","4","1","SK1174","Lim, Hock Chuan; Ng, Seik Weng","Di-μ-chloro-bis[chlorodimethyl(3-methyl-4-nitropyridine <i>N</i>-oxide-<i>O</i>)tin]","Acta Crystallographica Section C","1998","54","7","939","941","10.1107/S0108270198001735","","","0.71073","MoKα","","0.0381","0.0255","","0.0633","0.0585","","","","1.009","1.045","1.045","","","","","has coordinates","197922","2020-10-21","18:00:00",""
"2007488","12.8011","0.0002","9.6258","0.0002","19.4453","0.0002","90","","92.882","0.001","90","","2393.04","0.07","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 Cl2 N2 -","- C12 H10 Cl2 N2 -","- C96 H80 Cl16 N16 -","8","2","SK1176","Benchat, Nour-Eddine; Taoufik, Jamal; Essassi, El-Mokhtar; Ramdani, Abdelkrim; El-Bali, Brahim; Bolte, Michael","6-Chloro-4-(<i>o</i>-chlorobenzyl)-3-methylpyridazine at 173K","Acta Crystallographica Section C","1998","54","7","964","966","10.1107/S0108270198001838","","","0.71073","MoKα","","0.0465","0.034","","0.081","0.0753","0.081","","","1.052","","","1.052","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007489","8.5961","0.0003","10.367","0.0006","16.506","0.001","90","","98.76","0.01","90","","1453.79","0.14","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","","","- C19 H13 N O -","- C19 H13 N O -","- C76 H52 N4 O4 -","4","1","SX1044","Garcia, J. Gabriel; Haas, Julia; Rodriguez, Augusto; Fronczek, Frank R.","9-Hydroxy-9-(3-methylbut-3-en-1-ynyl)-9<i>H</i>-fluorene-1-carbonitrile","Acta Crystallographica Section C","1998","54","7","952","954","10.1107/S010827019701771X","","","1.54184","CuKα","","","0.038","","","0.051","","","","","2.58","2.58","","","","","has coordinates,has disorder,has Fobs","192029","2020-10-21","18:00:00",""
"2007490","9.226","0.001","15.164","0.002","18.868","0.002","90","","99.03","0.01","90","","2607","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[2,2'-iminodipyridinium(1+)] bis[μ-4-hydroxy-2,6-pyridinedicarboxylato(3-)]bis[aquadibutyltin(IV)] dihydrate","","- C25 H34 N4 O7 Sn -","- C25 H34 N4 O7 Sn -","- C100 H136 N16 O28 Sn4 -","4","1","TA1200","Ng, Seik Weng","Bis[2,2'-iminodipyridinium(1+)] Bis[μ-4-hydroxy-2,6-pyridinedicarboxylato(3 ‒)]bis[aquadibutyltin(IV)] Dihydrate","Acta Crystallographica Section C","1998","54","7","914","916","10.1107/S0108270198001322","","","0.71073","MoKα","","0.04","0.028","","0.072","0.067","","","","1.002","1.04","1.04","","","","","has coordinates","197922","2020-10-21","18:00:00",""
"2007491","14.354","0.005","13.594","0.004","17.501","0.003","90","","91.29","0.02","90","","3414.1","1.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","BistriphenylphosphineoxidetinIIchloride","","","- C36 H30 Cl2 O2 P2 Sn -","- C36 H30 Cl2 O2 P2 Sn -","- C144 H120 Cl8 O8 P8 Sn4 -","4","1","VJ1080","Selvaraju, R.; Panchanatheswaran, K.; Parthasarathi, V.","Dichlorobis(triphenylphosphine oxide)tin(II)","Acta Crystallographica Section C","1998","54","7","905","906","10.1107/S0108270198000328","","","0.71069","MoKα","","0.063","0.04","","0.077","0.072","","","","1.218","1.317","1.317","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007492","9.3938","0.0008","9.3938","0.0008","6.9013","0.0005","90","","90","","120","","527.4","0.07","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","britholite","","","- Ca9 F1.5 Nd O24.25 P5 Si -","- Ca9 F1.54 Nd O24.28 P5.1 Si0.9 -","- Ca9 F1.54 Nd O24.28 P5.1 Si0.9 -","1","0.0833333","","Laurent Boyer; Jean-Michel Savariault; Joëlle Carpena; Jean-Louis Lacout","Neodymium-Substituted Britholite Compound","Acta Crystallographica Section C","1998","54","","1057","1059","","","","","","","","0.0346","","","0.0924","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2007493","9.255","0.001","12.524","0.002","13.538","0.002","90","","104.32","0.01","90","","1520.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H26 Br2 Cu N2 O2 -","- C36 H26 Br2 Cu N2 O2 -","- C72 H52 Br4 Cu2 N4 O4 -","2","0.5","AB1532","Elerman, Yalc̨in; Elmali, Ayhan; Özbey, Süheyla","Bis[<i>N</i>-(2-bromo-4-methylphenyl)naphthaldiminato]copper(II)","Acta Crystallographica Section C","1998","54","8","1072","1074","10.1107/S0108270198003345","","","0.71069","MoKα","","0.098","0.056","","0.097","0.09","","","","1.208","1.387","1.387","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007494","6.235","0.009","13.137","0.01","25.73","0.03","88.05","0.09","86.38","0.1","84.5","0.09","2093","4","293","2","293","2","","","","","","","","3","P 1","P 1","1","Seychellogenin","3β-Hydroxy-20(S)-Holost-7,9-dien","","- C31 H48.67 O3.67 -","- C31 H48.6667 O3.66667 -","- C93 H146 O11 -","3","3","AV1012","Ilyin, Sergey G.; Antonov, Alexander S.; Stonik, Valentine A.; Antipin, Michael Yu.; Elyakov, Georgy B.","(20<i>S</i>)-3β-Hydroxyholosta-7,9-diene","Acta Crystallographica Section C","1998","54","8","1156","1158","10.1107/S0108270198001966","","","0.71069","MoKα","","0.1888","0.0843","","0.1256","0.1208","","","","1.829","2.484","2.484","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007495","14.766","0.002","24.223","0.005","9.239","0.001","94.74","0.01","96.72","0.01","87.19","0.01","3268.1","0.9","294","","294.2","","","","","","","","","4","P -1","-P 1","2","","","","- C80 H68 Mn2 O12 -","- C80 H68 Mn2 O12 -","- C160 H136 Mn4 O24 -","2","1","BK1373","Yaukey, Tammy S.; Steward, Omar W.; Chang, Shih-Chi","Manganese(II) Triphenylacetate Hydrate, a Manganese(II) Complex with a Chain Structure","Acta Crystallographica Section C","1998","54","8","1081","1083","10.1107/S0108270198003126","","","0.7107","MoKα","","","0.048","","","0.052","","","","","1.94","1.94","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007496","13.558","0.004","7.051","0.002","15.482","0.004","90","","90.42","0.02","90","","1480","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aqua(1,10-phenanthrolyne-N,N')(μ-thiosulfato-S,O) cadmium(II)), hydrate.","","- C12 H12 Cd N2 O5 S2 -","- C12 H12 Cd N2 O5 S2 -","- C48 H48 Cd4 N8 O20 S8 -","4","1","BK1378","Baggio, Sergio; Baggio, Ricardo; Garland, Maria Teresa","Aqua(1,10-phenanthroline-<i>N</i>,<i>N</i>')(μ~3~-thiosulfato-<i>S</i>:<i>S</i>:<i>O</i>)cadmium(II) Hydrate","Acta Crystallographica Section C","1998","54","8","1099","1102","10.1107/S0108270198003138","","","0.71073","MoKα","","0.084","0.041","","","","0.072","","","","","","0.999","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007497","11.642","0.002","33.225","0.003","16.312","0.004","90","","93.21","0.02","90","","6300","2","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","[7,11- or 7,8-(μ-thiobenzoate-S:O)-7-(triphenylphosphine-P)-8,9:10,11-di- μH-7-platina-nido-undecaborane] 0.5-dichloromethane","","- C25.5 H32 B10 Cl O P Pt S -","- C25.5 H27 B10 Cl O P Pt S -","- C204 H216 B80 Cl8 O8 P8 Pt8 S8 -","8","2","BM1188","Chun-Hua Hu; Jian-Min Dou; Jie Sun; Hai-Jun Yao; Jing-De Wei; Ruo-Shui Jin; Pei-Ju Zheng","Exopolyhedral Cyclized Platinaundecaboranes: [(PPh~3~)(PhCOS)PtB~10~H~11~].0.5CH~2~Cl~2~","Acta Crystallographica Section C","1998","54","8","1089","1091","10.1107/S010827019800290X","","","0.71073","MoKα","","0.121","0.076","","","","0.258","","","","","","1.102","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007498","8.108","0.005","5.345","0.001","16.68","0.011","90","","94.16","0.03","90","","721","0.7","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 N4 S2 -","- C14 H14 N4 S2 -","- C28 H28 N8 S4 -","2","0.5","BM1197","Bermejo, Elena; Carballo, Rosa; Castiñeiras, Alfonso; Maichle-Mössmer, Cäcilia","<i>N</i>,<i>N</i>'-Bis(2-pyridylmethyl)dithiooxamide","Acta Crystallographica Section C","1998","54","8","1130","1131","10.1107/S0108270198002510","","","1.54184","CuKα","","0.104","0.052","","","","0.146","","","","","","1.027","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007499","8.972","0.001","8.972","0.001","34.15","0.02","90","","90","","120","","2380.7","1.4","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","Kemp's acid-acrylonitrile","(1α,3α,5α)-1,3,5-trimethyl-1,3,5-cyclohexanetricarboxylic acid-acetonitrile","","- C14 H21 N O6 -","- C14 H21 N O6 -","- C84 H126 N6 O36 -","6","0.333333","BM1202","Hirose, Takuji; Baldwin, Bruce W.; Wang, Zhen-He; Kennard, Colin H. L.","(1α,3α,5α)-1,3,5-Trimethyl-1,3,5-cyclohexanetricarboxylic Acid Acetonitrile Solvate","Acta Crystallographica Section C","1998","54","8","1143","1144","10.1107/S0108270198001024","","","0.71073","MoKα","","0.08","0.05","","","","0.152","","","","","","1.096","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007500","10.128","0.002","10.599","0.002","12.784","0.004","86.75","0.02","86.35","0.02","79.079","0.009","1343.3","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Iodo (1,10-Phenathroline-N,N')(Triphenylphosphine) Copper(I)","","- C30 H23 Cu I N2 P -","- C30 H23 Cu I N2 P -","- C60 H46 Cu2 I2 N4 P2 -","2","1","BM1209","Jin, Qiong-Hua; Xin, Xiu-Lan; Dong, Cheng-Jun; Zhu, Hui-Ju","Iodo(1,10-phenanthroline-<i>N</i>,<i>N</i>')(triphenylphosphine)copper(I)","Acta Crystallographica Section C","1998","54","8","1087","1089","10.1107/S0108270198001991","","","0.71073","MoKα","","","0.0312","","","","0.0843","","","","","","1.117","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007501","11.0341","0.0008","11.0341","0.0008","62.874","0.009","90","","90","","120","","6629.4","1.2","150","2","150","2","","","","","","","","3","P 31 2 1","P 31 2""","152","β-dihydroentandrophragmin","","","- C44.42 H60.84 O17.71 -","- C44.42 H60.84 O17.71 -","- C266.52 H365.04 O106.26 -","6","1","BM1227","Baxter, Robert L.; Dijksma, Fokke J. J.; Gould, Robert O.; Parsons, Simon","β-Dihydroentandrophragmin‒Ethyl Acetate (1/0.355)","Acta Crystallographica Section C","1998","54","8","1182","1184","10.1107/S0108270198006076","","","1.54184","CuKα","","0.093","0.075","","","","0.21","","","","","","1.043","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007502","6.4542","0.0014","12.388","0.003","13.501","0.003","90","","93.2","0.02","90","","1077.8","0.4","143","2","143","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Benzo[g]imidazo[1,2-a]-2,3,5,6,7,8-hexahydro-quinazoline","","- C14 H13 N3 -","- C14 H13 N3 -","- C56 H52 N12 -","4","1","BM1232","Elgemeie, Galal E. H.; Fathy, Nahed M.; Hopf, Henning; Jones, Peter G.","1,2,3,4-Tetrahydrobenzimidazo[2,1-<i>b</i>]quinazoline","Acta Crystallographica Section C","1998","54","8","1109","1111","10.1107/S0108270198003278","","","0.71073","MoKα","","0.083","0.051","","0.126","0.109","","","","1.047","1.108","1.108","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007503","8.105","0.004","9.292","0.004","10.283","0.004","109.67","0.03","102.76","0.03","107.14","0.02","651.3","0.5","143","2","143","2","","","","","","","","3","P -1","-P 1","2","","","","- C17 H15 N3 -","- C17 H15 N3 -","- C34 H30 N6 -","2","1","","Elgemeie, Galal E. H.; Fathy, Nahed M.; Hopf, Henning; Dix, Ina; Jones, Peter G.","2,3,4,5-Tetrahydrocyclohepta[b]pyrido[2,1-a]benzimidazole-7-carbonitrile","Acta Crystallographica Section C","1998","54","","1107","1109","","","","","","","","0.055","","","0.096","","","","","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007504","8.5161","0.0004","10.039","0.0004","7.5138","0.0003","90","","95.372","0.003","90","","639.56","0.05","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","calcium iodate monohydrate","calcium iodate monohydrate","","- Ca D2 I O7 -","- Ca D2.01 I2 O7 -","- Ca4 D8.04 I8 O28 -","4","1","BR1201","Peter, Stefan; Suchanek, Ellen; Roisnel, Thierry; Lutz, Heinz Dieter","Neutron Powder Diffraction Study on Highly Deuterated Ca(IO~3~)~2~.D~2~O","Acta Crystallographica Section C","1998","54","8","1064","1066","10.1107/S010827019800167X","","neutron","1.2272","neutron","","0.039","","","","","","","","1.3","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007505","9.384","0.002","9.182","0.002","10.997","0.003","90","","90","","90","","947.5","0.4","295","","295","","","","","","","","","4","P n m a","-P 2ac 2n","62","Sodium managanese tellurate","","","- Mn4 Na3 O12 Te2 -","- Mn4 Na3 O12 Te2 -","- Mn16 Na12 O48 Te8 -","4","0.5","BR1203","Feger, Christopher R.; Kolis, Joseph W.","Na~3~Mn~4~Te~2~O~12~","Acta Crystallographica Section C","1998","54","8","1055","1057","10.1107/S0108270197020076","","","0.71073","MoKα","","0.068","0.048","","0.05","0.049","","","","","2.64","2.64","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007506","9.2892","0.0006","9.0724","0.0005","9.5328","0.0012","90","","96.15","0.006","90","","798.76","0.12","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H9 O7 P -","- C6 H9 O7 P -","- C24 H36 O28 P4 -","4","1","CF1164","Neidle, Stephen; Gaffney, Piers R.J.; Reese, Colin B.","<i>myo</i>-Inositol 1,3,5-Bicyclic Phosphate","Acta Crystallographica Section C","1998","54","8","1191","1192","10.1107/S0108270197017435","","","0.7107","MoKα","","0.0457","0.0387","","0.0978","0.0927","","","","0.576","0.609","0.609","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007507","7.654","0.001","11.282","0.002","29.404","0.004","90","","90","","90","","2539.1","0.7","293","2","293","2","","","","","","","","5","P n a a","-P 2ac 2bc","56","","","","- C14 H12 N2 O2 S -","- C14 H12 N2 O2 S -","- C112 H96 N16 O16 S8 -","8","1","CF1230","Hdii, Fatiha; Reboul, Jean-Pierre; Barbe, Jacques; Siri, Didier; Pèpe, Gérard","10-Ethyl-3-nitrophenothiazine","Acta Crystallographica Section C","1998","54","8","1151","1152","10.1107/S0108270198002522","","","0.71073","MoKα","","0.041","0.039","","0.082","0.081","","","","0.992","1.181","1.181","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007508","34.201","0.005","5.219","0.002","23.179","0.004","90","","98.57","0.05","90","","4091.1","1.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H19 N O5 S3 -","- C19 H19 N O5 S3 -","- C152 H152 N8 O40 S24 -","8","1","CF1236","TranQui, Duc; Fresneau, Pierre; Cussac, Max","(<i>Z</i>)-5-(1-Methoxy-2-naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidine-3-acetic Acid Dimethyl Sulfoxide Solvate","Acta Crystallographica Section C","1998","54","8","1152","1154","10.1107/S0108270198003096","","","0.71073","MoKα","","0.055","0.054","","0.121","0.118","","","","1.128","1.159","1.159","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007509","10.819","0.003","4.936","0.001","23.671","0.007","90","","91.34","0.02","90","","1263.7","0.6","300","2","300","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H32 N2 Ni O2 -","- C30 H32 N2 Ni O2 -","- C60 H64 N4 Ni2 O4 -","2","0.5","CF1237","Elerman, Yalc̨in; Elmali, Ayhan; Svoboda, Ingrid; Fuess, Hartmut","Bis(<i>N</i>-<i>n</i>-butyl-2-hydroxy-1-naphthaldiminato)nickel(II)","Acta Crystallographica Section C","1998","54","8","1076","1078","10.1107/S0108270198002534","","","0.71069","MoKα","","0.135","0.048","","0.162","0.128","","","","1.006","1.124","1.124","","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2007510","7.9188","0.0014","15.01","0.003","13.422","0.002","90","","101.064","0.003","90","","1565.7","0.5","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2',4'-dihydroxy-2-[3""-(4""'-methylphenyl)isoxazol-5""-yl]acetophenone","","- C18 H15 N O4 -","- C18 H15 N O4 -","- C72 H60 N4 O16 -","4","1","CF1247","Kumar, Naresh; Roy, Sucharita; Parmar, Virinder S.; Errington, William","2',4'-Dihydroxy-2-[3-(4-methylphenyl)isoxazol-5-yl]acetophenone","Acta Crystallographica Section C","1998","54","8","1123","1125","10.1107/S0108270198003102","","","0.71073","MoKα","","0.073","0.043","","","","0.111","","","","","","0.99","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007511","5.4965","0.0002","5.4965","0.0002","11.137","0.001","90","","90","","90","","336.47","0.03","296","","","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C H2 N4 O -","- C H2 N4 O -","- C4 H8 N16 O4 -","4","0.5","DA1003","Ohno, Yoshio; Akutsu, Yoshiaki; Arai, Mitsuru; Tamura, Masamitsu; Matsunaga, Takehiro; Iida, Mitsuaki","1<i>H</i>-Tetrazol-5(4<i>H</i>)-one","Acta Crystallographica Section C","1998","54","8","1160","1162","10.1107/S0108270198002108","","","0.7107","MoKα","","","0.028","","","","0.04","","","","","","1.36","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007512","8.89","0.002","19.392","0.002","8.704","0.002","90","","118.48","0.02","90","","1318.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","5,5-diphenyl-2-thiohydantoin","5,5-diphenyl-2-thioimidazolidine-4-one","","- C15 H12 N2 O S -","- C15 H12 N2 O S -","- C60 H48 N8 O4 S4 -","4","1","FG1365","Roszak, Aleksander W.; Weaver, Donald F.","5,5-Diphenyl-2-thiohydantoin","Acta Crystallographica Section C","1998","54","8","1168","1170","10.1107/S0108270197019963","","","0.71069","MoKα","","0.057","0.035","","0.112","0.095","","","","1.105","1.136","1.136","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007513","11.715","0.002","11.385","0.005","16.071","0.003","90","","104.57","0.01","90","","2074.5","1.1","298.2","","298.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Carbonyl(1,3-diphenyl-1,3-propanedionato-κO,κO)(4-methyl-2,6,7-trioxa-1- phosphabicyclo[2.2.2]octane)rhodium(I)","","- C21 H20 O6 P Rh -","- C21 H20 O6 P Rh -","- C84 H80 O24 P4 Rh4 -","4","1","FG1391","Erasmus, Johannes J. C.; Lamprecht, Gert J.; Kohzuma, Takamitsu; Nakano, Yoshiharu","Carbonyl(1,3-diphenyl-1,3-propanedionato-<i>O</i>,<i>O</i>')(4-methyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-<i>P</i>)rhodium(I)","Acta Crystallographica Section C","1998","54","8","1085","1087","10.1107/S0108270198002388","","","0.7107","MoKα","","0.069","0.052","","","","0.187","","","","","","1.175","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2007514","8.8847","0.0006","10.483","0.001","11.6776","0.0013","90","","108.375","0.008","90","","1032.18","0.17","293","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","racemic atrolactamidinium chloride","Racemic 2-Hydroxy-2-phenyl-propanamidinium chloride","","- C9 H13 Cl N2 O -","- C9 H13 Cl N2 O -","- C36 H52 Cl4 N8 O4 -","4","1","FG1392","Barnes, John C.; Weakley, Timothy J.R.","Racemic 2-Hydroxy-2-phenylpropanamidinium Chloride and (<i>S</i>)-2-Hydroxy-2-phenylbutanamidinium (<i>R</i>)-2-Hydroxy-2-phenylethanoate","Acta Crystallographica Section C","1998","54","8","1170","1173","10.1107/S010827019800239X","","","0.71073","MoKα","","0.062","0.054","","","","0.155","","","","","","1.823","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007515","7.3793","0.0009","12.917","0.004","10.2713","0.0013","90","","109.407","0.011","90","","923.4","0.3","293","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","(S)-2-hydroxy-2-phenylbutanamidinium (R)-mandelate","(S)-2-Hydroxy-2-phenylbutanamidinium (R)-2-Hydroxy-2-phenylethanoate","","- C18 H22 N2 O4 -","- C18 H22 N2 O4 -","- C36 H44 N4 O8 -","2","1","FG1392","Barnes, John C.; Weakley, Timothy J.R.","Racemic 2-Hydroxy-2-phenylpropanamidinium Chloride and (<i>S</i>)-2-Hydroxy-2-phenylbutanamidinium (<i>R</i>)-2-Hydroxy-2-phenylethanoate","Acta Crystallographica Section C","1998","54","8","1170","1173","10.1107/S010827019800239X","","","0.71073","MoKα","","0.059","0.037","","","","0.107","","","","","","1.111","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007516","8.6388","0.0008","12.9233","0.0011","11.13","0.0013","90","","90","","90","","1242.6","0.2","293","2","293","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C6 H13 N5 S2 Zn -","- C6 H13 N5 S2 Zn -","- C24 H52 N20 S8 Zn4 -","4","0.5","FG1401","Lu, Tian-Huey; Lo, Jem-Mau; Chen, Bor-Hann; Yeh, Mou-Yung; Tung, Shu-Fang; Huang, Wen-Tao; Yao, Hsueh-Hua","(Diethylenetriamine)bis(isothiocyanato)zinc(II)","Acta Crystallographica Section C","1998","54","8","1067","1068","10.1107/S0108270198002753","","","0.7107","MoKα","","0.055","0.039","","0.098","0.095","","","","1.071","1.173","1.173","","","","","has coordinates,has disorder,has Fobs","203567","2020-10-21","18:00:00",""
"2007517","10.9634","0.0008","11.1491","0.0008","13.2319","0.001","114.161","0.006","95.894","0.004","92.468","0.006","1461.4","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","[μ-(4,7-η:16,19-η)-5,24:6,11:12,17:18,23-tetra[1,2]benzeno- tetrabenzo[a,e,i,m]cyclohexadecene]bis{aqua[(2,3-η)toluene]silver(I)} bis(trifluoromethanesulfonate)","","- C72 H52 Ag2 F6 O8 S2 -","- C72 H52 Ag2 F6 O8 S2 -","- C72 H52 Ag2 F6 O8 S2 -","1","0.5","FG1410","Kammermeier, Stefan; Jones, Peter G.; Dix, Ina; Herges, Rainer","A Silver(I) Complex of a Tube-Shaped Hydrocarbon","Acta Crystallographica Section C","1998","54","8","1078","1081","10.1107/S0108270198002406","","","0.71073","MoKα","","0.044","0.034","","0.08","0.077","","","","1.051","1.122","1.122","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007518","6.4046","0.0009","5.255","0.0008","27.634","0.003","90","","92.111","0.008","90","","929.4","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","(+/-)-α-Tetralonecarboxylic Acid","(+/-)-4-Oxo-1,2,3,4-tetrahydronapthalene-1-carboxylic Acid","","- C11 H10 O3 -","- C11 H10 O3 -","- C44 H40 O12 -","4","1","FG1433","Thompson, Hugh W.; Lalancette, Roger A.; Brunskill, Andrew P. J.","(±)-4-Oxo-1,2,3,4-tetrahydronaphthalene-1-carboxylic Acid: Hydrogen Bonding and Carboxyl Disordering in a δ-Keto Acid","Acta Crystallographica Section C","1998","54","8","1180","1182","10.1107/S0108270198002765","","","0.71073","MoKα","","0.074","0.041","","0.108","0.091","","","","1.03","1.1","1.1","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007519","12.5595","0.0003","18.7907","0.0007","10.375","0.002","90","","90","","90","","2448.5","0.5","180","","180","","","","","","","","","3","P n a 21","P 2c -2n","33","","(RS,RS)-1,2-(1-Dinaphthyl)-1,2-diphenyl-ethan-1,2-diol","","- C34 H26 O2 -","- C34 H26 O2 -","- C136 H104 O8 -","4","1","FG1438","Mak, Thomas C.W.; Patrick, Brian O.; Rettig, Steven J.; Scheffer, John R.; Trotter, James; Ukpabi, Pauline; Wu, Bo-Mu; Yee, Vivien C.","α-Naphthyl Phenyl Pinacols","Acta Crystallographica Section C","1998","54","8","1148","1151","10.1107/S0108270198002777","","","0.7107","MoKα","","0.072","0.044","","","","0.113","","","1.3","","","1.3","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007520","11.072","0.002","11.4926","0.0003","18.9075","0.0007","90","","90","","90","","2405.9","0.4","180","","180","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","5-(1-naphthyl)-3,5-diphenyl-4-oxa- tricyclo[7.4.0.0^2,6^]trideca-7,9,11,13-tetraen-3-ol","","- C34 H26 O2 -","- C34 H26 O2 -","- C136 H104 O8 -","4","1","FG1438","Mak, Thomas C.W.; Patrick, Brian O.; Rettig, Steven J.; Scheffer, John R.; Trotter, James; Ukpabi, Pauline; Wu, Bo-Mu; Yee, Vivien C.","α-Naphthyl Phenyl Pinacols","Acta Crystallographica Section C","1998","54","8","1148","1151","10.1107/S0108270198002777","","","0.7107","MoKα","","0.076","0.048","","","","0.121","","","1.16","","","1.16","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007521","11.832","0.001","14.216","0.002","16.649","0.003","90","","90","","90","","2800.4","0.7","293","1","293","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","3α-Bikhaconine","","","- C28 H47 N O9 -","- C28 H47 N O9 -","- C112 H188 N4 O36 -","4","1","FG1439","Parvez, Masood; Gul, Waseem; Anwar, Saeed","3α-Bikhaconine Acetone Solvate","Acta Crystallographica Section C","1998","54","8","1139","1141","10.1107/S0108270198002546","","","1.54178","CuKα","","0.059","0.057","","","","0.149","","","","","","1.064","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007522","8.544","0.002","13.164","0.0013","16.8094","0.0019","90","","90","","90","","1890.6","0.5","100","2","100","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1-Bromomercurio-2-(2,5,8,11,14-pentaoxapentadecyl)benzene","","- C16 H25 Br Hg O5 -","- C16 H25 Br Hg O5 -","- C64 H100 Br4 Hg4 O20 -","4","1","FG1440","Lutz, Martin; Spek, Anthony L.; Markies, Peter R.; Akkerman, Otto S.; Bickelhaupt, Friedrich","1-Bromomercurio-2-(2,5,8,11,14-pentaoxapentadecyl)benzene","Acta Crystallographica Section C","1998","54","8","1091","1093","10.1107/S0108270198002418","","","0.71073","MoKα","","0.033","0.025","","","","0.051","","","","","","0.996","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007523","9.0116","0.0017","12.073","0.003","8.4305","0.0018","104.542","0.019","96.133","0.017","86.504","0.018","882.2","0.3","296","","296","","","","","","","","","3","P -1","-P 1","2","","sp-9-[o-(β-Chloro-α,α-dimethylethyl)phenyl]fluorene","","- C23 H21 Cl -","- C23 H21 Cl -","- C46 H42 Cl2 -","2","1","FG1442","Robinson, Paul D.; Hou, Yuqing; Meyers, Cal Y.","<i>sp</i>-9-[<i>o</i>-(β-Chloro-α,α-dimethylethyl)phenyl]fluorene: an Unanticipated Exclusive Product from the Reaction of <i>sp</i>-9-(<i>o</i>-<i>tert</i>-Butylphenyl)-9-fluorenol with Thionyl Chloride","Acta Crystallographica Section C","1998","54","8","1173","1175","10.1107/S0108270198002911","","","0.71069","MoKα","","0.069","0.035","","","","0.094","","","","","","1.008","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007524","8.519","0.002","9.315","0.002","13.429","0.003","90","","90","","90","","1065.7","0.4","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 N O4 -","- C11 H15 N O4 -","- C44 H60 N4 O16 -","4","1","FR1088","Abboud, Khalil A.; Butora, Gabor; Fearnley, Stephen P.; Gum, Andrew G.; Stabile, Michele R.; Hudlicky, Tomas","(7<i>R</i>,8<i>S</i>,10b<i>R</i>)-7,8-Dihydroxy-1,5,6,7,8,9,10,10b-octahydro-3<i>H</i>-1,3-oxazolo[4,3-<i>a</i>]isoquinolin-3-one","Acta Crystallographica Section C","1998","54","8","1162","1164","10.1107/S0108270197019586","","","0.71073","MoKα","","0.045","0.038","","0.078","0.074","","","","1.06","1.06","1.06","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007525","6.771","0.001","8.63","0.004","9.88","0.003","103.88","0.02","102.8","0.02","100.14","0.03","530.3","0.3","158","2","158","2","","","","","","","","5","P -1","-P 1","2","","8-aminoquinolinium chloride dihydrate","","- C9 H13 Cl N2 O2 -","- C9 H13 Cl N2 O2 -","- C18 H26 Cl2 N4 O4 -","2","1","FR1092","Barry J. Prince; Mark M. Turnbull","8-Aminoquinolinium Chloride Dihydrate","Acta Crystallographica Section C","1998","54","8","1178","1180","10.1107/S0108270198002133","","","0.71073","MoKα","","0.048","0.04","","0.115","0.112","","","","1.036","1.129","1.129","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007526","7.161","0.0001","9.445","0.002","12.479","0.003","80.63","0.002","72.441","0.003","83.272","0.002","791.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H19 Cl N2 O -","- C17 H19 Cl N2 O -","- C34 H38 Cl2 N4 O2 -","2","1","FR1105","Işik, Şamil; Aygün, Muhittin; Kocaokutgen, Hasan; Tahir, M. Nawaz","3-<i>tert</i>-Butyl-2'-chloro-2-hydroxy-5-methylazobenzene","Acta Crystallographica Section C","1998","54","8","1145","1146","10.1107/S0108270198002923","","","0.71069","MoKα","","0.074","0.055","","0.14","0.131","","","","1.097","1.195","1.195","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007527","13.047","0.0002","13.3683","0.0001","21.467","0.0003","90","","90","","90","","3744.19","0.08","213","2","213","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Adamantyl dithiete","3,4‒Bis(1‒adamantyl)‒1,2‒dithiete","","- C22 H30 S2 -","- C22 H30 S2 -","- C176 H240 S16 -","8","2","FR1112","Donahue, James P.; Holm, Richard H.","3,4-Bis(1-adamantyl)-1,2-dithiete: the First Structurally Characterized Dithiete Unsupported by a Ring or Benzenoid Frame","Acta Crystallographica Section C","1998","54","8","1175","1178","10.1107/S0108270198002935","","","0.71073","MoKα","","0.065","0.045","","0.105","0.094","","","","1.014","1.038","1.038","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007528","17.218","0.002","8.121","0.002","19.301","0.001","90","","91.264","0.007","90","","2698.2","0.7","296","","296","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","ortho-(1-naphthoyl)benzoic acid","","","- C18 H12 O3 -","- C18 H12 O3 -","- C144 H96 O24 -","8","1","FR1119","Gerkin, Roger E.","<i>ortho</i>-(1-Naphthoyl)benzoic Acid","Acta Crystallographica Section C","1998","54","8","1184","1186","10.1107/S0108270198002868","","","0.71073","MoKα","","","","","","","0.06","","","","","","1.67","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007529","11.591","0.001","10.891","0.001","10.903","0.001","90","","118","0.02","90","","1215.3","0.3","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Cyclopropylcarboximidamide Hydrochloride","","- C4 H9 Cl N2 -","- C4 H9 Cl N2 -","- C32 H72 Cl8 N16 -","8","1","HA1206","Barker, James; Powell, Harold R.","Cyclopropylcarboxamidinium Chloride","Acta Crystallographica Section C","1998","54","8","1189","1191","10.1107/S0108270197018829","","","0.71073","MoKα","","","0.052","","","0.053","","","","","1.098","1.098","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007530","4.2308","0.0003","14.2071","0.0009","7.0308","0.0005","90","","101.961","0.001","90","","413.43","0.05","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","2,6-dibromo-4-nitroaniline","2,6-dibromo-4-nitroaniline","","- C6 H4 Br2 N2 O2 -","- C6 H4 Br2 N2 O2 -","- C12 H8 Br4 N4 O4 -","2","0.5","HA1207","Bryant, Richard; James, Siân C.; Norman, Nicholas C.; Orpen, A. Guy","2,6-Dibromo-4-nitroaniline","Acta Crystallographica Section C","1998","54","8","1113","1115","10.1107/S0108270198001814","","","0.71073","MoKα","","0.0666","0.0588","","0.1477","0.1459","","","","0.994","1.145","1.145","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007531","9.313","0.001","19.202","0.003","22.33","0.003","90","","90","","90","","3993.2","0.9","297","2","297","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C23 H24 N2 Ni O2 -","- C23 H24 N2 Ni O2 -","- C184 H192 N16 Ni8 O16 -","8","1","JZ1238","Paulus, Helmut; Svoboda, Ingrid; Fuess, Hartmut","Rerefinement of {1-[(2-Hydroxybenzylidene)aminomethyl]naphthalen-2-olato(2 ‒)-<i>N</i>,<i>O</i>,<i>O</i>'}(piperidine-<i>N</i>)nickel(II)","Acta Crystallographica Section C","1998","54","8","1075","1076","10.1107/S0108270198005228","","","0.71069","MoKα","","0.133","0.037","","0.113","0.084","","","","1.007","1.082","1.082","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2007532","6.981","0.002","8.334","0.001","8.924","0.001","90","","112.32","0.02","90","","480.3","0.17","294","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Co O7 P2 Zn -","- Co O7 P2 Zn -","- Co4 O28 P8 Zn4 -","4","1","JZ1256","Bettach, M.; Benkhouja, K.; Zahir, M.; Rissouli, K.; Sadel, A.; Giorgi, M.; Pierrot, M.","A Mixed Zinc‒Cobalt Diphosphate, ZnCoP~2~O~7~","Acta Crystallographica Section C","1998","54","8","1059","1062","10.1107/S0108270198002820","","","0.71073","Mo_Kα","","0.048","0.041","","","0.064","","","","","2.011","2.011","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007533","12.302","0.008","7.461","0.004","11.203","0.008","90","","101.7","0.05","90","","1006.9","1.1","203","2","203","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","η-cyclopentadienyl-1,2,5,6-η-cyclooctatetraenecobalt'","","- C13 H13 Co -","- C13 H13 Co -","- C52 H52 Co4 -","4","1","JZ1269","Hubert Wadepohl; Rüdiger Merkel; Hans Pritzkow","[(1,2,5,6-η)-Cyclooctatetraene](η^5^-cyclopentadienyl)cobalt","Acta Crystallographica Section C","1998","54","8","1095","1097","10.1107/S0108270198002078","","","0.7107","MoKα","","0.0664","0.0402","","","","0.1042","","","","","","1.024","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007534","9.783","0.002","11.91","0.001","10.395","0.002","90","","99.11","0.01","90","","1195.9","0.4","293","2","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","(2R,3S)-3-Phenyl-2-[(2S,4S)-4-phenyl-3-tosyl-1,3-oxazolidin-2-yl] cyclopentanone","","- C27 H27 N O4 S -","- C27 H27 N O4 S -","- C54 H54 N2 O8 S2 -","2","1","JZ1271","Berger, Bernd; Bolte, Michael","(2<i>R</i>,3<i>S</i>)-3-Phenyl-2-[(2<i>S</i>,4<i>S</i>)-4-phenyl-3-tosyl-1,3-oxazolidin-2-yl]cyclopentanone","Acta Crystallographica Section C","1998","54","8","1106","1107","10.1107/S0108270198002169","","","1.5418","CuKα","","0.032","0.032","","0.086","0.086","","","","1.071","1.073","1.073","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007535","15.1015","0.0001","9.9128","0.0001","16.3279","0.0002","90","","92.359","0.001","90","","2442.19","0.04","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","24,27-diaza-3,6,9,12,15,18-hexaoxa tricyclo [24.4.0.0^20,25^] triaconta-1(26),20,22,24,27,29-hexaene dichloro palladium (II)","","- C22 H30 Cl2 N2 O6 Pd -","- C22 H30 Cl2 N2 O6 Pd -","- C88 H120 Cl8 N8 O24 Pd4 -","4","1","JZ1272","Luis, Santiago V.; Frías, Juan C.; Burguete, M. Isabel; Bolte, Michael","Organization of the Cavity in a Bipyridyl Crown Ether Through Coordination with PdCl~2~","Acta Crystallographica Section C","1998","54","8","1093","1095","10.1107/S0108270198002558","","","0.71073","MoKα","","0.033","0.027","","","","0.067","","","","","","1.138","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007536","8.229","0.003","11.522","0.003","14.43","0.004","66.33","0.02","79.23","0.02","70.08","0.02","1176.1","0.7","298","","294","","","","","","","","","3","P -1","-P 1","2","","9,10-dihydro-1,4-dimethoxy-5,8-dimethyl-cis-9,10-diphenyl- 9,10-anthracenediol","","- C30 H28 O4 -","- C30 H28 O4 -","- C60 H56 O8 -","2","1","JZ1274","Krieger, Claus; Wartini, Alexander R.; Neugebauer, Franz A.","9,10-Dihydro-1,4-dimethoxy-5,8-dimethyl-<i>cis</i>-9,10-diphenyl-9,10-anthracenediol, a Crowded Planar 9,10-Dihydroanthracene","Acta Crystallographica Section C","1998","54","8","1125","1127","10.1107/S0108270198003187","","","0.71073","MoKα","","","0.068","","","0.056","","","","","1.022","1.022","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007537","9.095","0.001","15.624","0.001","18.372","0.001","90","","90","","90","","2610.7","0.4","291","1","291","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","1,1-Bis(3-dimethylamino-1,1-dimethylpropyl)-3,3,5,5-tetramethyl-2,4,6-trioxa- 3,5-disila-1-stannacyclohexane","","- C18 H44 N2 O3 Si2 Sn -","- C18 H44 N2 O3 Si2 Sn -","- C72 H176 N8 O12 Si8 Sn4 -","4","1","JZ1276","Nicole Pieper; Markus Schürmann; Klaus Jurkschat","6,6-Bis[3-(dimethylamino)-1,1-dimethylpropyl]-2,2,4,4-tetramethyl-1,3,5-trioxa-2,4-disila-6-stannacyclohexane","Acta Crystallographica Section C","1998","54","8","1097","1099","10.1107/S0108270198003199","","","0.71069","MoKα","","0.0458","0.0278","","0.0547","0.0509","","","","0.94","0.985","0.985","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007538","9.573","0.002","9.778","0.002","8.562","0.002","90","","97.49","0.03","90","","794.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","ortho-fluorophenyl-thiourea","1-(2-Fluorophenyl)thiourea","","- C7 H7 F N2 S -","- C7 H7 F N2 S -","- C28 H28 F4 N8 S4 -","4","1","JZ1278","Steiner, Thomas","N—H···S and N-H···Ph Hydrogen Bonding in 1-(2-Fluorophenyl)thiourea","Acta Crystallographica Section C","1998","54","8","1121","1123","10.1107/S010827019800242X","","","0.71073","MoKα","","0.044","0.036","","0.1","0.092","","","","1.113","1.111","1.111","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007539","14.916","0.003","9.372","0.002","19.076","0.004","90","","107.64","0.01","90","","2541.3","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Phenformin","1-Phenethylbiguanide hydrochloride (Phenformin)","","- C10 H16 Cl N5 -","- C10 H16 Cl N5 -","- C80 H128 Cl8 N40 -","8","2","KA1267","Soriano-Lesh, Michelle Ann; Holt, Elizabeth M.; Aguirre García, Fermin; Soriano-García, Manuel","1-Phenethylguanidinium Chloride","Acta Crystallographica Section C","1998","54","8","1187","1189","10.1107/S0108270198003321","","","0.71073","MoKα","","0.155","0.071","","0.051","0.041","","","","1.053","1.339","1.339","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007540","6.1373","0.0006","8.979","0.002","13.3554","0.001","90","","96.88","0.005","90","","730.67","0.19","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H14 Br N O -","- C18 H14 Br N O -","- C36 H28 Br2 N2 O2 -","2","1","KA1275","Elmali, Ayhan; Elerman, Yalc̨in; Kendi̇, Engin","<i>N</i>-(2-Bromo-4-methylphenyl)naphthaldimine","Acta Crystallographica Section C","1998","54","8","1137","1139","10.1107/S0108270198002893","","","0.71069","MoKα","","0.07","0.044","","","","0.094","","","","","","1.254","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007541","15.33","0.001","11.829","0.002","11.631","0.002","90","","90.104","0.014","90","","2109.1","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Lead molybdenum oxide: Pb~5~MoO~8~","","- Mo O8 Pb5 -","- Mo O8 Pb5 -","- Mo8 O64 Pb40 -","8","2","NA1328","Vassilev, Peter; Nihtianova, Diana","Pb~5~O~4~MoO~4~","Acta Crystallographica Section C","1998","54","8","1062","1064","10.1107/S0108270198001000","","","0.71073","MoKα","","0.06","0.034","","0.1","","0.076","","","0.981","","","1.076","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007542","6.4494","0.0006","15","0.001","21.334","0.001","90","","90","","90","","2063.9","0.3","293","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","(-)-(2S)-5-(2-Fluorophenyl)-1-methyl-2-(3-thenoylaminomethyl)-2,3-dihydro- 1H-1,4-benzodiazepin-4-ium Chloride","","- C22 H21 Cl F N3 O S -","- C22 H21 Cl F N3 O S -","- C88 H84 Cl4 F4 N12 O4 S4 -","4","1","NA1340","Peeters, Oswald M.; Meurisse, Rita L.; Blaton, Norbert M.; De Ranter, Camiel J.","({-})-(2<i>S</i>)-Tifluadom Hydrochloride and Two of its ({-})-(2<i>S</i>)-2-(Acylaminomethyl)benzodiazepine Hydrochloride Analogues","Acta Crystallographica Section C","1998","54","8","1133","1137","10.1107/S0108270198003412","","","1.54184","CuKα","","0.046","0.045","","0.123","","0.123","","","1.069","","","1.069","","","","has coordinates,has disorder","200177","2020-10-21","18:00:00",""
"2007543","6.3344","0.0002","13.5131","0.0007","25.693","0.002","90","","90","","90","","2199.3","0.2","293","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(-)-(2S)-1,7-Dimethyl-5-phenyl-2-(3-thenoylaminomethyl)-2,3-dihydro-1H- 1,4-benzodiazepin-4-ium Chloride","","- C23 H24 Cl N3 O S -","- C23 H24 Cl N3 O S -","- C92 H96 Cl4 N12 O4 S4 -","4","1","NA1340","Peeters, Oswald M.; Meurisse, Rita L.; Blaton, Norbert M.; De Ranter, Camiel J.","({-})-(2<i>S</i>)-Tifluadom Hydrochloride and Two of its ({-})-(2<i>S</i>)-2-(Acylaminomethyl)benzodiazepine Hydrochloride Analogues","Acta Crystallographica Section C","1998","54","8","1133","1137","10.1107/S0108270198003412","","","1.54184","CuKα","","0.057","0.048","","0.137","","0.137","","","1.042","","","1.042","","","","has coordinates,has disorder","200178","2020-10-21","18:00:00",""
"2007544","11.9932","0.0003","19.667","0.001","12.9428","0.0007","90","","117.471","0.004","90","","2708.6","0.2","293","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","(-)-(2S)-5-(4-Fluorophenyl)-1,8-dimethyl-2-(p-toluoylaminomethyl)-2,3-dihydro- 1H-1,4-benzodiazepin-4-ium Chloride Methyl isobutyl ketone solvate","","- C29 H33 Cl F N3 O1.5 -","- C29 H33 Cl F N3 O1.5 -","- C116 H132 Cl4 F4 N12 O6 -","4","2","NA1340","Peeters, Oswald M.; Meurisse, Rita L.; Blaton, Norbert M.; De Ranter, Camiel J.","({-})-(2<i>S</i>)-Tifluadom Hydrochloride and Two of its ({-})-(2<i>S</i>)-2-(Acylaminomethyl)benzodiazepine Hydrochloride Analogues","Acta Crystallographica Section C","1998","54","8","1133","1137","10.1107/S0108270198003412","","","1.54184","CuKα","","0.038","0.037","","0.105","","0.105","","","1.084","","","1.084","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2007545","11.15","0.002","11.232","0.002","12.176","0.003","65.67","0.02","84.14","0.02","65.641","0.013","1261.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-phenylthio-tetrakis(triethylphosphine)diplatinum(II) hexafluorophosphate","","- C36 H70 F12 P6 Pt2 S2 -","- C36 H70 F12 P6 Pt2 S2 -","- C36 H70 F12 P6 Pt2 S2 -","1","0.5","NA1346","Bruhn, Clemens; Becke, Steffi; Steinborn, Dirk","Di-μ-phenylthio-bis[bis(triethylphosphine-<i>P</i>)platinum(II)] Bis(hexafluorophosphate), [Pt~2~(μ-SPh)~2~(PEt~3~)~4~](PF~6~)~2~","Acta Crystallographica Section C","1998","54","8","1102","1103","10.1107/S0108270198001097","","","0.71073","MoKα","","0.0356","0.0316","","0.0883","0.0825","","","","1.071","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007546","6.524","0.001","7.412","0.001","16.875","0.003","90","","93.72","0.03","90","","814.3","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H24 O3 -","- C20 H24 O3 -","- C40 H48 O6 -","2","1","NA1351","Kuhl, Alexander; Kornath, Andreas; Preut, Hans; Kreiser, Wolfgang","17β-Hydroxymethyl-3-methoxy-19,21-dinorestra-1,3,5(10)-trieno-18,20-lactone","Acta Crystallographica Section C","1998","54","8","1115","1117","10.1107/S0108270198003047","","","0.71069","MoKα","","0.099","0.042","","0.112","0.082","","","","0.856","0.923","0.923","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007547","7.2603","0.0012","9.4959","0.0007","14.0498","0.001","90.273","0.006","99.462","0.011","89.944","0.009","955.45","0.19","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H26 Cu N6 O7 -","- C14 H26 Cu N6 O7 -","- C28 H52 Cu2 N12 O14 -","2","1","OA1033","Lu, Tian-Huey; Tung, Shu-Fang; Chi, Ta-Yung; Chung, Chung-Sun","[7-Methyl-3,7,11,17-tetraazabicyclo[11.3.1]heptadeca-1(17),13,15-triene-κ^4^<i>N</i>](nitrato-κ<i>O</i>)copper(II) Nitrate Hydrate","Acta Crystallographica Section C","1998","54","8","1069","1070","10.1107/S0108270198002947","","","0.7107","MoKα","","0.033","0.033","","0.061","0.061","","","","","1.05","1.05","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007548","10.579","0.003","10.124","0.003","15.147","0.003","90","","90","","90","","1622.3","0.7","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2R, 3R, 4R)- cis-4-acetamido-3-hydroxy-2-dimethoxymethyl-2-methyl- 6-nitro-3,4-dihydro-2H-1-benzopyran","","- C15 H20 N2 O7 -","- C15 H20 N2 O7 -","- C60 H80 N8 O28 -","4","1","OA1040","Yoon, Tae-Sung; Yoo, Sung Eun; Shin, Whanchul","<i>N</i>-(2-Dimethoxymethyl-3-hydroxy-2-methyl-6-nitro-3,4-dihydro-2<i>H</i>-1-benzopyran-4-yl)acetamide","Acta Crystallographica Section C","1998","54","8","1146","1148","10.1107/S0108270198000250","","","0.7107","MoKα","","0.0913","0.047","","0.109","0.083","","","","1.08","1.14","1.14","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007549","8.9245","0.001","14.9611","0.001","15.7331","0.0013","90","","96.184","0.01","90","","2088.5","0.3","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C15 H32 Cl Cu N5 O4 S -","- C15 H32 Cl Cu N5 O4 S -","- C60 H128 Cl4 Cu4 N20 O16 S4 -","4","1","OA1047","Lu, Tian-Huey; Shui, Wei-Ze; Tung, Shu-Fang; Chi, Ta-Yung; Liao, Fen-Ling; Chung, Chung-Sun","(Isothiocyanato-κ<i>N</i>)(1,4,8,11-tetramethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)copper(II) Perchlorate","Acta Crystallographica Section C","1998","54","8","1071","1072","10.1107/S0108270198001711","","","0.7107","MolybdenumKα","","0.041","0.041","","0.053","0.052","","","","","1.13","1.13","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007550","11.28","0.003","13.417","0.002","8.986","0.002","90","","90","","90","","1360","0.5","298","","","","","","","","","","","6","P 2 21 21","P 2bc 2","18","","","","- C16 H28 Cl3 Co N6 O16 -","- C16 H28 Cl2.5 Co0.5 N6 O16 -","- C32 H56 Cl5 Co N12 O32 -","2","0.5","OA1050","Hideaki Kanno; Shunji Utsuno; Junnosuke Fujita; Kinya Iijima","Absolute Configuration of (+)~589~-(4,4'-Dimethoxy-2,2'-bipyridine 1,1'-dioxide-<i>O</i>,<i>O</i>')bis(ethylene-diamine-<i>N</i>,<i>N</i>')cobalt(III) Triperchlorate","Acta Crystallographica Section C","1998","54","8","1083","1085","10.1107/S0108270198002959","","","0.71073","MoKα","","","0.056","","","","0.07","","","","","","1.433","","","","has coordinates,has Fobs","198601","2020-10-21","18:00:00",""
"2007551","11.898","0.003","29.39","0.005","11.634","0.002","90","","90","","90","","4068.2","1.4","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","9-Deoxy-15-hydroxycotylenol","9-Deoxy-15-hydroxycotylenol","","- C21 H34 O4 -","- C21 H34 O4 -","- C168 H272 O32 -","8","2","OA1053","Kato, Nobuo; Li, Feng; Mori, Akira; Takeshita, Hitoshi; Sassa, Takeshi","9-Deoxy-15-hydroxy- and 9-Deoxy-19-hydroxycotylenol","Acta Crystallographica Section C","1998","54","8","1165","1168","10.1107/S010827019800256X","","","1.54184","CuKα","","0.083","0.061","","0.189","0.168","","","","1.055","1.067","1.067","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007552","12.703","0.003","17.141","0.003","9.203","0.001","90","","90","","90","","2003.9","0.6","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","9-Deoxy-19-hydroxycotylenol","9-Deoxy-19-hydroxycotylenol","","- C21 H34 O4 -","- C21 H34 O4 -","- C84 H136 O16 -","4","1","OA1053","Kato, Nobuo; Li, Feng; Mori, Akira; Takeshita, Hitoshi; Sassa, Takeshi","9-Deoxy-15-hydroxy- and 9-Deoxy-19-hydroxycotylenol","Acta Crystallographica Section C","1998","54","8","1165","1168","10.1107/S010827019800256X","","","1.54184","CuKα","","0.066","0.06","","0.182","0.173","","","","1.067","1.06","1.06","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007553","7.392","0.002","8.965","0.006","14.925","0.004","90","","102.9","0.02","90","","964.1","0.7","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 O2 -","- C12 H10 O2 -","- C48 H40 O8 -","4","1","OS1005","Byrne, Janice J.; Chavant, Pierre Y.; Averbuch-Pouchot, Marie-Thérèse; Vallée, Yannick","2,2'-Biphenol","Acta Crystallographica Section C","1998","54","8","1154","1156","10.1107/S0108270198002431","","","0.7107","MoKα","","0.042","0.042","","0.053","0.053","","","","1.768","1.768","1.768","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007554","6.4014","0.0011","9.2804","0.0012","13.606","0.002","90","","93.126","0.018","90","","807.1","0.2","293","2","293","2","","","","","","","","4","A 1 2/m 1","-A 2y","12","Hexaquocobalt(II)-cyclopropane-1,1-hydrogencarboxylate","","","- C10 H22 Co O14 -","- C10 H8 Co O14 -","- C20 H16 Co2 O28 -","2","0.25","OS1008","Schwarz, Thomas; Petri, Alke; Schilling, Joachim; Lentz, Axel","Hexaaquacobalt(II) Bis(hydrogen cyclopropane-1,1-dicarboxylate)","Acta Crystallographica Section C","1998","54","8","1104","1105","10.1107/S0108270198002960","","","0.71073","MoKα","","0.038","0.037","","","","0.107","","","","","","1.21","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007555","8.007","0.001","5.546","0.001","19.289","0.002","90","","95.62","0.01","90","","852.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dimethanolbis(N-nitroso-N-phenyl-hydroxylaminato-O,O')cobalt(II)","","- C14 H18 Co N4 O6 -","- C14 H18 Co N4 O6 -","- C28 H36 Co2 N8 O12 -","2","0.5","QB0041","Andrea Deák; László Párkányi; Alajos Kálmán; Monica Venter; Ionel Haiduc","Dimethanolbis(<i>N</i>-nitroso-<i>N</i>-phenylhydroxylaminato-<i>O</i>,<i>O</i>')cobalt(II)","Acta Crystallographica Section C","1998","54","8","IUC9800036","","10.1107/S0108270198099478","","","0.7107","MoKα","","0.1277","0.0531","","","","0.1331","","","","","","0.875","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007556","9.2118","0.0001","12.0569","0.0002","12.0845","0.0002","104.471","0.001","97.954","0.001","102.247","0.001","1243.77","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H35 N3 Si2 W -","- C22 H35 N3 Si2 W -","- C44 H70 N6 Si4 W2 -","2","1","QB0044","Wang, Shu-Yu S.; Boncella, James M.; Abboud, Khalil A.","[<i>N</i>,<i>N</i>'-Bis(trimethylsilyl)-<i>o</i>-phenylenediamido](1,4-butanediyl)(phenylimido)tungsten(VI), a Deactivation Product from Olefin Metathesis Polymerization","Acta Crystallographica Section C","1998","54","8","IUC9800035","","10.1107/S010827019809948X","","","0.71073","MoKα","","0.0293","0.0244","","","0.0564","0.0588","","","","","","1.055","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007557","6.4346","0.0012","9.837","0.002","13.116","0.002","90","","90.59","0.02","90","","830.2","0.3","158","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S,3R,5S)-2-benzyl-N-(tert-butoxycarbonyl)-3-hydroxy-5-methyl- pyrrolidine","","- C17 H25 N O3 -","- C17 H25 N O3 -","- C34 H50 N2 O6 -","2","1","QB0045","Bats, Jan W.; Heinrich, Timo; Reggelin, Michael","(2<i>S</i>,3<i>R</i>,5<i>S</i>)-2-Benzyl-<i>N</i>-(<i>tert</i>-butoxycarbonyl)-3-hydroxy-5-methylpyrrolidine at 158K","Acta Crystallographica Section C","1998","54","8","IUC9800039","","10.1107/S0108270198099429","","","0.71073","Mo-Kα","","0.0952","0.0607","","","","0.1037","","","","","","1.47","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007558","5.6316","0.0004","12.498","0.002","23.592","0.002","90","","90","","90","","1660.5","0.3","158","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S,3S,5R)-2-benzyl-N-(tert-butoxycarbonyl)-3-hydroxy-5-methyl- pyrrolidine","","- C17 H25 N O3 -","- C17 H25 N O3 -","- C68 H100 N4 O12 -","4","1","QB0046","Bats, Jan W.; Heinrich, Timo; Reggelin, Michael","(2<i>S</i>,3<i>S</i>,5<i>R</i>)-2-Benzyl-<i>N</i>-(<i>tert</i>-butoxycarbonyl)-3-hydroxy-5-methylpyrrolidine at 158K","Acta Crystallographica Section C","1998","54","8","IUC9800038","","10.1107/S0108270198099430","","","0.71073","Mo-Kα","","0.097","0.0537","","","","0.0878","","","","","","1.256","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007559","12.799","0.001","19.842","0.002","6.079","0.001","90","","90","","90","","1543.8","0.3","292","","292","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Bis-ethanediammoniumchloride tetrachloromercurate","","- C4 H20 Cl6 Hg N4 -","- C4 H20 Cl6 Hg N4 -","- C16 H80 Cl24 Hg4 N16 -","4","0.5","QB0047","Spengler, Roland; Zouari, Ridha; Ben Salah, Abdelhamid; Zimmermann, Helmuth; Burzlaff, Hans","Redetermination of Bis(1,2-ethanediammonium) Dichloride Tetrachloromercurate(II)","Acta Crystallographica Section C","1998","54","8","IUC9800034","","10.1107/S0108270198099491","","","0.70926","MoKα1","","","0.04","","","0.052","","","","","0.97","0.97","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007560","11.761","0.003","12.102","0.004","13.371","0.003","89.28","0.04","74.76","0.02","63.8","0.04","1635.7","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tris(1,2-diammonium,2-methylpropan) cyclohexaphosphate trihydrate","","- C12 H48 N6 O21 P6 -","- C12 H43 N6 O21 P6 -","- C24 H86 N12 O42 P12 -","2","1","QB0051","Charfi, Miriem; Jouini, Amor; Pierrot, Marcel","Disorder in Tris(2-methyl-1,2-propanediammonium) <i>cyclo</i>-Hexaphosphate Trihydrate","Acta Crystallographica Section C","1998","54","8","IUC9800041","","10.1107/S0108270198099417","","","0.71069","MoKα","","0.0532","0.046","","0.1363","0.1322","","","","1.096","1.141","1.141","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007561","11.749","0.002","6.849","0.002","12.592","0.002","90","","91.8","0.03","90","","1012.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Piperazinium dihydrogendiphosphate","","- C4 H14 N2 O7 P2 -","- C4 H14 N2 O7 P2 -","- C16 H56 N8 O28 P8 -","4","1","QB0052","Charfi, Miriem; Jouini, Amor; Pierrot, Marcel","Piperazine-1,4-diium Dihydrogendiphosphate","Acta Crystallographica Section C","1998","54","8","IUC9800042","","10.1107/S0108270198099405","","","0.71069","MoKα","","0.0376","0.0323","","0.0896","0.0867","","","","1.071","1.113","1.113","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007562","8.3429","0.0004","11.0878","0.0004","12.1128","0.0005","102.095","0.001","107.863","0.001","98.02","0.001","1017.49","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(di(n-propyl)dithiocarbamate) Nickel(II)","","- C14 H28 N2 Ni S4 -","- C14 H28 N2 Ni S4 -","- C28 H56 N4 Ni2 S8 -","2","1","QB0053","Jian, Fang-Fang; Wang, Zuo-Xiang; Fun, Hoong-Kun; Bai, Zhi-Ping; You, Xiao-Zeng; Razak, Ibrahim Abdul; Chinnakali, Kandasamy","A New Polymorph of Bis(di-<i>n</i>-propyldithiocarbamato-<i>S</i>,<i>S</i>')nickel(II)","Acta Crystallographica Section C","1998","54","8","IUC9800044","","10.1107/S0108270198099442","","","0.71073","MoKα","","0.065","0.042","","","","0.115","","","","","","1.055","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2007563","12.9452","0.0015","12.9452","0.0015","7.0747","0.0015","90","","90","","90","","1185.6","0.3","150","2","150","2","","","","","","","","5","I -4","I -4","82","Tetraphenylphosphonium tetrachloroaluminate","","","- C24 H20 Al Cl4 P -","- C24 H20 Al Cl4 P -","- C48 H40 Al2 Cl8 P2 -","2","0.25","QB0056","Neil Burford; Daren J. LeBlanc; Alan J. Lough","Tetraphenylphosphonium Tetrachloroaluminate","Acta Crystallographica Section C","1998","54","8","IUC9800040","","10.1107/S0108270198099454","","","0.71073","MoKα","","0.0727","0.0467","","","","0.0999","","","","","","0.993","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007564","8.8978","0.0003","13.7057","0.0004","7.5532","0.0002","90","","115.867","0.001","90","","828.83","0.04","300","2","300","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Feldspar","","","- Fe Ge3 K O8 -","- Fe Ge3 K O8 -","- Fe4 Ge12 K4 O32 -","4","0.5","QB0058","Lévy, David; Barbier, Jacques","A Sanidine Feldspar Analogue: KFeGe~3~O~8~","Acta Crystallographica Section C","1998","54","8","IUC9800043","","10.1107/S0108270198099508","","","0.71073","MoKα","","0.053","0.036","","0.077","0.071","","","","1.138","1.175","1.175","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007565","7.8972","0.0011","11.571","0.003","12.429","0.003","111.582","0.006","96.749","0.003","91.662","0.003","1045.6","0.4","180","","180","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H22 Cl Co N4 O9 -","- C18 H22 Cl Co N4 O9 -","- C36 H44 Cl2 Co2 N8 O18 -","2","1","QB0059","Caravan, P.; Orvig, Chris; Rettig, Steven J.","[<i>N</i>,<i>N</i>'-Bis(2-pyridylmethyl)ethylenediaminediacetato]cobalt(III) Perchlorate Monohydrate","Acta Crystallographica Section C","1998","54","8","IUC9800037","","10.1107/S0108270198099466","","","0.7107","MoKα","","0.0902","0.037","","0.0753","","0.0753","","","1.115","","","1.115","","","","has coordinates","189124","2020-10-21","18:00:00",""
"2007566","12.415","0.002","10.806","0.002","13.253","0.003","90","","102.83","0.03","90","","1733.6","0.6","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","","","7-(4-methyl-1-piperazinyl)-6H-[1]benzopyrano[3,4-c]quinoline","","- C21 H21 N3 O -","- C21 H21 N3 O -","- C84 H84 N12 O4 -","4","1","SK1085","Giorgi, Gianluca; Cappelli, Andrea; Anzini, Maurizio; Vomero, Salvatore","Characterization of Quinoline Derivatives. II. 7-(4-Methyl-1-piperazinyl)-6<i>H</i>-[1]benzopyrano[3,4-<i>c</i>]quinoline","Acta Crystallographica Section C","1998","54","8","1127","1130","10.1107/S0108270198003941","","","0.71073","MoKα","","0.085","0.046","","0.136","","0.108","","","1.022","","","1.092","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2007567","10.564","0.005","6.268","0.002","15.878","0.006","90","","107.94","0.02","90","","1000.2","0.7","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H23 N3 O7 -","- C21 H23 N3 O7 -","- C42 H46 N6 O14 -","2","1","SK1178","Carl Epple; Christian Leumann; Helen Stoeckli-Evans","(1'<i>S</i>,5'<i>S</i>,6'<i>R</i>,8'<i>S</i>)-1-[(6'-Acetoxy-8'-hydroxy-2'-oxabicyclo[3.2.1]oct-5'-yl)oxymethyl]-<i>N</i>^4^-benzoylcytosine","Acta Crystallographica Section C","1998","54","8","1141","1143","10.1107/S010827019800184X","","","0.71073","MoKα","","0.0726","0.0473","","","","0.1458","","","","","","0.912","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007568","12.87","0.002","15.06","0.002","16.575","0.002","84.07","0.02","84.122","0.015","77.77","0.02","3112.2","0.8","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","2,2,4,4,6,6-Hexaphenylcyclotrisiloxane","","- C36 H30 O3 Si3 -","- C36 H30 O3 Si3 -","- C144 H120 O12 Si12 -","4","2","SK1181","Ziemer, Burkhard; Backer, Michael; Auner, Norbert","A Triclinic Polymorph of Hexaphenylcyclotrisiloxane","Acta Crystallographica Section C","1998","54","8","1111","1113","10.1107/S0108270198003205","","","0.71073","MoKα","","0.051","0.036","","0.097","0.091","","","","0.932","1.035","1.035","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007569","7.178","0.002","14.268","0.003","14.795","0.003","90","","90","","90","","1515.2","0.6","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-Hydroxy-18-methyl-17-oxaestra-1,3,5(10)-trien-16-one","","- C18 H22 O3 -","- C18 H22 O3 -","- C72 H88 O12 -","4","1","SX1029","Slobodanka Stanković; Dušan Lazar; Vjera Pejanović; Julijana Petrović; Christian Courseille","<small>D</small>-Secoestrone Derivatives. IV. 3-Hydroxy-18-methyl-17-oxaestra-1,3,5(10)-trien-16-one","Acta Crystallographica Section C","1998","54","8","1158","1160","10.1107/S0108270197019161","","","1.54178","CuKα","","0.0793","0.0428","","0.1855","0.0889","","","","1.133","1.224","1.224","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007570","14.59","0.001","8.857","0.001","16.674","0.001","90","","90.22","0.01","90","","2154.7","0.3","299","2","299","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H23 N3 -","- C27 H23 N3 -","- C108 H92 N12 -","4","1","SX1063","de Silva, Saliya A.; Whitener, Mark A.; Baron, David E.; Zavaleta, Andres; Isidor, Edward V.; Allam, Osama","(9-Anthrylmethyl)bis(2-pyridylmethyl)amine","Acta Crystallographica Section C","1998","54","8","1117","1119","10.1107/S0108270198002728","","","0.71073","MoKα","","0.109","0.055","","0.156","0.123","","","","1.009","1.071","1.071","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007571","11.675","0.001","14.738","0.002","6.261","0.001","90","","90","","90","","1077.3","0.2","299","2","299","2","","","","","","","","4","P n a 21","P 2c -2n","33","","3-[[(2-Aminoethyl)imino]methyl]-4-hydroxybenzoic acid 0.28 hydrate","","- C10 H12.56 N2 O3.28 -","- C10 H12 N2 O3.277 -","- C40 H48 N8 O13.108 -","4","1","SX1066","Whitener, Mark A.; de Freitas, Cyrene Bolt; Zavaleta, Andres","3-[(2-Aminoethyl)iminomethyl]-4-hydroxybenzoic Acid 0.28-Hydrate","Acta Crystallographica Section C","1998","54","8","1119","1121","10.1107/S010827019800273X","","","0.71073","MoKα","","0.07","0.043","","0.119","0.104","","","","1.056","1.127","1.127","","","","","has coordinates","194049","2020-10-21","18:00:00",""
"2007572","13.323","0.002","7.8005","0.0009","15.324","0.002","90","","110.499","0.008","90","","1491.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","pptphe","N-tert-butyloxycarbonyl-N-benzylglycine","","- C14 H19 N O4 -","- C14 H19 N O4 -","- C56 H76 N4 O16 -","4","1","SX1067","Doi, Mitsunobu; Kinoshita, Kazue; Asano, Akiko; Yoneda, Ryuji; Kurihara, Takushi; Ishida, Toshimasa","<i>N</i>-Benzyl-<i>N</i>-(<i>tert</i>-butyloxycarbonyl)glycine, an <i>N</i>-Substituted Glycine (Peptoid) Monomer","Acta Crystallographica Section C","1998","54","8","1164","1165","10.1107/S0108270198002741","","","1.5418","CuKα","","0.095","0.068","","0.288","0.183","","","","1.167","1.176","1.176","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007573","3.8588","0.0001","3.8588","0.0001","29.6561","0.0007","90","","90","","90","","441.589","0.019","300","2","300","2","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- K2 Nd2 O10 Ti3 -","- K2 Nd2 O10 Ti3 -","- K4 Nd4 O20 Ti6 -","2","0.0625","TA1188","Amow, Gisele; Greedan, J. E.","The Layered Perovskite K~2~Nd~2~Ti~3~O~10~","Acta Crystallographica Section C","1998","54","8","1053","1055","10.1107/S0108270198002145","","","0.71073","MoKα","","0.028","0.026","","0.067","0.064","","","","1.129","1.13","1.13","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007574","6.9174","0.0004","7.4267","0.0004","12.0693","0.0007","90","","98.206","0.003","90","","613.69","0.06","158","2","158","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-bis(3-pyridinoxy)benzene","1,4-bis(3-pyridinoxy)benzene","","- C16 H12 N2 O2 -","- C16 H12 N2 O2 -","- C32 H24 N4 O4 -","2","0.5","TA1207","McMorran, David A.; Steel, Peter J.","1,4-Bis(3-pyridyloxy)benzene","Acta Crystallographica Section C","1998","54","8","1132","1133","10.1107/S0108270198003059","","","0.71073","MoKα","","","0.037","","","","0.105","","","","","","1.09","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007575","18.951","0.001","9.104","0.001","20.842","0.002","90","","100.01","0.01","90","","3541.1","0.6","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","(1,4-bis(diphenylphosphino-k,P,P')butane)(N,N'-diethyldithiocarbamato)- nickel(II) perchlorate.","","- C33 H38 Cl N Ni O4 P2 S2 -","- C33 H38 Cl N Ni O4 P2 S2 -","- C132 H152 Cl4 N4 Ni4 O16 P8 S8 -","4","1","AB1521","Ramalingam,Kuppukkannu; Shawkataly, Omar bin; Fun, Hoong-Kun; Ibrahim,Abdul Razak","[1,4-Bis(diphenylphosphino)butane-<i>P</i>,<i>P</i>'](<i>N</i>,<i>N</i>'-diethyldithiocarbamato-<i>S</i>,<i>S</i>')nickel(II) Perchlorate","Acta Crystallographica Section C","1998","54","9","1223","1225","10.1107/S0108270198001917","","","0.71073","MoKα","","0.0713","0.0441","","0.1314","0.1193","","","","0.945","1.076","1.076","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007576","6.933","0.004","7.826","0.004","11.969","0.007","90","","104.05","0.05","90","","630","0.6","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Potassium hydroxypropanedioate","","- C3 H2 K2 O5 -","- C3 H2 K2 O5 -","- C12 H8 K8 O20 -","4","1","AV1017","Taka, Jun-ichiro; Kashino, Setsuo","Potassium Tartronate and Ammonium Tartronate","Acta Crystallographica Section C","1998","54","9","1257","1259","10.1107/S0108270198004065","","","0.71073","MoKα","","","0.031","","","","0.034","","","","","","1.96","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007577","8.012","0.003","7.638","0.003","10.842","0.005","90","","90","","90","","663.5","0.5","295","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","Ammonium hydroxypropanedioate","","- C3 H10 N2 O5 -","- C3 H10 N2 O5 -","- C12 H40 N8 O20 -","4","1","AV1017","Taka, Jun-ichiro; Kashino, Setsuo","Potassium Tartronate and Ammonium Tartronate","Acta Crystallographica Section C","1998","54","9","1257","1259","10.1107/S0108270198004065","","","0.71073","MoKα","","","0.039","","","","0.038","","","","","","1.26","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007578","12.681","0.003","12.145","0.002","22.107","0.004","90","","90.35","0.03","90","","3404.7","1.2","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","","","","","- C33 H34 N6 Ni2 O11 -","- C16.5 H16 N3 Ni O5.5 -","- C66 H64 N12 Ni4 O22 -","4","1","BM1200","Koman, Marian; Baloghová, Zuzana; Valigura, Dušan","Structural Investigation of Nickel(II) Complexes. XIII. μ-[2,3,5,6-Tetra-(2-pyridyl)pyrazine]-bis-[bis(acetato)aquanickel(II)]‒Formaldehyde (1/1)","Acta Crystallographica Section C","1998","54","9","1277","1279","10.1107/S0108270198003631","","","0.71073","MoKα","","0.1092","0.0494","","0.1694","0.1184","","","","0.955","0.992","0.992","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007579","16.031","0.002","17.942","0.003","11.25","0.003","90","","90","","90","","3235.8","1.1","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","trans-2,3,5,7,15-pentaacetoxy jatroph 6(17),11-DIENE-9,14-DIONE","E-(-)-(2R,3R,4R,5S,7R,13R,15R)- 2,3,5,7,15-Pentaacetoxy-2,10,10,13-tetramethyl- 6-methylene-bicyclo[10.3.0] pentadec-11-en-9,14-dione","","- C30 H40 O12 -","- C30 H40 O12 -","- C120 H160 O48 -","4","1","BM1208","Kar, Tanusree; Bhattacharyya, Kinkini; Mazumdar, Sunil Kumar; Bocelli, Gabriele; Hohmann, Judit","<i>trans</i>-2,3,5,7,15-Pentaacetoxyjatropha-6(17),11-diene-9,14-dione, a Diterpene Oligoester","Acta Crystallographica Section C","1998","54","9","1287","1289","10.1107/S010827019800393X","","","1.5418","CuKα","","0.1067","0.0765","","0.2801","0.2228","","","","1.037","1.258","1.258","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007580","13.61","0.004","8.286","0.001","19.848","0.004","90","","93.74","0.02","90","","2233.5","0.8","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium (1-Pyrrolidinecarbodithioate-S,S')(tetrathiotungstenio-S,S')-nickelate(1-)","","- C13 H28 N2 Ni S6 W -","- C13 H28 N2 Ni S6 W -","- C52 H112 N8 Ni4 S24 W4 -","4","1","BM1219","De-Liang Long; Qing-Hua Wang; Jin-Shun Huang","Tetraethylammonium (1-Pyrrolidinecarbodithioato-<i>S</i>,<i>S</i>')(tetrathiotungstenio-<i>S</i>,<i>S</i>')nickelate(1 ‒)","Acta Crystallographica Section C","1998","54","9","1251","1253","10.1107/S0108270198004296","","","0.71073","MoKα","","","0.037","","","0.047","","","","","0.69","0.69","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007581","9.2751","0.0017","10.39","0.0016","14.08","0.002","98.503","0.012","106.398","0.014","99.953","0.014","1254","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(di-2-pyridylamine)(propionato)copper(II) Chloride Monohydrate","","- C23 H25 Cl Cu N6 O3 -","- C23 H25 Cl Cu N6 O3 -","- C46 H50 Cl2 Cu2 N12 O6 -","2","1","BM1221","Sujittra Youngme; Kitisak Poopasit; Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak; Suchada Chantrapromma","Bis(di-2-pyridyl-<i>N</i>-amine)(propionato-<i>O</i>)copper(II) Chloride Monohydrate","Acta Crystallographica Section C","1998","54","9","1221","1223","10.1107/S0108270198003618","","","0.71073","MoKα","","0.0702","0.05","","0.1477","0.1388","","","","0.994","1.121","1.121","","","","","has coordinates,has disorder","199607","2020-10-21","18:00:00",""
"2007582","11.885","0.003","8.004","0.002","33.795","0.007","90","","90.59","0.02","90","","3214.7","1.3","143","2","143","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(4-Chlorophenyl)-2-amino-5,6-dihydro-benzo[f]quinoline-3-carbonitrile","","- C20 H14 Cl N3 -","- C20 H14 Cl N3 -","- C160 H112 Cl8 N24 -","8","2","BM1235","Elgemeie, Galal E.H.; Fathy, Nahed M.; Jones, Peter G.","2-Amino-4-(4-chlorophenyl)-5,6-dihydrobenzo[<i>h</i>]quinoline-3-carbonitrile, a Strongly Fluorescent Phenanthridine Analogue","Acta Crystallographica Section C","1998","54","9","1314","1316","10.1107/S0108270198003813","","","0.71073","MoKα","","0.0676","0.044","","0.1071","0.0928","","","","1.044","1.057","1.057","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007583","5.5431","0.0005","8.909","0.0006","45.893","0.004","90","","90","","90","","2266.4","0.3","220","","220","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-hydroxyacetophenone anil","","- C14 H13 N O -","- C14 H13 N O -","- C112 H104 N8 O8 -","8","1","BM1237","Leardini, Rino; McDougald, Graham; McNab, Hamish; Nanni, Daniele; Parsons, Simon","Methyl-and Phenyl-Substituted Salicylideneanilines","Acta Crystallographica Section C","1998","54","9","1360","1362","10.1107/S0108270198004302","","","1.5418","CuKα","","","0.0603","","","0.0735","","","","","1.0892","1.0892","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007584","18.339","0.003","9.642","0.001","16.323","0.002","90","","90.26","0.02","90","","2886.3","0.7","220","","220","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-hydroxybenzophenone anil","","- C19 H15 N O -","- C19 H15 N O -","- C152 H120 N8 O8 -","8","1","BM1237","Leardini, Rino; McDougald, Graham; McNab, Hamish; Nanni, Daniele; Parsons, Simon","Methyl-and Phenyl-Substituted Salicylideneanilines","Acta Crystallographica Section C","1998","54","9","1360","1362","10.1107/S0108270198004302","","","1.5418","CuKα","","","0.0437","","","0.0476","","","","","1.126","1.126","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007585","15.883","0.002","7.233","0.001","7.718","0.001","90","","90.29","0.01","90","","886.6","0.2","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Titano nonaoxodiarséniate de tétrasodium","","- As2 Na4 O9 Ti -","- As2 Na4 O9 Ti -","- As8 Na16 O36 Ti4 -","4","0.5","BR1184","Yaakoubi, Arbia; Jouini, Tahar","Na~4~TiAs~2~O~9~","Acta Crystallographica Section C","1998","54","9","1200","1202","10.1107/S010827019701994X","","","0.71069","MoKα","","0.077","0.036","","0.097","0.076","","","","1.154","1.135","1.135","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007586","3.6848","0.0002","3.6848","","10.552","0.0005","90","","90","","90","","143.272","0.01","292","","292","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- C B2 Er Rh2 -","- C B2 Er Rh1.838 -","- C2 B4 Er2 Rh3.676 -","2","0.0625","BR1189","Ye, Jinhua; Shishido, Toetsu; Kimura, Takashi; Matsumoto, Takehiko; Fukuda, Tsuguo","End Member of the Rhodium-Based Quaternary Borocarbides, ErRh~2~B~2~C","Acta Crystallographica Section C","1998","54","9","1211","1214","10.1107/S0108270198003035","","","0.7107","MoKα","","","0.019","","","0.02","","","","","1.7","1.7","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007587","6.712","0.002","6.892","0.002","7.855","0.002","94.27","0.02","114.47","0.02","114.79","0.02","286.39","0.17","295.2","","295.2","","","","","","","","","4","P -1","-P 1","2","divanadium managanese tellurite","","","- Mn O7 Te V2 -","- Mn O7 Te V2 -","- Mn2 O14 Te2 V4 -","2","1","BR1206","Feger, Christopher R.; Kolis, Joseph W.","V~2~MnTeO~7~","Acta Crystallographica Section C","1998","54","9","1217","1219","10.1107/S010827019800448X","","","0.7107","MoKα","","0.036","0.028","","0.036","0.035","","","","","1.14","1.14","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007588","16.923","0.002","14.783","0.002","17.6634","0.0013","90","","90","","90","","4418.9","0.9","163","2","163","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","tetra-n-butylammonium trinitromethane","tetra-n-butylammonium trinitromethanide","","- C17 H36 N4 O6 -","- C17 H36 N4 O6 -","- C136 H288 N32 O48 -","8","1","BR1207","Bryan, Jeffrey C.; Burnett, Michael N.; Gakh, Andrei A.","Tetrabutylammonium and Caesium Salts of Trinitromethane","Acta Crystallographica Section C","1998","54","9","1229","1233","10.1107/S0108270198004491","","","0.71073","MoKα","","0.043","0.043","","0.127","","0.127","","","1.03","1.13","1.13","","","","","has coordinates,has disorder","200221","2020-10-21","18:00:00",""
"2007589","8.1023","0.0005","8.3297","0.0004","9.4897","0.0009","90","","99.208","0.006","90","","632.2","0.08","163","2","163","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","caesium trinitromethane","caesium trinitromethanide","","- C Cs N3 O6 -","- C Cs N3 O6 -","- C4 Cs4 N12 O24 -","4","1","BR1207","Bryan, Jeffrey C.; Burnett, Michael N.; Gakh, Andrei A.","Tetrabutylammonium and Caesium Salts of Trinitromethane","Acta Crystallographica Section C","1998","54","9","1229","1233","10.1107/S0108270198004491","","","0.71073","MoKα","","0.018","0.018","","0.047","","0.047","","","1.09","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007590","16.6","0.003","13.12","0.003","7.96","0.002","90","","109.23","0.03","90","","1636.9","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","[6-(4,5-dimethyl-1,3-dithiole-2-ylidene)-5,7-dioxo-6,7-dihydro-5H-dibenzo- [a.c]cycloheptene]","","- C20 H14 O2 S2 -","- C20 H14 O2 S2 -","- C80 H56 O8 S8 -","4","0.5","CF1132","Khodorkovsky, Vladimir; Ellern, Arkady; Moldavsky, Vadim","New Examples of Donor‒Acceptor Conjugated Systems Involving the 1,3-Dithiole Moiety","Acta Crystallographica Section C","1998","54","9","1364","1367","10.1107/S0108270198000602","","","0.71073","MoKα","","0.088","0.043","","0.109","0.099","","","","0.749","0.969","0.969","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007591","10.519","0.002","25.456","0.005","20.319","0.004","90","","92.03","0.03","90","","5437.4","1.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","[6-(4,5-tetramethylene-1,3-dithiole-2-ylidene)-5,7-dioxo-6,7- dihydro-5H-dibenzo[a.c]cycloheptene]","","- C22 H16 O2 S2 -","- C22 H16 O2 S2 -","- C264 H192 O24 S24 -","12","1.5","CF1132","Khodorkovsky, Vladimir; Ellern, Arkady; Moldavsky, Vadim","New Examples of Donor‒Acceptor Conjugated Systems Involving the 1,3-Dithiole Moiety","Acta Crystallographica Section C","1998","54","9","1364","1367","10.1107/S0108270198000602","","","0.71073","MoKα","","0.101","0.059","","0.171","0.132","","","","1.088","1.121","1.121","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007592","8.11","0.001","10.045","0.002","30.67","0.003","90","","90.8","0.3","90","","2498.3","0.7","294","","294","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H24 Cl2 N4 O2 S -","- C27 H24 Cl2 N4 O2 S -","- C108 H96 Cl8 N16 O8 S4 -","4","1","CF1198","Benelbaghdadi, Rachida; Benharref, Ahmed; Hasnaoui, Aïssa; Lavergne, Jean-Pierre; Giorgi, Michel; Pierrot, Marcel","Some 1,3-Dipolar Adducts from Benzodiazepine. II. Condensation of Nitrilimines with [1,4]Benzodiazepine and [1,4]Benzodiazepin-2-one","Acta Crystallographica Section C","1998","54","9","1343","1345","10.1107/S0108270198003825","","","0.71073","Mo_Kα","","0.132","0.047","","","0.062","","","","","1.655","1.655","","","","","has coordinates,has Fobs","278324","2022-10-03","14:41:53",""
"2007593","10.8058","0.0003","11.1736","0.0003","16.7577","0.0005","93.7","0.001","90.732","0.001","100.238","0.001","1986.35","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tris(diethyldithiocarbamato-S,S')- tris(μ^2^-η~2~-disulfido)(μ~3~-sulfido)trimolybdenum(IV) (3Mo—Mo) diethyldithiocarbamate","","- C20 H40 Mo3 N4 S15 -","- C20 H36 Mo3 N4 S15 -","- C40 H72 Mo6 N8 S30 -","2","1","CF1227","Hong-Ping Zhu; Chang-Neng Chen; Qiu-Tian Liu; Jiu-Tong Chen","A Triangular [Mo~3~S~7~]^4+^ Complex: Tris(diethyldithiocarbamato-<i>S</i>,<i>S</i>')tris(μ~2~-η^2^-disulfido)(μ~3~-sulfido)trimolybdenum(IV)(3 <i>Mo</i>—<i>Mo</i>)Diethyldithiocarbamate","Acta Crystallographica Section C","1998","54","9","1273","1275","10.1107/S0108270198003643","","","0.71073","MoKα","","0.033","0.03","","0.09","0.082","","","","0.845","0.802","0.802","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007594","13.074","0.002","17.354","0.002","13.794","0.004","90","","90","","90","","3129.7","1.1","293","","293","","","","","","","","","6","C m c 21","C 2c -2","36","","Bis(1,4-dimethyl-1,4,7-triazacyclononanyl)-μ-aqua- μ-acetato-μ-hydroxodicopper(II) perchlorate","","- C18 H44 Cl2 Cu2 N6 O12 -","- C18 H42 Cl2 Cu2 N6 O12 -","- C72 H168 Cl8 Cu8 N24 O48 -","4","0.5","CF1241","Elliot, David J.; Martin, Lisandra L.; Taylor, Max R.","μ-Acetato-μ-aqua-μ-hydroxo-bis[(1,4-dimethyl-1,4,7-triazacyclononane-κ^3^<i>N</i>)copper(II)] Diperchlorate","Acta Crystallographica Section C","1998","54","9","1259","1261","10.1107/S0108270198004375","","","0.71073","MoKα","","0.041","0.039","","0.092","0.09","","","","1.705","1.706","1.706","","","","","has coordinates","192027","2020-10-21","18:00:00",""
"2007595","15.3046","0.001","14.5739","0.001","6.4175","0.0006","90","","90","","90","","1431.41","0.19","180","2","180","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","7-Methyl-3,7,11,17-tetra-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene","","- C14 H24 N4 -","- C14 H24 N4 -","- C56 H96 N16 -","4","0.5","CF1244","Corden, Jonathan P.; Errington, William; Moore, Peter; Wallbridge, Malcolm G.H.","7-Methyl-3,7,11,17-tetraazabicyclo[11.3.1]heptadeca-1(17),13,15-triene","Acta Crystallographica Section C","1998","54","9","1327","1329","10.1107/S0108270198004387","","","0.71073","MoKα","","0.0658","0.0479","","","","0.1222","","","","","","1.162","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007596","7.185","0.001","11.3264","0.0008","13.443","0.001","90","","93.48","0.01","90","","1091.98","0.19","294.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H12 B F2 N O -","- C11 H12 B F2 N O -","- C44 H48 B4 F8 N4 O4 -","4","1","DE1049","Itoh, Kuniaki; Fujimoto, Miki; Hashimoto, Masao","1-Difluoroboronyloxy-3-(<i>N</i>-methylimino)-1-phenyl-1-butene and its Two Photoproducts","Acta Crystallographica Section C","1998","54","9","1324","1327","10.1107/S0108270197004332","","","0.7107","MoKα","","","0.057","","","0.038","","","","","3.14","3.14","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2007597","6.043","0.002","11.192","0.002","15.715","0.002","90","","99.76","0.01","90","","1047.5","0.4","294.2","","294.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 B2 F4 N2 O2 -","- C22 H24 B2 F4 N2 O2 -","- C44 H48 B4 F8 N4 O4 -","2","0.5","DE1049","Itoh, Kuniaki; Fujimoto, Miki; Hashimoto, Masao","1-Difluoroboronyloxy-3-(<i>N</i>-methylimino)-1-phenyl-1-butene and its Two Photoproducts","Acta Crystallographica Section C","1998","54","9","1324","1327","10.1107/S0108270197004332","","","0.7107","MoKα","","","0.052","","","0.037","","","","","1.64","1.64","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007598","14.685","0.002","8.679","0.003","17.769","0.003","90","","111.75","0.01","90","","2103.5","0.9","289.2","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C22 H24 B2 F4 N2 O2 -","- C22 H24 B2 F4 N2 O2 -","- C88 H96 B8 F16 N8 O8 -","4","1","DE1049","Itoh, Kuniaki; Fujimoto, Miki; Hashimoto, Masao","1-Difluoroboronyloxy-3-(<i>N</i>-methylimino)-1-phenyl-1-butene and its Two Photoproducts","Acta Crystallographica Section C","1998","54","9","1324","1327","10.1107/S0108270197004332","","","0.7107","MoKα","","","0.0848","","","0.0518","","","","","1.341","1.341","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2007599","8.0599","0.001","8.419","0.001","8.4446","0.0008","78.078","0.009","78.886","0.011","61.473","0.007","489.63","0.1","295","2","","","","","","","","","","4","P -1","-P 1","2","","8-Ammonioquinolinium dichloride","","- C9 H10 Cl2 N2 -","- C9 H10 Cl2 N2 -","- C18 H20 Cl4 N4 -","2","1","DE1080","Yaw Kai Yan; Ngoh Khang Goh; Lian Ee Khoo","8-Ammonioquinolinium Dichloride","Acta Crystallographica Section C","1998","54","9","1322","1324","10.1107/S0108270198003977","","","0.71073","MoKα","","","0.0275","","","","0.0835","","","","","","1.051","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007600","18.005","0.003","7.497","0.003","11.796","0.002","90","","90","","90","","1592.3","0.7","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Vanadyl diarsénovanadate de césium","","- As2.54 Cs2 O17 V4.46 -","- As2.54 Cs2 O17 V4.46 -","- As10.16 Cs8 O68 V17.84 -","4","0.5","DU1175","Haddad, Amor; Boughzala, Habib; Jouini, Tahar","Cs~2~V~3~(As~0,635~V~0,365~)~4~O~17~","Acta Crystallographica Section C","1998","54","9","1202","1204","10.1107/S0108270197007415","","","0.71069","RadiationMoKα","","0.0606","0.0307","","0.0682","0.0592","","","","1.133","1.183","1.183","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007601","10.263","0.002","10.27","0.002","20.42","0.002","90","","98.38","0.03","90","","2129.3","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- O22 Rb5 Sb7 Ti -","- O22 Rb5 Sb7 Ti -","- O88 Rb20 Sb28 Ti4 -","4","0.5","FG1383","Almgren, Jenni; Svensson, Göran; Albertsson, Jörgen","Rubidium Antimony(V) Titanium Oxide, Rb~5~Sb~7~TiO~22~","Acta Crystallographica Section C","1998","54","9","1206","1209","10.1107/S0108270198003837","","","0.71073","MoKα","","0.0872","0.0499","","0.1004","0.0871","","","","1.273","1.323","1.323","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007602","8.582","0.002","11.313","0.002","16.251","0.003","74.75","0.03","87.29","0.03","83.16","0.03","1511.2","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H27 Fe2 N3 O21 -","- C21 H25 Fe2 N3 O21 -","- C42 H50 Fe4 N6 O42 -","2","1","FG1421","Abboud, Khalil A.; Xu, Cheng; Drago, Russell S.","Triaqua(pyridine-2,6-dipicolinato-<i>O</i>,<i>N</i>,<i>O</i>')iron(III) Bis(pyridine-2,6-dipicolinato-<i>O</i>,<i>N</i>,<i>O</i>')iron(III) Hexahydrate: an Unusual Ion-Pair Compound","Acta Crystallographica Section C","1998","54","9","1270","1273","10.1107/S0108270198000183","","","0.71073","MoKα","","0.045","0.035","","","0.092","0.097","","","","","","1.037","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007603","21.558","0.004","6.5897","0.0012","18.861","0.002","90","","111.891","0.01","90","","2486.2","0.7","150","1","150","1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3-Hydroxy-2,16-dioxatetracyclo[9.4.0.0^3,8^.1^1,8^]hexadecane","","- C14 H22 O3 -","- C14 H22 O3 -","- C112 H176 O24 -","8","1","FG1423","Parvez, Masood; Sultana, Naheed; Sarfaraz, Tahira B.; Husain, Shaheen A.","10,16-Dioxatetracyclo[7.6.1.0^1,11^.0^4,9^]hexadecan-11-ol","Acta Crystallographica Section C","1998","54","9","1285","1287","10.1107/S0108270198003849","","","0.71069","MoKα","","0.0925","0.0399","","0.1251","0.0964","","","","1.014","1.055","1.055","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007604","15.8782","0.0011","5.784","0.0009","17.1481","0.0009","90","","107.535","0.004","90","","1501.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","S-(ethenyl)-S-phenyl-N-(p-tolylsulfonyl)sulfoximine","","- C15 H15 N O3 S2 -","- C15 H15 N O3 S2 -","- C60 H60 N4 O12 S8 -","4","1","FG1428","Briggs, Andrew D.; Clegg, William; Elsegood, Mark R.J.; Frampton, Christopher S.; Jackson, Richard F.W.","Conformational Variations in Vinylsulfoximines","Acta Crystallographica Section C","1998","54","9","1335","1341","10.1107/S0108270198004508","","","0.71069","MoKα","","0.04","0.03","","","","0.081","","","","","","1.081","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2007605","35.6712","0.0018","5.8847","0.0019","15.4068","0.0015","90","","90.737","0.007","90","","3233.8","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(E)-S-(propenyl)-S-phenyl-N-(p-tolylsulfonyl)sulfoximine","","- C16 H17 N O3 S2 -","- C16 H17 N O3 S2 -","- C128 H136 N8 O24 S16 -","8","1","FG1428","Briggs, Andrew D.; Clegg, William; Elsegood, Mark R.J.; Frampton, Christopher S.; Jackson, Richard F.W.","Conformational Variations in Vinylsulfoximines","Acta Crystallographica Section C","1998","54","9","1335","1341","10.1107/S0108270198004508","","","0.71069","MoKα","","0.06","0.038","","","","0.111","","","","","","1.03","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2007606","10.37","0.002","9.9267","0.0018","19.9997","0.0016","90","","94.285","0.01","90","","2053","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(E)-S-(2-cyclohexylethenyl)-S-phenyl-N-(p-tolylsulfonyl)sulfoximine","","- C21 H25 N O3 S2 -","- C21 H25 N O3 S2 -","- C84 H100 N4 O12 S8 -","4","1","FG1428","Briggs, Andrew D.; Clegg, William; Elsegood, Mark R.J.; Frampton, Christopher S.; Jackson, Richard F.W.","Conformational Variations in Vinylsulfoximines","Acta Crystallographica Section C","1998","54","9","1335","1341","10.1107/S0108270198004508","","","0.71069","MoKα","","0.06","0.038","","","","0.104","","","","","","1.026","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007607","9.968","0.003","11.6851","0.0014","18.509","0.004","90","","90","","90","","2155.9","0.8","160","2","160","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(E)-S-phenyl-S-(4-phenylbut-1-enyl)-N-(p-tolylsulfonyl)sulfoximine","","- C23 H23 N O3 S2 -","- C23 H23 N O3 S2 -","- C92 H92 N4 O12 S8 -","4","1","FG1428","Briggs, Andrew D.; Clegg, William; Elsegood, Mark R.J.; Frampton, Christopher S.; Jackson, Richard F.W.","Conformational Variations in Vinylsulfoximines","Acta Crystallographica Section C","1998","54","9","1335","1341","10.1107/S0108270198004508","","","0.71073","MoKα","","0.083","0.035","","","","0.095","","","","","","1.024","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007608","13.876","0.007","21.926","0.008","9.363","0.002","97.05","0.03","91.78","0.03","99.83","0.03","2781.7","1.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(E)-S-(2-trimethylsilylphenyl)-S-(3-methyl-1-trimethylsilylbut-1-enyl)- N-(p-tolylsulfonyl)sulfoximine","","- C24 H37 N O3 S2 Si2 -","- C24 H37 N O3 S2 Si2 -","- C96 H148 N4 O12 S8 Si8 -","4","2","FG1428","Briggs, Andrew D.; Clegg, William; Elsegood, Mark R.J.; Frampton, Christopher S.; Jackson, Richard F.W.","Conformational Variations in Vinylsulfoximines","Acta Crystallographica Section C","1998","54","9","1335","1341","10.1107/S0108270198004508","","","0.71069","MoKα","","0.057","0.036","","","","0.109","","","","","","1.044","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007609","11.142","0.003","17.128","0.004","15.541","0.004","90","","100.35","0.03","90","","2917.6","1.3","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(E)-S-(2-trimethylsilylphenyl)-S-(2-phenyl-1-trimethylsilylethenyl)- N-(p-tolylsulfonyl)sulfoximine","","- C27 H35 N O3 S2 Si2 -","- C27 H35 N O3 S2 Si2 -","- C108 H140 N4 O12 S8 Si8 -","4","1","FG1428","Briggs, Andrew D.; Clegg, William; Elsegood, Mark R.J.; Frampton, Christopher S.; Jackson, Richard F.W.","Conformational Variations in Vinylsulfoximines","Acta Crystallographica Section C","1998","54","9","1335","1341","10.1107/S0108270198004508","","","0.71073","MoKα","","0.103","0.068","","","","0.227","","","","","","1.013","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007610","11.019","0.002","17.093","0.004","11.044","0.003","90","","99.73","0.03","90","","2050.2","0.8","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(E)-S-(1-trimethylsilylprop-1-enyl)-S-phenyl-N-(p-tolylsulfonyl)sulfoximine","","- C19 H25 N O3 S2 Si -","- C19 H25 N O3 S2 Si -","- C76 H100 N4 O12 S8 Si4 -","4","1","FG1428","Briggs, Andrew D.; Clegg, William; Elsegood, Mark R.J.; Frampton, Christopher S.; Jackson, Richard F.W.","Conformational Variations in Vinylsulfoximines","Acta Crystallographica Section C","1998","54","9","1335","1341","10.1107/S0108270198004508","","","0.71073","MoKα","","0.076","0.047","","","","0.149","","","","","","1.197","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007611","9.747","0.002","10.648","0.002","15.418","0.003","90","","90","","90","","1600.2","0.5","160","2","160","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","phenyl vinylsulfone","","- C8 H8 O2 S -","- C8 H8 O2 S -","- C64 H64 O16 S8 -","8","1","FG1428","Briggs, Andrew D.; Clegg, William; Elsegood, Mark R.J.; Frampton, Christopher S.; Jackson, Richard F.W.","Conformational Variations in Vinylsulfoximines","Acta Crystallographica Section C","1998","54","9","1335","1341","10.1107/S0108270198004508","","","0.71073","MoKα","","0.039","0.03","","","","0.087","","","","","","1.054","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007612","9.057","0.002","11.092","0.003","7.299","0.002","106.31","0.02","108.15","0.02","77.88","0.02","662.7","0.3","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H32 Fe N2 O10 -","- C24 H32 Fe N2 O10 -","- C24 H32 Fe N2 O10 -","1","0.5","FG1437","Okabe, Nobuo; Makino, Tomomi","<i>trans</i>-Diaquabis(2-quinolinecarboxylato-<i>N</i>,<i>O</i>)iron(II)‒Ethanol‒Water (1/2/2)","Acta Crystallographica Section C","1998","54","9","1279","1280","10.1107/S0108270198004739","","","0.71069","MoKα","","","0.068","","","0.089","","","","","1.68","1.68","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007613","17.441","0.002","10.9569","0.0012","10.756","0.003","90","","107.69","0.011","90","","1958.3","0.6","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(N-Methyl-N-benzyl)carbamoyl-1,2,4- trimethylquinolinium iodide","","- C21 H23 I N2 O -","- C21 H23 I N2 O -","- C84 H92 I4 N8 O4 -","4","1","FG1441","Lutz, Martin; Spek, Anthony L.","3-(<i>N</i>-Benzyl-<i>N</i>-methylcarbamoyl)-1,2,4-trimethylquinolinium Iodide","Acta Crystallographica Section C","1998","54","9","1291","1292","10.1107/S010827019800314X","","","0.71073","MoKα","","0.033","0.029","","","","0.085","","","","","","1.136","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007614","13.9138","0.0016","8.2036","0.0013","14.555","0.002","90","","99.836","0.01","90","","1636.9","0.4","295","","295","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H25 Br2 Mg N O -","- C10 H23.9 Br2 Mg N O -","- C40 H95.6 Br8 Mg4 N4 O4 -","4","1","FG1446","Henderson, Kenneth W.; Kennedy, Alan R.","Dibromo(diethyl ether-<i>O</i>)(diisopropylamine-<i>N</i>)magnesium(II)","Acta Crystallographica Section C","1998","54","9","1238","1240","10.1107/S0108270198003655","","","0.71069","MoKα","","0.112","0.033","","","","0.096","","","","","","0.986","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2007615","9.703","0.001","5.582","0.001","12.765","0.001","90","","97.9","0.01","90","","684.82","0.15","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","3-oxo-1-cyclohexene-1-carboxylic acid","3-oxo-1-cyclohexene-1-carboxylic acid","","- C7 H8 O3 -","- C7 H8 O3 -","- C28 H32 O12 -","4","1","FG1448","Barcon, Alan; Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","3-Oxo-1-cyclohexene-1-carboxylic Acid: Catemeric Hydrogen Bonding and Flexional Ring Disorder in a γ-Keto Acid","Acta Crystallographica Section C","1998","54","9","1282","1285","10.1107/S0108270198004740","","","0.71073","MoKα","","0.084","0.048","","0.137","0.117","","","","1.06","1.15","1.15","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007616","13.488","0.005","10.113","0.003","22.223","0.01","90","","98.78","0.02","90","","2996","2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H29 K O6 Se8 W -","- C17 H29 K O6 Se8 W -","- C68 H116 K4 O24 Se32 W4 -","4","1","FG1451","Thöne, Carsten; Jones, Peter G.; Laube, Jörg; Jäger, Stefan","Organometallic Selenolates. IX. (18-Crown-6)-potassium (η^5^-cyclopentadienyl)bis(1,4-tetraselenido-<i>Se</i>^1^,<i>Se</i>^4^)tungstate(IV)","Acta Crystallographica Section C","1998","54","9","1247","1249","10.1107/S0108270198004752","","","0.71073","MoKα","","0.146","0.065","","0.164","0.135","","","","0.92","1.077","1.077","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007617","18.049","0.001","8.637","0.001","13.908","0.001","90","","128.25","0.05","90","","1702.7","1.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H18 Cl O2 P S -","- C16 H18 Cl O2 P S -","- C64 H72 Cl4 O8 P4 S4 -","4","0.5","FR1051","Aygün, Muhittin.; Işík, Şamil.; Odabaşoǧlu, Mustafa; Tahir,M.Nawaz; Erdönmez, Ahmet.; Büyükgüngör, Orhan.","Bis(2,6-dimethylphenyl) Chlorothiophosphate","Acta Crystallographica Section C","1998","54","9","1345","1347","10.1107/S0108270198003291","","","0.71069","MoKα","","0.0342","0.0313","","0.0872","0.0856","","","","1.141","1.178","1.178","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007618","20.977","0.003","5.2741","0.0004","15.406","0.002","90","","121.422","0.007","90","","1454.5","0.3","298","","0","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","triammonium dizinc vanadium diphosphate di(hydrogen phosphate)","","- H14 N3 O16 P4 V Zn2 -","- N3 O16 P4 V Zn2 -","- N12 O64 P16 V4 Zn8 -","4","0.5","FR1102","Bircsak, Zsolt; Harrison, William T. A.","Ammonium Zinc Vanadium Phosphate, (NH~4~)~3~Zn~2~V(PO~4~)~2~(HPO~4~)~2~","Acta Crystallographica Section C","1998","54","9","1197","1200","10.1107/S0108270198003667","","","0.71073","MoKα","","","0.038","","","0.036","","","","","1.92","1.92","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007619","7.173","0.002","8.841","0.002","9.458","0.002","65.08","0.02","70.68","0.02","69.59","0.02","497.7","0.2","298","","298","","","","","","","","","5","P -1","-P 1","2","","triamonium trivanadium(III) hexakis(hydrogen phosphate)","","- H18 N3 O24 P6 V3 -","- H14 N3 O24 P6 V3 -","- H14 N3 O24 P6 V3 -","1","0.5","FR1104","Bircsak, Zsolt; Harrison, William T. A.","α-Ammonium Vanadium Hydrogen Phosphate, α-(NH~4~)V(HPO~4~)~2~","Acta Crystallographica Section C","1998","54","9","1195","1197","10.1107/S0108270198002856","","","0.71073","MoKα","","","0.033","","","0.037","","","","","1.096","1.096","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007620","9.614","0.004","10.664","0.004","12.26","0.003","112.37","0.03","100.77","0.03","90.2","0.03","1138","0.8","295","","","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H52 Mn N6 Ni2 O10 -","- C44 H52 Mn N6 Ni2 O10 -","- C44 H52 Mn N6 Ni2 O10 -","1","0.5","FR1111","Ercan, Filiz; Atakol, Orhan","A Linear Trinuclear Ni^II^‒Mn^II^‒Ni^II^ Complex with a μ-Acetato Bridge: Bis{(μ-acetato)[μ-bis(salicylidene)-1,3-propanediaminato](<i>N</i>,<i>N</i>-dimethylformamide)nickel(II)}manganese(II)","Acta Crystallographica Section C","1998","54","9","1268","1270","10.1107/S0108270198003679","","","0.71073","MoKα","","","0.031","","","0.04","","","","","1.1","1.1","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007621","12.661","0.005","13.816","0.006","7.93","0.002","96.44","0.03","96.71","0.03","109.5","0.03","1281.6","0.9","295","","295","","","","","","","","","5","P -1","-P 1","2","","N,N'-ethylenebis(3-t-butyl-5-methyl-salicylideneaminato)oxovanadium(IV)","","- C26 H34 N2 O3 V -","- C26 H34 N2 O3 V -","- C52 H68 N4 O6 V2 -","2","1","FR1114","Haas, Geoffrey; Schimek, George L.; Pennington, William T.; Kolis, Joseph W.","[<i>N</i>,<i>N</i>'-Ethylenebis(3-<i>tert</i>-butyl-5-methylsalicylideneaminato)]oxovanadium(IV)","Acta Crystallographica Section C","1998","54","9","1263","1265","10.1107/S0108270198003990","","","0.7107","MoKα","","0.1256","0.0648","","0.0616","","0.0572","","","","","","1.88","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007622","11.059","0.003","7.862","0.002","21.828","0.004","90","","97.17","0.02","90","","1883","0.8","295","2","295","2","","","","","","","","7","C 1 c 1","C -2yc","9","","Sodium ethylenediamminetetraacetato μ-oxo-μ-sulfido bisoxomolybdenum(V) dihydrate","","- C10 H16 Mo2 N2 Na2 O13 S -","- C10 H12 Mo2 N2 Na2 O13 S -","- C40 H48 Mo8 N8 Na8 O52 S4 -","4","1","FR1115","Valente, Edward J.; Zubkowski, Jeffrey D.; Hicks, Kenneth W.","Na~2~[(μ-<i>N</i>,<i>N</i>'-C~10~H~12~N~2~O~8~)(μ-O)(μ-S)Mo~2~O~2~].2H~2~O","Acta Crystallographica Section C","1998","54","9","1265","1268","10.1107/S0108270198003163","","","0.71073","MoKα","","0.086","0.047","","","","0.115","","","0.788","","","0.788","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007623","5.2789","0.0012","25.266","0.011","7.139","0.003","90","","103.49","0.03","90","","925.9","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","cyclodecanol","cyclodecanol","","- C10 H20 O -","- C10 H20 O -","- C40 H80 O4 -","4","1","FR1118","Valente, Edward J.; Pawar, Diwakar M.; Noe, Eric A.","Cyclodecanol","Acta Crystallographica Section C","1998","54","9","1302","1304","10.1107/S0108270198003308","","","0.71073","MoKα","","0.172","0.056","","","","0.138","","","","","","0.6","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007624","8.945","0.001","11.472","0.001","14.649","0.002","90","","106.36","0.01","90","","1442.4","0.3","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","6,6'-dimethylbiphenyl-2,2'-dicarboxylic acid","","","- C16 H14 O4 -","- C16 H14 O4 -","- C64 H56 O16 -","4","1","FR1132","Gerkin, Roger E.","6,6'-Dimethylbiphenyl-2,2'-dicarboxylic Acid (6,6'-Dimethyldiphenic Acid)","Acta Crystallographica Section C","1998","54","9","1369","1372","10.1107/S0108270198005204","","","0.71073","MoKα","","","0.052","","","0.084","","","","","1.61","1.61","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007625","7.7244","0.0006","9.9912","0.0014","13.82","0.003","90","","91.006","0.011","90","","1066.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Chloro-7-(carboxymethyl)purine Ethyl Ester","","- C9 H9 Cl N4 O2 -","- C9 H9 Cl N4 O2 -","- C36 H36 Cl4 N16 O8 -","4","1","HA1208","Sood, Geeta; Schwalbe, Carl H.; Fraser, William","7-(Carboxymethyl)-6-chloropurine Ethyl Ester","Acta Crystallographica Section C","1998","54","9","1316","1318","10.1107/S010827019800345X","","","1.54178","CuKα","","0.038","0.034","","0.082","0.079","","","","1.071","1.085","1.085","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007626","22.036","0.004","9.243","0.002","19.816","0.003","90","","90","","90","","4036.1","1.3","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","Bistitanium (IV) tetraisopropoxide di-μ-isopropoxide di-2,4,6-trimethylphenoxide","","- C36 H64 O8 Ti2 -","- C36 H64 O8 Ti2 -","- C144 H256 O32 Ti8 -","4","0.5","HA1214","James, Siân C.; Norman, Nicholas C.; Orpen, A. Guy","[Ti~2~(O-2,4,6-Me~3~C~6~H~2~)~2~(O^<i>i^</i>Pr)~4~(μ-O^<i>i^</i>Pr)~2~]","Acta Crystallographica Section C","1998","54","9","1261","1263","10.1107/S0108270198003461","","","0.71073","MoKα","","0.1","0.056","","0.172","0.15","","","","0.977","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007627","8.2983","0.0001","14.6086","0.0002","29.1258","0.0004","90","","90","","90","","3530.82","0.08","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-(2-bromo-4-methylphenyl)-4-methyl-7,8,9,10-tetrahydro-7,8-benzocoumarine- 8,9-aziridine","","- C21 H18 Br N O2 -","- C21 H18 Br N O2 -","- C168 H144 Br8 N8 O16 -","8","1","HA1215","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan; Ibrahim Abdul Razak","An <i>N</i>-Substituted 6,7-Benzocoumarin-8,9-aziridine Derivative","Acta Crystallographica Section C","1998","54","9","1299","1301","10.1107/S0108270198003874","","","0.71073","MoKα","","0.0863","0.0479","","0.1088","0.0927","","","","1.065","1.144","1.144","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007628","23.9096","0.0007","9.5192","0.0003","11.9629","0.0003","90","","112.136","0.001","90","","2522.07","0.13","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H13 N O3 S -","- C13 H13 N O3 S -","- C104 H104 N8 O24 S8 -","8","1","HA1219","Goswami, Shyamaprosad; Ajit Kumar Mahapatra; Gur Dayal Nigam; Chinnakali, Kandasamy; Fun, Hoong-Kun","<i>N</i>-(3-Hydroxyphenyl)-<i>p</i>-toluenesulfonamide","Acta Crystallographica Section C","1998","54","9","1301","1302","10.1107/S010827019800479X","","","0.71073","MoKα","","0.045","0.036","","0.102","0.096","","","","1.058","1.084","1.084","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007629","11.636","0.002","8.232","0.001","11.086","0.002","90","","128.71","0.01","90","","828.6","0.3","294","","294","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ni O12 P4 Zn -","- Ni0.5 O12 P4 Zn0.5 -","- Ni2 O48 P16 Zn2 -","4","0.5","JZ1265","Bettach, M.; Benkhouja, K.; Zahir, M.; Rissouli, K.; Sadel, A.; Giorgi, M.; Pierrot, M.","A Mixed Zinc‒Nickel <i>cyclo</i>-Tetraphosphate, ZnNiP~4~O~12~","Acta Crystallographica Section C","1998","54","9","1209","1211","10.1107/S0108270198003886","","","0.71073","MoKα","","0.069","0.031","","","0.041","","","","","1.227","1.227","","","","","has coordinates,has Fobs","176342","2020-10-21","18:00:00",""
"2007630","9.8205","0.001","10.9505","0.001","25.645","0.002","90","","90","","90","","2757.8","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","11α-hydroxy-28-methoxy-28-oxo-2,3-dinor-18β-olean-12-en-1,4-olide","","- C29 H46 O6 -","- C29 H44 O6 -","- C116 H176 O24 -","4","1","JZ1266","Gzella, Andrzej; Zaprutko, Lucjusz; Wrzeciono, Urszula","Triterpenoide. XIII. Über weitere neue Triterpenlactone","Acta Crystallographica Section C","1998","54","9","1309","1312","10.1107/S0108270198003540","","","1.54178","CuKα","","0.05","0.043","","0.133","0.122","","","","1.061","1.042","1.042","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007631","6.58","0.001","12.1344","0.001","32.338","0.002","90","","90","","90","","2582","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","28-methoxy-28-oxo-1,2-dinor-10α,18β-oleano-9,12-dien-3,10β-olide","","- C29 H42 O4 -","- C29 H42 O4 -","- C116 H168 O16 -","4","1","JZ1266","Gzella, Andrzej; Zaprutko, Lucjusz; Wrzeciono, Urszula","Triterpenoide. XIII. Über weitere neue Triterpenlactone","Acta Crystallographica Section C","1998","54","9","1309","1312","10.1107/S0108270198003540","","","1.54178","CuKα","","0.041","0.033","","0.102","0.094","","","","1.053","1.038","1.038","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007632","20.074","0.002","6.488","0.003","7.18","0.004","90","","96.68","0.02","90","","928.8","0.7","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H9 N O3 -","- C11 H9 N O3 -","- C44 H36 N4 O12 -","4","1","JZ1267","Okabe, Nobuo; Adachi, Yukari","2-Hydroxy-3-(1<i>H</i>-indol-3-yl)propenoic Acid","Acta Crystallographica Section C","1998","54","9","1330","1331","10.1107/S0108270198003175","","","0.71069","MoKα","","","0.059","","","0.12","","","","","1.66","1.66","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007633","8.1023","0.0008","9.7724","0.001","5.5763","0.0008","90","","121.9","0.08","90","","374.8","0.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","caesium oxo-antimonate(III)","","- Cs O2 Sb -","- Cs O2 Sb -","- Cs4 O8 Sb4 -","4","0.5","JZ1279","Hirschle, Christian; Röhr, Caroline","Caesium Dioxoantimonate(III), CsSbO~2~","Acta Crystallographica Section C","1998","54","9","1219","1220","10.1107/S010827019800331X","","","0.7107","MoK~α~","","0.039","0.0383","","","","0.1072","","","","","","1.135","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007634","10.835","0.002","20.834","0.003","7.85","0.002","90","","103","0.02","90","","1726.6","0.6","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Chloro-3-(4-chloro-2-methyl-1,3-oxazol-5-yl)-1H-indole-1-carboxylic Acid 2,2,2-Trichloroethyl ester","","- C15 H9 Cl5 N2 O3 -","- C15 H9 Cl5 N2 O3 -","- C60 H36 Cl20 N8 O12 -","4","1","JZ1281","Radspieler, Alexander; Ziemer, Burkhard; Liebscher, Jürgen","Twisted Structure of a Substituted 2-Chloro-3-(4-chloro-2-methyl-1,3-oxazol-5-yl)-1<i>H</i>-indole","Acta Crystallographica Section C","1998","54","9","1351","1353","10.1107/S0108270198004351","","","0.71073","MoKα","","0.035","0.0286","","0.0775","0.075","","","","1.033","1.094","1.094","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007635","10.8948","0.001","7.7476","0.001","13.2634","0.001","90","","114.283","0.01","90","","1020.5","0.2","133","","133","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H13 Br N2 Si -","- C6 H13 Br N2 Si -","- C24 H52 Br4 N8 Si4 -","4","1","JZ1282","Hensen, Karl; Kettner, Markus; Bolte, Michael","<i>N</i>-Trimethylsilylimidazole Hydrobromide at 133K","Acta Crystallographica Section C","1998","54","9","1312","1314","10.1107/S010827019800362X","","","0.71073","MoKα","","0.0527","0.0382","","0.096","0.0891","","","","1.057","1.095","1.095","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007636","14.7592","0.0015","10.7763","0.0011","10.0983","0.0007","90","","92.473","0.007","90","","1604.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(2-ethylpyridine-N)(N-salicylideneglycinato-O,N,O`)copper(II)","","- C16 H18 Cu N2 O4 -","- C16 H18 Cu N2 O4 -","- C64 H72 Cu4 N8 O16 -","4","1","JZ1284","Warda, Salam A.","Aqua(2-ethylpyridine-<i>N</i>)(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1998","54","9","1236","1238","10.1107/S0108270198004673","","","0.71073","MoKα","","0.0737","0.0426","","","","0.095","","","","0.968","0.968","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007637","9.847","0.003","10.242","0.003","10.866","0.003","90","","101.4","0.04","90","","1074.2","0.6","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3,6'-dimethoxy-1',2'α,3'β,4'-tetrahydroquinolino[3',2':16,17]estra-1,3,5(10)- triene","","- C27 H33 N O2 -","- C27 H33 N O2 -","- C54 H66 N2 O4 -","2","1","KA1260","Bes, M. Teresa; Usón, Isabel; Pelikán, Szilvia; Tietze, Lutz F.; Frank, Éva; Schneider, Gyula","A Hexacyclic Estrone Derivative","Acta Crystallographica Section C","1998","54","9","1341","1343","10.1107/S0108270198002881","","","0.71073","MoKα","","0.037","0.036","","0.102","0.101","","","","1.016","1.015","1.015","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007638","9.147","0.002","13.36","0.002","9.379","0.002","90","","113.83","0.02","90","","1048.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di(perchlorato-O)- [(5RS,6RS,12SR,13SR)-5,6,12,13-tetramethyl-1,4,8,11-tetraazacyclotetradecane- κ^4^N]copper(II)","","- C14 H32 Cl2 Cu N4 O8 -","- C14 H26 Cl2 Cu N4 O8 -","- C28 H52 Cl4 Cu2 N8 O16 -","2","0.5","KA1262","Lu, Tian-Huey; Panneerselvam, Kaliyamoorthy; Huang, Chin-Sun; Chung, Chung-Sun; Tung, Shu-Fang","Two Conformational (Configurational) Isomers of Diperchlorato[(5<i>RS</i>,6<i>RS</i>,12<i>SR</i>,13<i>SR</i>)-5,6,12,13-tetramethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>]copper(II)","Acta Crystallographica Section C","1998","54","9","1240","1242","10.1107/S0108270198003710","","","0.71073","MoKα","","0.102","0.051","","0.13","0.118","","","","0.99","1.167","1.167","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007639","9.291","0.001","7.957","0.002","8.093","0.002","90","","103.11","0.01","90","","582.7","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,4 diaminobutane tetrabromopalladate","","- C4 H14 Br4 N2 Pd -","- C4 H14 Br4 N2 Pd -","- C8 H28 Br8 N4 Pd2 -","2","0.5","LN1029","Zouari, Rhida; Leger, Jean Michel; Maris,Thierry; Chanh, N. B.","1,4-Butanediammonium Tetrabromopalladate(II)","Acta Crystallographica Section C","1998","54","9","1253","1255","10.1107/S0108270198003473","","","0.71073","MoKα","","0.039","0.025","","","","0.074","","","","","","1.223","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007640","16.9681","0.001","16.9681","0.001","6.5473","0.0006","90","","90","","120","","1632.5","0.2","100","2","100","2","","","","","","","","3","P 65","P 65","170","","(2S,3R,5S)-3-Hydroxy-2-methyl-5-(1-methylethenyl)cyclohexanone Diethyl Ether Solvate","","- C10.48 H17.2 O2.12 -","- C10 H16 O2 -","- C60 H96 O12 -","6","1","LN1051","Lutz, Martin; Spek, Anthony L.","(2<i>S</i>,3<i>R</i>,5<i>S</i>)-3-Hydroxy-2-methyl-5-(1-methylethenyl)cyclohexanone 0.12-Diethyl Ether Solvate","Acta Crystallographica Section C","1998","54","9","1293","1295","10.1107/S0108270198003783","","","0.71073","MoKα","","0.0328","0.0301","","","","0.0836","","","","","","1.051","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007641","16.599","0.002","13.957","0.002","18.105","0.003","90","","95.929","0.012","90","","4172","1","294","1","294","1","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","2-methoxy-3-methyl-6-[(triphenylphosphoranylidene)amino]pyrimidin-4(3H)-one","","- C24 H22 N3 O2 P -","- C24 H22 N3 O2 P -","- C192 H176 N24 O16 P8 -","8","1","LN1053","Low, John N.; Ferguson, George; Cobo, Justo; Nogueras, Manuel; Sanchez, Adolfo; Marchal, Antonio","2-Methoxy-3-methyl-6-[(triphenylphosphoranylidene)amino]pyrimidin-4(3<i>H</i>)-one and 3-Methyl-2-methylthio-6-[(triphenylphosphoranylidene)amino]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section C","1998","54","9","1355","1357","10.1107/S0108270198003795","","","0.7107","MolybdenumKα","","0.1092","0.0392","","0.1128","0.1007","","","","0.964","1.207","1.207","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007642","8.666","0.002","10.985","0.003","12.373","0.003","79.291","0.012","75.62","0.02","70.693","0.014","1069.8","0.5","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","2-methylthio-3-methyl-6-[(triphenylphosphoranylidene)amino]pyrimidin-4(3H)- one","","- C24 H22 N3 O P S -","- C24 H22 N3 O P S -","- C48 H44 N6 O2 P2 S2 -","2","1","LN1053","Low, John N.; Ferguson, George; Cobo, Justo; Nogueras, Manuel; Sanchez, Adolfo; Marchal, Antonio","2-Methoxy-3-methyl-6-[(triphenylphosphoranylidene)amino]pyrimidin-4(3<i>H</i>)-one and 3-Methyl-2-methylthio-6-[(triphenylphosphoranylidene)amino]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section C","1998","54","9","1355","1357","10.1107/S0108270198003795","","","0.7107","MolybdenumKα","","0.0679","0.0647","","0.1641","0.1617","","","","1.084","1.132","1.132","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007643","8.0862","0.0019","12.576","0.004","8.186","0.002","90","","98.441","0.019","90","","823.4","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C2 H9 B Cu F4 N2 O2 -","- C2 H9 B Cu F4 N2 O2 -","- C8 H36 B4 Cu4 F16 N8 O8 -","4","1","MU1344","Cronin, Leroy; Harper, Miriam, C; Walton, Paul H.; Lindsay, Chris","<i>catena</i>-Poly[diamminecopper(II)-μ-acetato-<i>O</i>:<i>O</i>'] Tetrafluoroborate","Acta Crystallographica Section C","1998","54","9","1255","1257","10.1107/S0108270198004594","","","0.71069","MoKα","","0.0454","0.0383","","","","0.1055","","","","","","1.053","","","","has coordinates","249787","2020-10-21","18:00:00",""
"2007644","10.802","0.003","12.896","0.008","14.936","0.006","90","","90","","90","","2080.6","1.6","296","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H27 N O2 -","- C23 H27 N O2 -","- C92 H108 N4 O8 -","4","1","NA1240","Camalli, Mercedes; Pifferi, Augusto; Palmieri, Gianni","Enantiopure δ-Hydroxy-β-enamino Ketones","Acta Crystallographica Section C","1998","54","9","1306","1309","10.1107/S0108270196011985","","","0.71069","MoKα","","0.09","0.058","","0.152","0.086","","","","","1.178","1.178","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007645","27.132","0.005","27.132","0.005","8.29","0.004","90","","90","","120","","5285","3","296","","","","","","","","","","","4","R 3 :H","R 3","146","","","","- C24 H33 N O3 -","- C24 H30 N O3 -","- C216 H270 N9 O27 -","9","1","NA1240","Camalli, Mercedes; Pifferi, Augusto; Palmieri, Gianni","Enantiopure δ-Hydroxy-β-enamino Ketones","Acta Crystallographica Section C","1998","54","9","1306","1309","10.1107/S0108270196011985","","","1.5418","CuKα","","0.06","0.055","","0.084","0.074","","","","","0.997","0.997","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007646","13.148","0.005","5.834","0.001","6.501","0.002","90","","90","","90","","498.7","0.3","293","2","293","2","","","","","","","","6","P m n 21","P 2ac -2","31","bis(thiourea)cadmium chloride","Bis(thiourea)cadmium Chloride","","- C2 H8 Cd Cl2 N4 S2 -","- C2 H8 Cd Cl2 N4 S2 -","- C4 H16 Cd2 Cl4 N8 S4 -","2","0.5","NA1330","Celia Marcos; José M. Alía; Victor Adovasio; Manuel Prieto; Santiago García-Granda","Bis(thiourea)cadmium Halides","Acta Crystallographica Section C","1998","54","9","1225","1229","10.1107/S0108270198004314","","","0.71073","MoKα","","0.0258","0.0177","","0.0428","0.0397","","","","1.053","1.008","1.008","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007647","13.052","0.018","5.9892","0.0019","13.542","0.003","90","","90","","90","","1058.6","1.5","293","2","293","2","","","","","","","","6","P n a m","-P 2c 2n","62","bis(thiourea)cadmium chloride","Bis(thiourea)cadmium bromide","","- C2 H8 Br2 Cd N4 S2 -","- C2 H8 Br2 Cd N4 S2 -","- C8 H32 Br8 Cd4 N16 S8 -","4","0.5","NA1330","Celia Marcos; José M. Alía; Victor Adovasio; Manuel Prieto; Santiago García-Granda","Bis(thiourea)cadmium Halides","Acta Crystallographica Section C","1998","54","9","1225","1229","10.1107/S0108270198004314","","","0.71073","MoKα","","0.132","0.0553","","","","0.191","","","","","","1.095","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007648","10.481","0.002","7.64","0.002","15.133","0.004","90","","91","0.02","90","","1211.6","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","bis(thiourea)cadmium iodide","Bis(thiourea)cadmium Iodide","","- C2 H8 Cd I2 N4 S2 -","- C2 H8 Cd I2 N4 S2 -","- C8 H32 Cd4 I8 N16 S8 -","4","1","NA1330","Celia Marcos; José M. Alía; Victor Adovasio; Manuel Prieto; Santiago García-Granda","Bis(thiourea)cadmium Halides","Acta Crystallographica Section C","1998","54","9","1225","1229","10.1107/S0108270198004314","","","0.71073","MoKα","","0.117","0.0505","","","","0.1413","","","","","","1.099","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007649","9.378","0.002","20.241","0.004","12.848","0.003","90","","99.31","0.03","90","","2406.7","0.9","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[Bis((O, μ-O'methyllactato)-dioxovanadate(V))-bis(tetrabuthylammonium)] dihydrate]","","- C40 H88 N2 O12 V2 -","- C40 H88 N2 O12 V2 -","- C80 H176 N4 O24 V4 -","2","0.5","NA1343","Smatanová, Ivana; Marek, Jaromír; Švančárek, Peter; Schwendt, Peter","Bis(tetra-<i>n</i>-butylammonium) Bis[(methyllactato)dioxovanadate(V)] Dihydrate","Acta Crystallographica Section C","1998","54","9","1249","1251","10.1107/S0108270198003424","","","0.71073","MoKα","","0.062","0.046","","0.133","0.12","","","","1","1.015","1.015","","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2007650","16.912","0.001","18.188","0.001","17.872","0.001","90","","91.009","0.004","90","","5496.5","0.5","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(acetylacetonato)(1,10-phenanthroline)cerium(III)","","- C27 H29 Ce N2 O6 -","- C27 H11 Ce N2 O6 -","- C216 H88 Ce8 N16 O48 -","8","2","NA1347","Christidis, Panayiotis C.; Tossidis, Ioannis A.; Paschalidis, Damianos G.; Tzavellas, Leandros C.","Tris(acetylacetonato)(1,10-phenanthroline)cerium(III) and Tris(acetylacetonato)(1,10-phenanthroline)praseodymium(III)","Acta Crystallographica Section C","1998","54","9","1233","1236","10.1107/S0108270198003898","","","0.71073","MoKα","","0.105","0.053","","0.046","0.043","","","","1.49","1.835","1.835","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007651","9.515","0.001","21.086","0.009","14.978","0.002","90","","99.39","0.01","90","","2964.8","1.4","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(acetylacetonato)(1,10-phenanthroline)praseodymium(III)","","- C27 H29 N2 O6 Pr -","- C27 H11 N2 O6 Pr -","- C108 H44 N8 O24 Pr4 -","4","1","NA1347","Christidis, Panayiotis C.; Tossidis, Ioannis A.; Paschalidis, Damianos G.; Tzavellas, Leandros C.","Tris(acetylacetonato)(1,10-phenanthroline)cerium(III) and Tris(acetylacetonato)(1,10-phenanthroline)praseodymium(III)","Acta Crystallographica Section C","1998","54","9","1233","1236","10.1107/S0108270198003898","","","0.71073","MoKα","","0.068","0.043","","0.051","0.045","","","","0.912","0.972","0.972","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007652","10.032","0.002","10.787","0.003","22.947","0.004","90","","90","","90","","2483.2","1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3S,4S,7R)-7-acetoxy-2-(benzensulphonyl)-5-benzyloxy-3-phenyl -2,5-diazaspiro[3,4]octan-1-one","","- C27 H24 N2 O6 S -","- C27 H24 N2 O6 S -","- C108 H96 N8 O24 S4 -","4","1","NA1356","Alessandra Forni","Two Diastereoisomers of 2-(Benzenesulfonyl)-5-benzoyl-1-oxo-3-phenyl-2,5-diazaspiro[3.4]octan-7-yl Acetate","Acta Crystallographica Section C","1998","54","9","1320","1322","10.1107/S0108270198003436","","","0.71073","MoKα","","0.053","0.035","","0.07","0.066","","","","0.896","0.991","0.991","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007653","6.237","0.001","18.928","0.002","21.321","0.003","90","","90","","90","","2517","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(3R,4S,7R)-7-acetoxy-2-(benzensulphonyl)-5-benzyloxy-3-phenyl -2,5-diazaspiro[3,4]octan-1-one","","- C27 H24 N2 O6 S -","- C27 H24 N2 O6 S -","- C108 H96 N8 O24 S4 -","4","1","NA1356","Alessandra Forni","Two Diastereoisomers of 2-(Benzenesulfonyl)-5-benzoyl-1-oxo-3-phenyl-2,5-diazaspiro[3.4]octan-7-yl Acetate","Acta Crystallographica Section C","1998","54","9","1320","1322","10.1107/S0108270198003436","","","0.71073","MoKα","","0.101","0.052","","0.099","0.083","","","","1.013","1.089","1.089","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007654","9.041","0.001","11.242","0.001","11.637","0.001","65.482","0.005","66.853","0.005","73.376","0.005","978.75","0.17","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H60 N12 O6 P4 -","- C28 H60 N12 O6 P4 -","- C28 H60 N12 O6 P4 -","1","0.5","NA1358","Hökelek, Tuncer; Kılıç, Emïne; Kılıç, Zeynel","<i>trans</i>-2,6-Bis(ethylamino)-2,4,4,6,8,8-hexamorpholinocyclo-2λ^5^, 4λ^5^, 6λ^5^, 8λ^5^-tetraphosphazatetraene","Acta Crystallographica Section C","1998","54","9","1295","1297","10.1107/S0108270198004260","","","0.71073","MoKα","","","0.073","","","0.084","","","","","1.07","1.07","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007655","7.537","0.001","16.928","0.001","10.292","0.001","90","","106.044","0.005","90","","1262","0.2","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 N O S2 -","- C14 H13 N O S2 -","- C56 H52 N4 O4 S8 -","4","1","NA1362","Hökelek, Tuncer; Gündüz, Hüseyin; Patır, Süleyman; Nesimi Uludağ","Spiro[carbazole-1(2<i>H</i>),2'-[1,3]dithiolan]-4(3<i>H</i>)-one","Acta Crystallographica Section C","1998","54","9","1297","1299","10.1107/S0108270198005083","","","0.71073","MoKα","","","0.04","","","0.046","","","","","1.01","1.01","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007656","5.4313","0.0005","45.18","0.003","5.0355","0.0005","92.924","0.006","92.317","0.008","92.088","0.006","1232.11","0.19","293.2","","293.2","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H42 N2 O3 -","- C24 H42 N2 O3 -","- C48 H84 N4 O6 -","2","1","OA1032","Amai, Makoto; Endo, Tomohiro; Nagase, Hiromasa; Ueda, Haruhisa; Nakagaki, Masayuki","1:1 Complex of Octadecanoic Acid and 3-Pyridinecarboxamide","Acta Crystallographica Section C","1998","54","9","1367","1369","10.1107/S0108270197019227","","","1.5418","CuKα","","0.064","0.042","","0.056","0.053","","","","2.427","2.428","2.428","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007657","26.965","0.006","26.965","0.006","10.933","0.002","90","","90","","120","","6884","3","293","2","293","2","","","","","","","","3","R -3 :H","-R 3","148","4-(p-hydroxyphenyl)-2,2,4-trimethylchroman","4-(2,2,4-trimethylchroman-4-yl)phenol","","- C18 H20 O2 -","- C18 H20 O2 -","- C324 H360 O36 -","18","1","OA1044","Imashiro, Fumio; Yoshimura, Motohide; Fujiwara, Takaji","`Guest-Free' Dianin's Compound","Acta Crystallographica Section C","1998","54","9","1357","1360","10.1107/S010827019800451X","","","1.5405","CuKα","","0.049","0.037","","0.101","0.092","","","","1.038","1.059","1.059","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007658","23.138","0.005","11.22","0.002","6.882","0.001","90","","93.94","0.02","90","","1782.4","0.6","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H18 N2 O2 -","- C22 H18 N2 O2 -","- C88 H72 N8 O8 -","4","1","OA1045","Hajime Irikawa; Kinya Iijima","2,6-Dimethyl-3,7-diphenyl-2,6-naphthyridine-1,5(2<i>H</i>,6<i>H</i>)-dione","Acta Crystallographica Section C","1998","54","9","1318","1320","10.1107/S0108270198003333","","","0.71073","MoK~α~","","","0.0669","","","","0.0694","","","","","","1.041","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007659","10.892","0.006","15.82","0.01","8.223","0.003","90","","98.55","0.04","90","","1401.2","1.3","293","","293","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-15(1),17-diene-16,19-dione","","- C14 H18 O7 -","- C14 H18 O7 -","- C56 H72 O28 -","4","1","OA1046","Akihiko Tsuda; Tatsuya Kawamoto; Takumi Oshima","2,3-Benzoquino[15]crown-5","Acta Crystallographica Section C","1998","54","9","1362","1364","10.1107/S010827019800287X","","","0.71073","MoKα","","","0.061","","","0.063","","","","","1.316","1.316","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007660","28.021","0.005","17.118","0.004","12.11","0.002","90","","90.44","0.02","90","","5809","2","295","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[μ-methylenebis(dicyclohexylphosphine)- P:P']bis[chloropalladium(I)](Pd—Pd) Bis(acetonitrile) Solvate","","- C54 H98 Cl2 N2 P4 Pd2 -","- C54 H98 Cl2 N2 P4 Pd2 -","- C216 H392 Cl8 N8 P16 Pd8 -","4","1","OA1051","Hashioka, Miho; Sakai, Ken; Tsubomura, Taro","Bis[μ-methylenebis(dicyclohexylphosphine)-<i>P</i>:<i>P</i>']bis[chloropalladium(I)](<i>Pd</i>—<i>Pd</i>) Diacetonitrile Solvate","Acta Crystallographica Section C","1998","54","9","1244","1247","10.1107/S0108270198004521","","","0.71069","MoKα","","0.16","0.064","","0.184","0.121","","","","1.034","1.069","1.069","","","","","has coordinates,has Fobs","198601","2020-10-21","18:00:00",""
"2007661","11.776","0.006","3.918","0.002","10.189","0.007","90","","100.59","0.04","90","","462.1","0.5","293","","293","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Li3 O13 V6 -","- Li4 O13 V6 -","- Li8 O26 V12 -","2","0.25","OS1007","Bergström, Örjan; Gustafsson, Torbjörn; Thomas, John O.","Electrochemically Lithiated Vanadium Oxide, Li~3~V~6~O~13~","Acta Crystallographica Section C","1998","54","9","1204","1206","10.1107/S0108270198004211","","","0.71073","MolybdenumKᾱ","","0.095","0.095","","0.082","0.082","","","","1.69","1.69","1.69","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007662","7.5815","0.0008","9.9861","0.0009","10.2413","0.0012","78.417","0.009","88.559","0.009","71.491","0.008","719.66","0.14","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H24 Co N6 O12 -","- C26 H24 Co N6 O12 -","- C26 H24 Co N6 O12 -","1","0.5","OS1013","Hökelek, Tuncer; Necefoğlu, Hacalı","<i>trans</i>-Diaquabis(nicotinamide-<i>N</i>^1^)bis(4-nitrobenzoato-<i>O</i>)cobalt(II)","Acta Crystallographica Section C","1998","54","9","1242","1244","10.1107/S0108270198004533","","","0.71073","MoKα","","","0.037","","","0.046","","","","","1.03","1.03","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007663","9.92","0.002","10.631","0.002","19.413","0.004","90","","92.35","0.03","90","","2045.6","0.7","193","2","193","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","Octakis(dimethylsulfoxide-O)gadolinium(III) hexacyanoferrate(III)","","","- C22 H48 Fe Gd N6 O8 S8 -","- C22 H48 Fe Gd N6 O8 S8 -","- C44 H96 Fe2 Gd2 N12 O16 S16 -","2","0.5","OS1014","Martti Klinga; Rafael Cuesta; José María Moreno; José Manuel Dominguez-Vera; Enrique Colacio; Raikko Kivekäs","Octakis(dimethyl sulfoxide-<i>O</i>)gadolinium(III) Hexacyanoferrate(III)","Acta Crystallographica Section C","1998","54","9","1275","1277","10.1107/S0108270198004545","","","0.71073","MoKα","","0.065","0.052","","0.121","0.116","","","","1.169","1.213","1.213","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007664","18.116","0.002","18.601","0.002","18.503","0.003","90","","95.87","0.01","90","","6202.4","1.4","294.2","","294","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Ce H60 Na8 O66 W10 -","- Ce Na8 O66 W10 -","- Ce4 Na32 O264 W40 -","4","0.5","QA0047","Rosu, Cristina; Weakley, Timothy J. R.","Redetermination of Sodium [Bis(pentatungstato)cerate(IV)](8 ‒) 30-Hydrate, Na~8~[Ce(W~5~O~18~)~2~].30H~2~O","Acta Crystallographica Section C","1998","54","9","IUC9800047","","10.1107/S0108270198099363","","","0.71073","MoKα","","","0.047","","","0.055","","","","","","","2.14","","","","has coordinates,has Fobs","198601","2020-10-21","18:00:00",""
"2007665","9.1202","0.0005","14.743","0.0008","17.7793","0.0009","90","","102.389","0.001","90","","2334.9","0.2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(N,N,N',N'-Tetramethylethylenediamine-N,N')bis(1,1,1,5,5,5- hexafluoropentane-2,4-dionato-O,O')iron(II)","","- C16 H18 F12 Fe N2 O4 -","- C16 H18 F12 Fe N2 O4 -","- C64 H72 F48 Fe4 N8 O16 -","4","0.5","QA0049","Dickman, Michael H.","(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylethylenediamine-<i>N</i>,<i>N</i>')bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato-<i>O</i>,<i>O</i>')iron(II)","Acta Crystallographica Section C","1998","54","9","IUC9800048","","10.1107/S010827019809934X","","","0.71073","MoKα","","0.044","0.037","","","","0.098","","","","","","1.04","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007666","14.028","0.001","8.6312","0.0006","20.615","0.002","90","","108.21","0.01","90","","2371","0.4","294","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetra-n-butylammonium Bis(1,1-dicyanoethylene-2,2-dithiolato)nickelate(II)","","- C40 H72 N6 Ni S4 -","- C40 H72 N6 Ni S4 -","- C80 H144 N12 Ni2 S8 -","2","0.5","QB0057","Dong, Gang; Fronczek, Frank R.; Watkins, Steven F.; Bernal, Ivan","Bis(tetra-<i>n</i>-butylammonium) Bis(1,1-dicyanoethylene-2,2-dithiolato)nickelate(II)","Acta Crystallographica Section C","1998","54","9","IUC9800045","","10.1107/S0108270198099351","","","1.54184","CuKα","","","0.061","","","0.057","","","","","1.447","1.447","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007667","7.822","0.001","7.822","0.001","7.822","0.001","90","","90","","90","","478.58","0.11","173","2","173","2","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","Strontium Nitrate","","- N2 O6 Sr -","- N2 O6 Sr -","- N8 O24 Sr4 -","4","0.166667","QB0061","El-Bali, Brahim; Bolte, Michael","Sr(NO~3~)~2~ at 173K","Acta Crystallographica Section C","1998","54","9","IUC9800046","","10.1107/S0108270198099375","","","0.71073","MoKα","","0.0292","0.0226","","","","0.0549","","","","","","1.246","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007669","9.9403","0.0006","25.4021","0.0014","10.587","0.0005","90","","91.808","0.005","90","","2671.9","0.3","294","1","294","1","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S,4S,5R)-(-)-2-(1H-Imidazol-2-yl)-3,4-dimethyl-5-phenyl-1,3-oxazolidine","","- C14 H17 N3 O -","- C14 H17 N3 O -","- C112 H136 N24 O8 -","8","4","SK1179","Gallagher, John F.; Briody, John M.; Cantwell, Brendan P.","N—H···N Hydrogen Bonding in the Four Independent Molecules of (2<i>S</i>,4<i>S</i>,5<i>R</i>)-({-})-2-(1<i>H</i>-Imidazol-2-yl)-3,4-dimethyl-5-phenyl-1,3-oxazolidine, with C-H···π~arene~, C-H···O and C-H···π~C=C~ Interactions","Acta Crystallographica Section C","1998","54","9","1331","1335","10.1107/S0108270198004089","","","0.71073","MoKα","","0.068","0.038","","","","0.088","","","","","","1.009","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007670","6.189","0.001","10.614","0.001","16.16","0.001","90","","100.993","0.004","90","","1042.1","0.2","292","2","292","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(1S)-phenyl-1-[(2S)-(3,5-dinitrobenzoyloxy)-propyl]-(2R)-methyl cyclopentane","","- C22 H24 N2 O6 -","- C22 H24 N2 O6 -","- C44 H48 N4 O12 -","2","1","SK1180","Baudoux, Guy; Norberg, Bernadette; Bousbaa, Jamal; Krief, Alain; Evrard, Guy","Dinitrobenzoate Derivative of a Chiral Arylcyclopentane","Acta Crystallographica Section C","1998","54","9","1353","1355","10.1107/S0108270198004090","","","1.54178","CuKα","","0.045","0.044","","","","0.116","","","","","","1.092","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007671","6.184","0.002","17.787","0.004","11.746","0.002","90","","91.65","0.02","90","","1291.5","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-O-benzoyl-myo-inositol-1,3,5-orthoformate","","- C14 H14 O7 -","- C14 H14 O7 -","- C56 H56 O28 -","4","1","SX1052","Samanta, Uttamkumar; Puranik, Vedavati G.; Chakrabarti, Pinak; Thoniyot, Praveen; Shashidhar, Mysore S.","2-<i>O</i>-Benzoyl-<i>myo</i>-inositol-1,3,5-orthoformate","Acta Crystallographica Section C","1998","54","9","1289","1291","10.1107/S0108270197017721","","","0.71073","MoKα","","0.0773","0.0679","","0.2223","0.2115","","","","1.082","1.153","1.153","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007672","15.638","0.003","8.65","0.002","15.778","0.002","90","","98.503","0.014","90","","2110.8","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","16α-Chloro-16β-cyano-3-methoxy-14,17α-ethenoestra-1,3,5(10)- trien-17β-yl Acetate","","- C24 H26 Cl N O3 -","- C24 H26 Cl N O3 -","- C96 H104 Cl4 N4 O12 -","4","2","SX1056","Bull, James R.; de Koning, Pieter D.","16α-Chloro-16β-cyano-3-methoxy-14,17α-ethenoestra-1,3,5(10)-trien-17β-yl Acetate","Acta Crystallographica Section C","1998","54","9","1281","1282","10.1107/S0108270198000584","","","0.71069","MoKα","","0.1568","0.064","","0.161","0.151","","","","0.972","1.299","1.299","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007673","17.9713","0.0012","5.6693","0.0009","13.9522","0.0011","90","0.001","126.87","0.0006","90","0.0011","1137.2","0.2","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","ethylenediammonium bis(monohydrogenoxalate) monohydrate","","- C6 H14 N2 O9 -","- C6 H14 N2 O9 -","- C24 H56 N8 O36 -","4","0.5","SX1061","Barnes, John C.; Longhurst, Rayne W.; Weakley, Timothy J.R.","Ethylenediammonium Bis(monohydrogen oxalate) Monohydrate and Two Modifications of Trimethylenediammonium Bis(monohydrogen oxalate) Monohydrate","Acta Crystallographica Section C","1998","54","9","1347","1351","10.1107/S0108270198003734","","","0.71069","MoKα","","0.0746","0.0447","","","","0.1199","","","","","","1.064","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007674","6.7954","0.0008","16.1594","0.0013","5.6307","0.001","90","","90","","90","","618.3","0.14","295","2","295","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","trimethylenediammonium bis(monohydrogenoxalate) monohydrate (β-form)","","- C7 H16 N2 O9 -","- C7 H16 N2 O9 -","- C14 H32 N4 O18 -","2","0.5","SX1061","Barnes, John C.; Longhurst, Rayne W.; Weakley, Timothy J.R.","Ethylenediammonium Bis(monohydrogen oxalate) Monohydrate and Two Modifications of Trimethylenediammonium Bis(monohydrogen oxalate) Monohydrate","Acta Crystallographica Section C","1998","54","9","1347","1351","10.1107/S0108270198003734","","","0.71073","MoKα","","0.052","0.0356","","","","0.1019","","","","","","1.005","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007675","14.6727","0.0019","7.3876","0.0006","11.3348","0.0018","90","","90","","90","","1228.6","0.3","295","2","295","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","trimethylenediammonium bis(monohydrogenoxalate) monohydrate","","- C7 H16 N2 O9 -","- C7 H16 N2 O9 -","- C28 H64 N8 O36 -","4","0.5","SX1061","Barnes, John C.; Longhurst, Rayne W.; Weakley, Timothy J.R.","Ethylenediammonium Bis(monohydrogen oxalate) Monohydrate and Two Modifications of Trimethylenediammonium Bis(monohydrogen oxalate) Monohydrate","Acta Crystallographica Section C","1998","54","9","1347","1351","10.1107/S0108270198003734","","","0.71079","MoKα","","0.0538","0.0367","","","","0.108","","","","","","0.982","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007676","7.9808","0.0007","11.72","0.001","16.468","0.001","90","","90","","90","","1540.3","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H15 Br N2 O3 -","- C16 H15 Br N2 O3 -","- C64 H60 Br4 N8 O12 -","4","1","TA1201","White, Jonathan M.; Clark, Christopher I.","2-(4-Bromo-2-nitrophenyl)-1-(4-dimethylaminophenyl)-1-ethanone","Acta Crystallographica Section C","1998","54","9","1304","1306","10.1107/S0108270198003989","","","1.5418","CuKα","","0.0768","0.0482","","","","0.1296","","","","","","1.037","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007677","6.4274","0.001","11.826","0.002","17.616","0.002","90","","90","","90","","1339","0.3","122.4","0.5","122.4","0.5","","","","","","","","4","P n a m","-P 2c 2n","62","methylammonium hydrogen maleate","","","- C5 H9 N O4 -","- C5 H9 N O4 -","- C40 H72 N8 O32 -","8","1","AB1534","Madsen, Dennis; Larsen, Sine","Methylamine and Dimethylamine Salts of the Hydrogen Maleate Ion","Acta Crystallographica Section C","1998","54","10","1507","1511","10.1107/S0108270198003606","","","0.71073","MoKα","","0.074","0.05","","0.075","0.072","","","","2.203","2.439","2.439","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007678","8.4738","0.0008","8.3444","0.0013","11.5727","0.001","90","","98.729","0.008","90","","808.81","0.16","122.4","0.5","122.4","0.5","","","","","","","","4","P 1 21/n 1","-P 2yn","14","dimethylammonium hydrogen maleate","","","- C6 H11 N O4 -","- C6 H11 N O4 -","- C24 H44 N4 O16 -","4","1","AB1534","Madsen, Dennis; Larsen, Sine","Methylamine and Dimethylamine Salts of the Hydrogen Maleate Ion","Acta Crystallographica Section C","1998","54","10","1507","1511","10.1107/S0108270198003606","","","0.71073","MoKα","","0.082","0.054","","0.076","0.072","","","","2.187","2.471","2.471","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007679","12.617","0.0011","13.5333","0.0015","18.8645","0.0016","79.129","0.012","79.32","0.01","73.004","0.011","2995.9","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C30 H42 Si3 -","- C30 H42 Si3 -","- C120 H168 Si12 -","4","2","AB1538","Teng, Zhu; Stoeckli-Evans, Helen; Keese, Reinhart","A Tricyclic Trisiladiene","Acta Crystallographica Section C","1998","54","10","1473","1475","10.1107/S0108270198004661","","","0.71073","MoKα","","0.0797","0.0461","","","","0.1291","","","","","","0.86","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007680","25.601","0.008","12.694","0.003","18.153","0.005","90","","107.608","0.012","90","","5623","3","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dekakis(acetato)bis(μ~4~-oxo)tetrakis(piridine) dimanganese(III)tetramanganese(II) pyridine solvate","","- C45 H55 Mn6 N5 O22 -","- C44 H54 Mn6 N6 O22 -","- C176 H216 Mn24 N24 O88 -","4","0.5","AV1019","Karsten, Peter; Strähle, Joachim","Deca-μ-acetato-di-μ~4~-oxo-tetra(pyridine-<i>N</i>)dimanganese(III)tetramanganese(II) Pyridine Solvate","Acta Crystallographica Section C","1998","54","10","1403","1406","10.1107/S0108270198005861","","","0.71073","MoKα","","0.072","0.052","","0.148","","0.128","","","1.126","","","1.104","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2007681","7.2582","0.0014","9.585","0.002","15.47","0.003","93.626","0.012","101.703","0.011","101.479","0.01","1026.8","0.4","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","trans-Bis(chloro)tetrakis(pyridine)iron(II) Di(1,8-diazabicyclo[5.4.0]undec-7-ene hydrochloride)","","- C38 H54 Cl4 Fe N8 -","- C38 H54 Cl4 Fe N8 -","- C38 H54 Cl4 Fe N8 -","1","0.5","AV1020","Karsten, Peter; Strähle, Joachim","Bis(1,8-diazabicyclo[5.4.0]undec-7-en-8-ium) <i>trans</i>-Dichlorotetra(pyridine-<i>N</i>)iron(II) Dichloride","Acta Crystallographica Section C","1998","54","10","1406","1408","10.1107/S0108270198005873","","","1.5418","CuKα","","0.06","0.054","","0.161","","0.154","","","1.117","","","1.128","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2007682","6.585","0.001","11.066","0.002","14.207","0.003","90","","101.45","0.03","90","","1014.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Chloro-3-cyano-6-phenylpyridine","","- C12 H7 Cl N2 -","- C12 H7 Cl N2 -","- C48 H28 Cl4 N8 -","4","1","AV1021","Cyrañski, Michal K.; Mieczkowski, Jȯzef","2-Chloro-3-cyano-6-phenylpyridine","Acta Crystallographica Section C","1998","54","10","1521","1523","10.1107/S0108270198006015","","","1.54178","CuKα","","0.064","0.05","","0.163","0.132","","","","1.032","1.077","1.077","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007683","10.326","0.001","8.67","0.001","10.72","0.001","90","","94.93","0.01","90","","956.17","0.17","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nitropentaammine Co(III) chloride","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H15 N6 O2 -","- Cl8 Co4 H60 N24 O8 -","4","0.5","AV1022","Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali","Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa","Acta Crystallographica Section C","1998","54","10","1378","1383","10.1107/S0108270198004879","","","0.71073","MoKα","","0.058","0.023","","0.0457","0.043","","","","0.6","0.809","0.809","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007684","10.314","0.001","8.587","0.001","10.71","0.001","90","","94.95","0.01","90","","945.01","0.17","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nitropentaammine Co(III) chloride","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H15 N6 O2 -","- Cl8 Co4 H60 N24 O8 -","4","0.5","AV1022","Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali","Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa","Acta Crystallographica Section C","1998","54","10","1378","1383","10.1107/S0108270198004879","","","0.71073","MoKα","","0.0651","0.0269","","0.0473","0.0441","","","","0.759","0.959","0.959","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007685","10.312","0.001","8.457","0.001","10.683","0.001","90","","94.935","0.009","90","","928.2","0.17","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nitropentaammine Co(III) chloride","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H15 N6 O2 -","- Cl8 Co4 H60 N24 O8 -","4","0.5","AV1022","Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali","Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa","Acta Crystallographica Section C","1998","54","10","1378","1383","10.1107/S0108270198004879","","","0.71073","MoKα","","0.0638","0.0261","","0.0498","0.046","","","","0.785","0.973","0.973","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007686","10.4","0.001","8.089","0.001","10.658","0.001","90","","94.804","0.009","90","","893.46","0.16","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nitropentaammine Co(III) chloride","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H15 N6 O2 -","- Cl8 Co4 H60 N24 O8 -","4","0.5","AV1022","Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali","Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa","Acta Crystallographica Section C","1998","54","10","1378","1383","10.1107/S0108270198004879","","","0.71073","MoKα","","0.0528","0.0242","","0.0458","0.0432","","","","0.659","0.852","0.852","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007687","10.443","0.001","7.857","0.001","10.601","0.001","90","","94.57","0.01","90","","867.05","0.16","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nitropentaammine Co(III) chloride","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H15 N6 O2 -","- Cl8 Co4 H60 N24 O8 -","4","0.5","AV1022","Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali","Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa","Acta Crystallographica Section C","1998","54","10","1378","1383","10.1107/S0108270198004879","","","0.71073","MoKα","","0.0517","0.025","","0.049","0.0466","","","","0.7","0.89","0.89","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007688","10.457","0.001","7.619","0.001","10.477","0.001","90","","94.126","0.01","90","","832.56","0.16","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nitropentaammine Co(III) chloride","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H15 N6 O2 -","- Cl8 Co4 H60 N24 O8 -","4","0.5","AV1022","Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali","Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa","Acta Crystallographica Section C","1998","54","10","1378","1383","10.1107/S0108270198004879","","","0.71073","MoKα","","0.0468","0.0242","","0.0486","0.0467","","","","0.71","0.881","0.881","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007689","12.03","0.002","13.652","0.003","15.462","0.003","87.91","0.03","77.62","0.03","72.56","0.03","2365.3","0.9","160","","160","","","","","","","","","6","P -1","-P 1","2","","","","- C46 H30 Fe3 N8 Ni2 S8 -","- C46 H30 Fe3 N8 Ni2 S8 -","- C92 H60 Fe6 N16 Ni4 S16 -","2","1","BK1370","Day, Michael W.; Qin, Jingui; Yang, Chuluo","Ferrocene, Ferrocenium and a Bis(maleonitriledithiolate) Complex of Nickel","Acta Crystallographica Section C","1998","54","10","1413","1416","10.1107/S0108270198002340","","","0.71073","MoKα","","0.049","0.035","","0.069","","0.064","","","1.44","","","1.5","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2007690","10.4968","0.0009","13.5","0.001","15.626","0.001","90","","96.986","0.006","90","","2197.9","0.3","294","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 Cl N O6 S -","- C24 H18 Cl N O6 S -","- C96 H72 Cl4 N4 O24 S4 -","4","1","BK1376","Nancy N. Tsou; Richard G. Ball; Patrick J. Roy; Yves Leblanc","4-Chloro-2-{4-[<i>p</i>-(methylsulfonyl)phenyl]-2-oxo-5-phenyl-2,3-dihydro-1,3-oxazol-3-yl}phenyl Acetate","Acta Crystallographica Section C","1998","54","10","1493","1494","10.1107/S0108270198003928","","","1.54184","CuKα","","","0.049","","","0.128","","","","","1.026","1.026","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2007691","11.5036","0.0006","12.8861","0.0006","14.8388","0.0009","102.351","0.004","98.342","0.005","103.493","0.004","2044.9","0.2","297","","","","","","","","","","","5","P -1","-P 1","2","","pyridine [2-{1-methoxy-2-acetyl-2-(ethoxycarbonyl)} ethyl-8-quinolinol-C,N, O] palladium(II)","","- C22 H22 N2 O5 Pd -","- C22 H22 N2 O5 Pd -","- C88 H88 N8 O20 Pd4 -","4","2","BK1380","Billodeaux, Damon R.; Fronczek, Frank R.; Yoneda, Akio; Newkome, George R.","[2-(2-Acetyl-2-ethoxycarbonyl-1-methoxyethyl)-8-quinolinolato-<i>C</i>,<i>N</i>,<i>O</i>](pyridine-<i>N</i>)palladium(II)","Acta Crystallographica Section C","1998","54","10","1439","1441","10.1107/S0108270198005538","","","0.71073","MoKα","","","0.045","","","0.048","","","","","2.26","2.26","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2007692","14.489","0.0002","14.489","0.0002","21.5432","0.0003","90","","90","","90","","4522.59","0.11","295","","295","","","","","","","","","5","P 42/n :2","-P 4bc","86","","octakis-tetramethylammonium acetate,docosavanadate hydrate","","- C34 H107.5 N8 O60.25 V22 -","- C34 H48 N8 O60.26 V22 -","- C68 H96 N16 O120.52 V44 -","2","0.25","BK1386","Chirayil, Thomas; Zavalij, Peter Y.; Whittingham, M. Stanley","The Inserting Host‒Guest System in [N(CH~3~)~4~]~8~[(CH~3~COO)V~22~O~54~].4.25H~2~O","Acta Crystallographica Section C","1998","54","10","1441","1444","10.1107/S0108270198006404","","","0.71073","MoKα","","","0.052","","","0.076","","","","","1.53","1.53","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007693","11.479","0.002","12.828","0.002","22.475","0.003","89.04","0.01","84.8","0.01","69.19","0.01","3080.4","0.9","153","2","153.2","","","","","","","","","8","P -1","-P 1","2","","","","- C49 H78 Cl2 F12 N6 O14 P2 Ru -","- C49 H78 Cl2 F12 N6 O14 P2 Ru -","- C98 H156 Cl4 F24 N12 O28 P4 Ru2 -","2","1","BK1387","Dong I. Yoon; Suzanne Bélanger; Joseph T. Hupp; Charlotte L. Stern","An Adduct Between Tetraammine(1,10-phenanthroline)ruthenium(II) and Dibenzo-42-crown-14","Acta Crystallographica Section C","1998","54","10","1427","1431","10.1107/S010827019800554X","","","0.7107","MoKα","","0.068","0.047","","0.081","0.073","","","","1.292","1.89","1.89","","","","","has coordinates","202200","2020-10-21","18:00:00",""
"2007694","9.004","0.002","7.065","0.002","9.851","0.003","90","","97.96","0.02","90","","620.6","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-hydroxymethyl-4-methyl-2-oxazolidinone","","- C5 H9 N O3 -","- C5 H9 N O3 -","- C20 H36 N4 O12 -","4","1","BK1395","Eknoian, Michael W.; Webb, Thomas R.; Worley, S. Davis; Fleury, Jennifer R.; Maddox, Spencer D.","Two Oxazolidinone Derivatives","Acta Crystallographica Section C","1998","54","10","1529","1532","10.1107/S0108270198005654","","","0.71073","MoKα","","0.073","0.045","","0.122","0.106","","","","1.058","1.119","1.119","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007695","10.45","0.003","8.198","0.003","17.497","0.007","90","","106.85","0.03","90","","1434.6","0.9","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-ethyl-4-hydroxymethyl-2-oxazolidinone","","- C6 H11 N O3 -","- C6 H11 N O3 -","- C48 H88 N8 O24 -","8","1","BK1395","Eknoian, Michael W.; Webb, Thomas R.; Worley, S. Davis; Fleury, Jennifer R.; Maddox, Spencer D.","Two Oxazolidinone Derivatives","Acta Crystallographica Section C","1998","54","10","1529","1532","10.1107/S0108270198005654","","","0.71073","MoKα","","0.046","0.037","","0.103","0.096","","","","1.081","1.107","1.107","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007696","12.544","0.001","9.017","0.002","15.12","0.001","90","","110.54","0.01","90","","1601.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-di-η^5^-cyclopentadienyl-1,2-dinickela-closo-dodecaborane","","- C10 H20 B10 Ni2 -","- C10 H20 B10 Ni2 -","- C40 H80 B40 Ni8 -","4","1","BM1225","Jian-Min Dou; Chun-Hua Hu; Jian-Ming Gu; Yong Nie; Hai-Jun Yao; Ruo-Shui Jin; Pei-Ju Zheng","A <i>closo</i>-12-Vertex Dinickelaborane: [(η^5^-C~5~H~5~)~2~Ni~2~B~10~H~10~]","Acta Crystallographica Section C","1998","54","10","1418","1419","10.1107/S0108270198004077","","","0.71073","MoKα","","","0.0343","","","","0.0989","","","","","","1.1","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007697","9.735","0.003","12.7753","0.0008","9.735","0.003","90","","110.58","0.002","90","","1133.5","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-crotonoyl-5,8-dihydro-1-naphthol","","- C14 H14 O2 -","- C14 H14 O2 -","- C56 H56 O8 -","4","1","BM1234","Chinnakali, Kandasamy; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vayalakkavoor T.","2-Crotonoyl-5,8-dihydro-1-naphthol, (I), and 4-(1-Naphthoyl)-5,8-dihydro-1-naphthol, (II)","Acta Crystallographica Section C","1998","54","10","1496","1499","10.1107/S0108270198005599","","","0.71073","MoKα","","0.072","0.051","","0.134","0.118","","","","1.096","1.128","1.128","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007698","12.2964","0.0002","16.2109","0.0003","7.8517","0.0002","90","","103.197","0.002","90","","1523.79","0.06","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-(1-naphthoyl)-5,8-dihydro-1-naphthol","","- C21 H16 O2 -","- C21 H16 O2 -","- C84 H64 O8 -","4","1","BM1234","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan","2-Crotonoyl-5,8-dihydro-1-naphthol, (I), and 4-(1-Naphthoyl)-5,8-dihydro-1-naphthol, (II)","Acta Crystallographica Section C","1998","54","10","1496","1499","10.1107/S0108270198005599","","","0.71073","MoKα","","0.149","0.059","","0.134","0.101","","","","1.005","1.172","1.172","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007699","14.131","0.003","8.281","0.002","15.473","0.003","90","","108.36","0.02","90","","1718.5","0.7","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1RS,10aRS)-3-Imino-1-(2-thienyl)-1,2,3,9,10,10a-hexahydrophenanthrene-2,2,4- tricarbonitrile","","- C21 H14 N4 S -","- C21 H14 N4 S -","- C84 H56 N16 S4 -","4","1","BM1245","Elgemeie, Galal E. H.; Farag, Dalia S.; Jones, Peter G.","(1<i>RS</i>,10a<i>RS</i>)-3-Imino-1-(2-thienyl)-1,2,3,9,10,10a-hexahydrophenanthrene-2,2,4-tricarbonitrile","Acta Crystallographica Section C","1998","54","10","1466","1468","10.1107/S0108270198005022","","","0.71073","MoKα","","0.108","0.043","","0.078","0.065","","","","0.791","0.979","0.979","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2007700","11.017","0.003","11.511","0.003","14.292","0.003","100.61","0.02","103.52","0.02","117.69","0.02","1467.4","0.8","178","2","178","2","","","","","","","","5","P -1","-P 1","2","","trans-1,3-Diethoxy-5,5-dimethyl-1,3-diphospha-5-silacyclohexane-1,3-dione","","- C9 H22 O4 P2 Si -","- C9 H22 O4 P2 Si -","- C36 H88 O16 P8 Si4 -","4","2","BM1247","Jones, Peter G.; Weinkauf, Andreas","<i>trans</i>-1,3-Diethoxy-5,5-dimethyl-1,3-diphospha-5-silacyclohexane-1,3-dione","Acta Crystallographica Section C","1998","54","10","1449","1451","10.1107/S0108270198006337","","","0.71073","MoKα","","0.039","0.032","","0.089","0.084","","","","1.044","1.059","1.059","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007701","7.313","0.002","9.028","0.002","18.61","0.005","90","","97.34","0.02","90","","1218.6","0.5","178","2","178","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","cis-1,3-Diethoxy-1,3-diphosphorinane-1,3-dione","","- C8 H18 O4 P2 -","- C8 H18 O4 P2 -","- C32 H72 O16 P8 -","4","1","BM1249","Jones, Peter G.; Fischer, Axel K.","<i>cis</i>- and <i>trans</i>-1,3-Diethoxy-1,3-diphosphorinane-1,3-dione","Acta Crystallographica Section C","1998","54","10","1451","1453","10.1107/S0108270198006349","","","0.71073","MoKα","","0.058","0.04","","0.121","0.103","","","","1.032","1.013","1.013","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007702","7.431","0.002","18.715","0.005","17.183","0.006","90","","99.06","0.03","90","","2359.8","1.2","178","2","178","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","trans-1,3-Diethoxy-1,3-diphosphorinane-1,3-dione","","- C8 H18 O4 P2 -","- C8 H18 O4 P2 -","- C64 H144 O32 P16 -","8","2","BM1249","Jones, Peter G.; Fischer, Axel K.","<i>cis</i>- and <i>trans</i>-1,3-Diethoxy-1,3-diphosphorinane-1,3-dione","Acta Crystallographica Section C","1998","54","10","1451","1453","10.1107/S0108270198006349","","","0.71073","MoKα","","0.059","0.038","","0.105","0.09","","","","1.053","1.046","1.046","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007703","25.108","0.01","10.954","0.005","8.547","0.004","90","","94.82","0.04","90","","2342.4","1.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","cis-3,5-Diethoxy-3,5-dioxo-1-oxa-3,5-diphosphorinane","","- C7 H16 O5 P2 -","- C7 H16 O5 P2 -","- C56 H128 O40 P16 -","8","1","BM1250","Jones, Peter G.; Weinkauf, Andreas","<i>cis</i>- and <i>trans</i>-3,5-Diethoxy-1-oxa-3,5-diphosphorinane-3,5-dione","Acta Crystallographica Section C","1998","54","10","1453","1456","10.1107/S0108270198006155","","","0.71073","MoKα","","0.047","0.036","","0.105","0.096","","","","1.031","1.052","1.052","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007704","9.058","0.002","15.312","0.003","8.27","0.002","90","","90","","90","","1147","0.4","178","2","178","2","","","","","","","","4","P n a 21","P 2c -2n","33","","trans-3,5-Diethoxy-3,5-dioxo-1-oxa-3,5-diphosphorinane","","- C7 H16 O5 P2 -","- C7 H16 O5 P2 -","- C28 H64 O20 P8 -","4","1","BM1250","Jones, Peter G.; Weinkauf, Andreas","<i>cis</i>- and <i>trans</i>-3,5-Diethoxy-1-oxa-3,5-diphosphorinane-3,5-dione","Acta Crystallographica Section C","1998","54","10","1453","1456","10.1107/S0108270198006155","","","0.71073","MoKα","","0.036","0.03","","0.08","0.076","","","","1.027","1.033","1.033","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007705","9.887","0.002","12.666","0.003","20.345","0.004","90","","102.78","0.02","90","","2484.7","0.9","178","2","178","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{Difluoromethane-bis(diisopropylphosphonite)}tetracarbonylmolybdenum(0)","","- C17 H28 F2 Mo O8 P2 -","- C17 H28 F2 Mo O8 P2 -","- C68 H112 F8 Mo4 O32 P8 -","4","1","BM1251","Jones, Peter G.","Tetracarbonyl[difluoromethylenebis(diisopropoxyphosphine-<i>P</i>)]molybdenum(0)","Acta Crystallographica Section C","1998","54","10","1447","1448","10.1107/S0108270198005885","","","0.71073","MoKα","","0.038","0.027","","","","0.072","","","","","","1.029","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007706","13.756","0.002","8.9663","0.0014","11.6831","0.0018","90","","99.828","0.01","90","","1419.9","0.4","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,3'-[Ethanediylbis(aminomethylene)]bis(pentane-2,4-dione)","","- C14 H20 N2 O4 -","- C14 H20 N2 O4 -","- C56 H80 N8 O16 -","4","0.5","BM1271","König, Burkhard; Pelka, Mario; Dix, Ina; Jones, Peter G.","3,3'-[Ethane-1,2-diylbis(aminomethylene)]bis(pentane-2,4-dione) and the Nickel(II) Complex of a Condensation Product","Acta Crystallographica Section C","1998","54","10","1468","1471","10.1107/S0108270198009263","","","0.71073","MoKα","","0.066","0.04","","0.093","0.087","","","","0.909","1.047","1.047","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007707","8.542","0.003","9.406","0.003","30.213","0.008","90","","90","","90","","2427.5","1.3","173","2","173","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","[{6,13-diacetyl-5,12-dimethyl-1,4,8,11-tetraazacyclotetradeca- 4,6,11,13-tetraenato(2-)}nickel(II)] deuterochloroform solvate (1:2)","","- C18 H22 Cl6 D2 N4 Ni O2 -","- C18 H24 Cl6 N4 Ni O2 -","- C72 H96 Cl24 N16 Ni4 O8 -","4","1","BM1271","König, Burkhard; Pelka, Mario; Dix, Ina; Jones, Peter G.","3,3'-[Ethane-1,2-diylbis(aminomethylene)]bis(pentane-2,4-dione) and the Nickel(II) Complex of a Condensation Product","Acta Crystallographica Section C","1998","54","10","1468","1471","10.1107/S0108270198009263","","","0.71073","MoKα","","0.036","0.031","","","","0.069","","","","","","1.055","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007708","12.414","0.003","11.891","0.003","9.062","0.002","90","","94.23","0.02","90","","1334","0.6","143","2","143","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2;4,5-Di-O-isopropylidene-galactitol","","- C12 H22 O6 -","- C12 H22 O6 -","- C48 H88 O24 -","4","1","BM1272","König, Burkhard; Pitsch, Wolfgang; Dix, Ina; Jones, Peter G.","1,2:4,5-Di-<i>O</i>-isopropylidenegalactitol","Acta Crystallographica Section C","1998","54","10","1471","1473","10.1107/S0108270198009275","","","0.71073","MoKα","","0.106","0.058","","","","0.118","","","","","","1.063","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007709","7.664","0.002","7.664","0.002","10.241","0.002","90","","90","","90","","601.5","0.3","293","2","293","2","","","","","","","","5","P 42/m n m","-P 4n 2n","136","Disodium Europium Zinc Diphosphate","Disodium Europium Zinc Diphosphate","","- Eu0.02 Na1.94 O7 P2 Zn -","- Eu0.017 Na1.948 O7 P2 Zn -","- Eu0.068 Na7.792 O28 P8 Zn4 -","4","0.25","BR1194","Erragh, Fatima; Boukhari, Ali; Sadel, Abderahim; Holt, Elizabeth M.","Disodium Zinc Pyrophosphate and Disodium (Europium) Zinc Pyrophosphate","Acta Crystallographica Section C","1998","54","10","1373","1376","10.1107/S0108270198006246","","","0.71073","MoKα","","0.083","0.059","","","0.137","0.137","","","","1.229","1.229","1.229","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007710","7.656","0.001","7.656","0.001","10.233","0.002","90","","90","","90","","599.8","0.16","293","2","293","2","","","","","","","","4","P 42/m n m","-P 4n 2n","136","Disodium Zinc Diphosphate","Disodium Zinc Diphosphate","","- Na2 O7 P2 Zn -","- Na2 O7 P2 Zn -","- Na8 O28 P8 Zn4 -","4","0.25","BR1194","Erragh, Fatima; Boukhari, Ali; Sadel, Abderahim; Holt, Elizabeth M.","Disodium Zinc Pyrophosphate and Disodium (Europium) Zinc Pyrophosphate","Acta Crystallographica Section C","1998","54","10","1373","1376","10.1107/S0108270198006246","","","0.71073","MoKα","","0.052","0.039","","","0.102","0.102","","","","1.113","1.113","1.113","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007711","13.196","0.002","13.196","0.002","7.943","0.003","90","","90","","120","","1197.8","0.5","183","","183","","","","","","","","","3","P -6 2 c","P -6c -2c","190","","Potassium pentasilver trisulfide","","- Ag5 K S3 -","- Ag5 K S3 -","- Ag30 K6 S18 -","6","0.5","BR1202","Emirdag, Mehtap; Schimek, George L.; Kolis, Joseph W.","KAg~5~S~3~","Acta Crystallographica Section C","1998","54","10","1376","1378","10.1107/S0108270198003680","","","0.71073","MoKα","","0.084","0.062","","0.069","0.04","","","","","2.71","2.71","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007712","9.617","0.002","10.209","0.002","12.721","0.003","90","","110.55","0.03","90","","1169.5","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Benzenediamine N-[(3-nitrophenyl)methylene]","","- C13 H11 N3 O2 -","- C13 H11 N3 O2 -","- C52 H44 N12 O8 -","4","1","CF1208","Yang, Qing-chuan; Tang, You-qi; Yang, Wen-jun; Chen, Hui-ying","<i>N</i>-(3-Nitrobenzylidene)-<i>p</i>-phenylenediamine","Acta Crystallographica Section C","1998","54","10","1532","1534","10.1107/S0108270198004818","","","0.71073","MoKα","","0.101","0.052","","","","0.159","","","","","","1.088","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007713","13.002","0.009","9.329","0.006","22.798","0.014","90","","95.21","0.05","90","","2754","3","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","1,2,5,6,dibenzofluorenone","13-H-Dibenzo[a,g]fluoren-13-one","","- C21 H12 O -","- C21 H12 O -","- C168 H96 O8 -","8","1","CF1248","Morris, David G.; Ryder, Karl S.; Howie, R. Alan","13<i>H</i>-Dibenzo[<i>a</i>,<i>g</i>]fluoren-13-one","Acta Crystallographica Section C","1998","54","10","1542","1544","10.1107/S0108270198006167","","","0.71073","MoKα","","0.101","0.052","","","","0.136","","","","","","1.01","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007714","11.4712","0.0008","12.3457","0.0008","20.582","0.002","90","","90","","90","","2914.8","0.4","294","1","294","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(2R/2S)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanoic acid","","- C17 H15 N O3 -","- C17 H15 N O3 -","- C136 H120 N8 O24 -","8","1","CF1250","Brady, Fiona; Gallagher, John F.; Kenny, Peter T. M.","O—H···O, C—H···O and C—H···π~arene~ Intermolecular Interactions in (2<i>R</i>/2<i>S</i>)-2-(1-oxo-1,3-dihydroisoindol-2-yl)-3-phenylpropanoic Acid","Acta Crystallographica Section C","1998","54","10","1523","1525","10.1107/S0108270198005678","","","0.7107","MoKα","","0.085","0.041","","","","0.098","","","","","","1.013","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007715","13.274","0.002","12.214","0.004","15.044","0.003","90","","110.606","0.014","90","","2283","1","123","","123","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,8-Dimethylphenoxathiin-10-oxide","","- C14 H12 O2 S -","- C14 H12 O2 S -","- C112 H96 O16 S8 -","8","2","CF1253","Bennett, Stephen R.; Kennedy, Alan R.; Khalaf, Abedawn I.; Waigh, Roger D.","2,8-Dimethylphenoxathiin 10-Oxide","Acta Crystallographica Section C","1998","54","10","1511","1513","10.1107/S0108270198005903","","","0.71069","MoKα","","0.107","0.058","","","","0.17","","","","","","1.036","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007716","10.5933","0.0006","8.8517","0.0007","11.3495","0.0006","90","","91.606","0.004","90","","1063.81","0.12","287","2","287","2","","","","","","","","4","P 1 2/a 1","-P 2ya","13","10-bornanesulfonic acid 2-hydroxy-γ-sultone","endo-10,10-dimethyl-4-oxa-5-thiatricyclo[5.2.1.0^3,7^]decane-S,S-dioxide","","- C10 H16 O3 S -","- C10 H16 O3 S -","- C40 H64 O12 S4 -","4","1","CF1262","Muir, Kenneth W.; Rodger, Colin S.; Morris, David G.; Ryder, Karl S.","A Sultone Derived from Racemic Camphene","Acta Crystallographica Section C","1998","54","10","1546","1548","10.1107/S0108270198006179","","","0.71073","MoKα","","0.056","0.035","","0.11","0.095","","","","1.008","1.017","1.017","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007717","8.7171","0.0008","10.9766","0.0012","21.946","0.004","90","","90","","90","","2099.9","0.5","291","2","291","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Gomisin N","1,2,3,12-tetramethoxy-6,7-dimethyl- 10,11-methylenedioxy-5,6,7,8-tetrahydrodibenzo[a,c]cyclooctene","","- C23 H28 O6 -","- C23 H28 O6 -","- C92 H112 O24 -","4","1","DA1014","Marek, Jaromír; Slanina, Jiří","Gomisin N","Acta Crystallographica Section C","1998","54","10","1548","1550","10.1107/S0108270198006489","","","0.71073","MoKα","","0.055","0.036","","","","0.1","","","","","","0.955","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007718","22.7727","0.0004","38.3529","0.0007","9.631","0.0002","90","","90","","90","","8411.7","0.3","297","2","297","2","","","","","","","","3","F d d 2","F 2 -2d","43","calanone","","","- C27 H20 O5 -","- C27 H20 O5 -","- C432 H320 O80 -","16","1","DE1085","Vittal, Jagadese J.; Cao, Shu-Geng; Goh, Swee-Hock; Tan, Goek-Kheng; Sim, Keng-Yeow","Three Novel Isomeric Pyranocoumarins from <i>Calophyllum teysmannii</i>: Calanone, Isocalanone and Teysmanone A","Acta Crystallographica Section C","1998","54","10","1536","1540","10.1107/S0108270198005691","","","0.71073","MoKα","","0.039","0.034","","0.084","0.081","","","","1.036","1.047","1.047","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007719","6.0017","0.0003","27.3003","0.0013","12.8273","0.0006","90","","95.303","0.001","90","","2092.73","0.17","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","isocalanone","","","- C27 H20 O5 -","- C27 H20 O5 -","- C108 H80 O20 -","4","1","DE1085","Vittal, Jagadese J.; Cao, Shu-Geng; Goh, Swee-Hock; Tan, Goek-Kheng; Sim, Keng-Yeow","Three Novel Isomeric Pyranocoumarins from <i>Calophyllum teysmannii</i>: Calanone, Isocalanone and Teysmanone A","Acta Crystallographica Section C","1998","54","10","1536","1540","10.1107/S0108270198005691","","","0.71073","MoKα","","0.08","0.049","","0.12","0.107","","","","1.053","1.153","1.153","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007720","9.0418","0.0005","16.7577","0.001","14.1879","0.0009","90","","106.315","0.001","90","","2063.2","0.2","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","teysmanone A","","","- C27 H20 O5 -","- C27 H20 O5 -","- C108 H80 O20 -","4","1","DE1085","Vittal, Jagadese J.; Cao, Shu-Geng; Goh, Swee-Hock; Tan, Goek-Kheng; Sim, Keng-Yeow","Three Novel Isomeric Pyranocoumarins from <i>Calophyllum teysmannii</i>: Calanone, Isocalanone and Teysmanone A","Acta Crystallographica Section C","1998","54","10","1536","1540","10.1107/S0108270198005691","","","0.71073","MoKα","","0.092","0.056","","0.128","0.114","","","","1.057","1.151","1.151","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007721","7.074","0.001","11.052","0.001","15.086","0.002","90.22","0.01","91.85","0.01","105.37","0.01","1136.6","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","potassium(benzo-15-crown-5)picrate","[Potassium(2,3-benzo-1,4,7,10,13-pentaoxacyclopenta-dec-2-ene)picrate]","","- C20 H22 K N3 O12 -","- C20 H22 K N3 O11.98 -","- C40 H44 K2 N6 O23.96 -","2","1","FG1402","Dong, Wenkui; Yang, Rudong; Yu, Kaibei","<i>catena</i>-Poly[[(2,3-benzo-1,4,7,10,13-pentaoxacyclopentadec-2-ene-κ^5^<i>O</i>)potassium]-μ-(picrato-<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^5^)]","Acta Crystallographica Section C","1998","54","10","1416","1418","10.1107/S0108270198003151","","","0.71073","MoKα","","0.062","0.048","","0.146","0.139","","","","1.1","1.203","1.203","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007722","13.18","0.002","13.555","0.003","13.267","0.002","90","","118.23","0.02","90","","2088.3","0.8","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1,3,3,14,14,16,16,18,18,29,29-Dodecamethyl-1,16-distanna-3,14,18,29- tetrasila(5,5)ferrocenophane","","- C36 H60 Fe2 Si4 Sn2 -","- C36 H60 Fe2 Si4 Sn2 -","- C72 H120 Fe4 Si8 Sn4 -","2","0.5","FG1430","Olivier Gausset; Guylaine Delpon-Lacaze; Markus Schürmann; Klaus Jurkschat","1,1,3,3,14,14,16,16,18,18,29,29-Dodecamethyl-3,14,18,29-tetrasila-1,16-distanna[5.5]ferrocenophane","Acta Crystallographica Section C","1998","54","10","1425","1427","10.1107/S0108270198006088","","","0.71069","MoKα","","0.034","0.022","","0.054","0.05","","","","1.054","1.081","1.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007723","8.207","0.002","17.445","0.002","11.151","0.001","90","","93.69","0.01","90","","1593.2","0.5","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","5-aminoisophthalic acid hemihydrate","","","- C8 H8 N O4.5 -","- C8 H8 N O4.5 -","- C64 H64 N8 O36 -","8","1","FG1449","Dobson, Allison J.; Gerkin, Roger E.","5-Aminoisophthalic Acid Hemihydrate","Acta Crystallographica Section C","1998","54","10","1503","1505","10.1107/S0108270198005915","","","0.71073","MoKα","","","0.043","","","0.074","","","","","1.8","1.8","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007724","7.2501","0.0005","22.917","0.0002","9.1648","0.0007","90","","92.443","0.009","90","","1521.35","0.16","220","2","220","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H26 Cl2 I6 N2 Pd2 S4 -","- C12 H26 Cl2 I6 N2 Pd2 S4 -","- C24 H52 Cl4 I12 N4 Pd4 S8 -","2","0.5","FG1461","Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin","Dichloro(μ-[18]aneN~2~S~4~)dipalladium(II) Bis(triiodide)","Acta Crystallographica Section C","1998","54","10","1408","1410","10.1107/S0108270198005927","","","0.71073","MoKα","","0.051","0.035","","","","0.087","","","","","","1.03","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007725","10.005","0.002","16.556","0.002","3.927","0.001","90","","99.26","0.01","90","","642","0.2","293","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H6 S2 -","- C16 H6 S2 -","- C32 H12 S4 -","2","0.5","FR1072","Sarkar, Abhijit; Komatsu, Kyoji; Okada, Shuji; Matsuda, Hiro; Nakanishi, Hachiro","1,8-Bis(2-thienyl)-1,3,5,7-octatetrayne","Acta Crystallographica Section C","1998","54","10","1519","1521","10.1107/S0108270198005605","","","0.71073","MoKα","","","0.074","","","0.056","","","","","1.805","1.805","","","","","has coordinates,has disorder","200209","2020-10-21","18:00:00",""
"2007726","5.9103","0.0004","28.2842","0.0019","5.0635","0.0003","90","","93.975","0.007","90","","844.42","0.1","295","1","295","1","","","","","","","","3","P 1 21 1","P 2yb","4","S,S-trans-2,3-tetralindiol","(S,S)-trans-1,2,3,4-tetrahydro-2,3-naphthalenediol","","- C10 H12 O2 -","- C10 H12 O2 -","- C40 H48 O8 -","4","2","FR1110","Michael A. Lloyd; Garth E. Patterson; Brock, Carolyn Pratt","(<i>S</i>,<i>S</i>)-<i>trans</i>-2,3-Tetralindiol","Acta Crystallographica Section C","1998","54","10","1486","1488","10.1107/S010827019800537X","","","0.71073","MoKα","","0.069","0.031","","0.076","0.065","","","","1.021","1.103","1.103","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007727","19.862","0.001","21.301","0.001","9.758","0.001","90","","90","","90","","4128.4","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","3-(o-Carboxyphenyl)-1-ethyltriazene 1-Oxide","3-(o-Carboxyphenyl)-1-ethyltriazene 1-Oxide","","- C9 H11 N3 O3 -","- C9 H11 N3 O3 -","- C144 H176 N48 O48 -","16","2","HA1213","Chitra Samanta; Alok Kumar Mukherjee; Monika Mukherjee","3-(<i>o</i>-Carboxyphenyl)-1-ethyltriazene 1-Oxide","Acta Crystallographica Section C","1998","54","10","1544","1546","10.1107/S0108270198003862","","","1.54178","CuKα","","0.0811","0.0489","","0.1342","0.1211","","","","0.948","1.063","1.063","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007728","8.4255","0.0002","8.5771","0.0002","14.5531","0.0002","89.692","0.001","85.374","0.002","61.295","0.001","918.78","0.03","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,6-dihydroxy-4-(6'-hydroxy-2',4'-dimethoxy-3'-methylbenzoyloxy)-3- methylbenzoate","","- C19 H20 O9 -","- C19 H20 O9 -","- C38 H40 O18 -","2","1","HA1218","Kan Chantrapromma; Rapeeporn Sortiruk; Suchada Chantrapromma; Chanita Ponglimanont; Hoong-Kun Fun; Kandasamy Chinnakali","Methyl 2,6-Dihydroxy-4-(2-hydroxy-4,6-dimethoxy-3-methylbenzoyloxy)-3-methylbenzoate","Acta Crystallographica Section C","1998","54","10","1494","1496","10.1107/S0108270198005058","","","0.71073","MoKα","","0.0667","0.0492","","0.1493","0.1313","","","","1.054","1.082","1.082","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007729","17.298","0.001","10.738","0.001","12.453","0.001","90","","95.43","0.01","90","","2302.7","0.3","173","1","173","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Di-t-butyl cis-transoid-cis-perhydro-3,3,6,6-tetramethyl-1,4- dioxocyclobuta[1,2-c:3,4-c']-dipyrrole-2,5-dicarboxylate","","- C22 H34 N2 O6 -","- C22 H34 N2 O6 -","- C88 H136 N8 O24 -","4","0.5","JZ1280","Kopf, Jürgen; Wrobel, Matthias Nils; Margaretha, Paul","The 3,3,6,6-Tetramethyl <i>cis</i>-<i>transoid</i>-<i>cis</i>-Photocyclodimer of <i>tert</i>-Butyl 2,5-Dihydro-5,5-dimethyl-2-oxo-1<i>H</i>-pyrrole-1-carboxylate","Acta Crystallographica Section C","1998","54","10","1499","1501","10.1107/S0108270198005344","","","1.54178","CuKα","","0.045","0.045","","","","0.114","","","","","","1.078","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007730","12.386","0.002","11.732","0.002","12.845","0.002","90","","112.08","0.01","90","","1729.6","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(diisopropylammonium) hexafluorosilicate(IV)","","- C12 H32 F6 N2 Si -","- C12 H32 F6 N2 Si -","- C48 H128 F24 N8 Si4 -","4","0.5","JZ1289","Reiß, Guido J.","Bis(diisopropylammonium) Hexafluorosilicate(IV)","Acta Crystallographica Section C","1998","54","10","1489","1491","10.1107/S010827019800609X","","","0.71073","MoKα","","0.042","0.03","","","","0.076","","","","","","1.036","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007731","11.0034","0.0002","27.2848","0.0004","6.7194","0.0001","90","","90","","90","","2017.34","0.06","173","","173","","","","","","","","","5","P n a 21","P 2c -2n","33","","1,1-Bis-(N-Methylimidazol)-silacyclohexane dibromide acetonitrile solvate","","- C15 H25 Br2 N5 Si -","- C15 H25 Br2 N5 Si -","- C60 H100 Br8 N20 Si4 -","4","1","JZ1295","Hensen, Karl; Gebhardt, Frank; Bolte, Michael","3,3'-(1-Silacyclohexane-1,1-diyl)bis(1-methylimidazolium) Dibromide Acetonitrile Solvate at 173K","Acta Crystallographica Section C","1998","54","10","1462","1464","10.1107/S0108270198006763","","","0.71073","MoKα","","0.073","0.065","","0.172","0.164","0.172","","","1.01","","","1.01","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007732","11.711","0.001","11.711","0.001","11.696","0.001","90","","90","","90","","1604.1","0.2","298","2","298","2","","","","","","","","6","I -4 2 m","I -4 2","121","Tetrabetainecopper(II) perchlorate","Tetrakis(trimethylammonioacetato-O)copper(II) diperchlorate","","- C20 H44 Cl2 Cu N4 O16 -","- C20 H44 Cl2 Cu N4 O16 -","- C40 H88 Cl4 Cu2 N8 O32 -","2","0.125","KA1268","Ng, Seik Weng; Chen, Xiao-Ming; Yang, Guang","Metallo-Ligand [Cu^II^(carboxylato)~4~]^2+^ Cores: Tetrakis(trimethylammonioacetato-<i>O</i>)copper Diperchlorate and its 1/1 Complex with Sodium Perchlorate","Acta Crystallographica Section C","1998","54","10","1389","1393","10.1107/S010827019800523X","","","0.71073","MoKα","","0.034","0.034","","","","0.087","","","","","","0.936","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007733","12.6528","0.0008","25.849","0.001","5.7717","0.0004","90","","102.626","0.004","90","","1842.06","0.19","298","2","298","2","","","","","","","","7","C 1 m 1","C -2y","8","Sodium tetrabetainecopper(II) perchlorate","Perchlorato-2κO-bis(μ-trimethylammonioacetato)-1:2κ^4^O- bis(trimethylammonioacetato)-1κ^2^O-coppersodium diperchlorate","","- C20 H44 Cl3 Cu N4 Na O20 -","- C20 H44 Cl3 Cu N4 Na O20 -","- C40 H88 Cl6 Cu2 N8 Na2 O40 -","2","0.5","KA1268","Ng, Seik Weng; Chen, Xiao-Ming; Yang, Guang","Metallo-Ligand [Cu^II^(carboxylato)~4~]^2+^ Cores: Tetrakis(trimethylammonioacetato-<i>O</i>)copper Diperchlorate and its 1/1 Complex with Sodium Perchlorate","Acta Crystallographica Section C","1998","54","10","1389","1393","10.1107/S010827019800523X","","","0.71073","MoKα","","0.085","0.075","","","","0.195","","","","","","1.466","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007734","12.167","0.001","14.712","0.002","10.18","0.001","90","","103.48","0.01","90","","1772","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[bis(benzimidazole-N^3^)copper(II)-μ-aqua-μ- acetylenedicarboxylato-O:O']","","- C18 H14 Cu N4 O5 -","- C18 H14 Cu N4 O5 -","- C72 H56 Cu4 N16 O20 -","4","0.5","KA1272","Sieroń, Lesław; Bukowska-Strzyżewska, Maria","Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-acetylenedicarboxylato-<i>O</i>:<i>O</i>'-μ-aqua] and Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-aqua-μ-fumarato-<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","1998","54","10","1431","1435","10.1107/S0108270198004880","","","0.71073","MoKα","","0.034","0.028","","","0.069","0.071","","","","","","1.08","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007735","12.941","0.002","13.292","0.002","10.398","0.002","90","","100.09","0.01","90","","1760.9","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[bis(benzimidazole-N^3^)copper(II)-μ-aqua-μ-fumarato-O:O']","","- C18 H16 Cu N4 O5 -","- C18 H16 Cu N4 O5 -","- C72 H64 Cu4 N16 O20 -","4","0.5","KA1272","Sieroń, Lesław; Bukowska-Strzyżewska, Maria","Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-acetylenedicarboxylato-<i>O</i>:<i>O</i>'-μ-aqua] and Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-aqua-μ-fumarato-<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","1998","54","10","1431","1435","10.1107/S0108270198004880","","","0.71073","MoKα","","0.048","0.035","","","0.076","0.079","","","","","","1.063","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007736","9.346","0.002","4.5979","0.0012","13.7798","0.0014","90","","105.164","0.011","90","","571.5","0.2","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","6-carboxy-2-pyridone","","","- C6 H5 N O3 -","- C6 H5 N O3 -","- C24 H20 N4 O12 -","4","1","KA1286","Sawada, Keiju; Ohashi, Yuji","2-Oxo-1,2-dihydropyridine-6-carboxylic Acid","Acta Crystallographica Section C","1998","54","10","1491","1493","10.1107/S0108270198007446","","","1.54184","CuKα","","0.093","0.051","","","","0.161","","","","","","1.024","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007737","6.6977","0.0007","7.9438","0.0005","10.81","0.0013","72.643","0.008","85.549","0.009","88.011","0.007","547.26","0.1","293","2","293","2","","","","","","","","4","P 1","P 1","1","","Complex of (-)-Morphine with β-Phenylhydracrylic Acid","","- C26 H29 N O6 -","- C26 H29 N O6 -","- C26 H29 N O6 -","1","1","LN1054","Lutz, Martin; Spek, Anthony L.","Complex of ({-})-Morphine with β-Phenylhydracrylic Acid","Acta Crystallographica Section C","1998","54","10","1477","1479","10.1107/S010827019800506X","","","0.71073","MoKα","","0.1096","0.0507","","","","0.1215","","","","","","1.049","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007738","11.632","0.003","11.835","0.002","22.412","0.004","90","","100.28","0.03","90","","3035.8","1.1","210","2","210","0.2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Cl2 I7 Rh S4 -","- C12 H24 Cl2 I7 Rh S4 -","- C48 H96 Cl8 I28 Rh4 S16 -","4","1","LN1058","Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Schröder, Martin","<i>trans</i>-Dichloro([16]aneS~4~)rhodium(III) Pentaiodide Diiodine","Acta Crystallographica Section C","1998","54","10","1410","1413","10.1107/S0108270198005964","","","0.71073","MoKα","","0.09","0.062","","0.134","0.116","","","","1.235","1.225","1.225","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007739","7.32","0.005","8.307","0.005","16.399","0.005","81.23","0.05","98.52","0.05","104.46","0.05","948","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H17 N O4 S3 -","- C18 H17 N O4 S3 -","- C36 H34 N2 O8 S6 -","2","1","MU1359","D.TranQui; P. Fresneau; M.Cussac","(<i>Z</i>)-5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidine-3-acetic Acid Dimethyl Sulfoxide Solvate","Acta Crystallographica Section C","1998","54","10","1501","1503","10.1107/S0108270198004600","","","0.71073","MoKα","","0.0573","0.0437","","0.137","0.1","","","","0.974","0.897","0.897","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007740","9.0038","0.0006","12.413","0.0005","6.6728","0.0008","96.458","0.006","99.231","0.008","75.48","0.004","710.57","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-Hydroxy-3-Methoxycarbonyl-2-Dimethoxyphosphoryl-2H-1-Benzopyran","","- C13 H15 O7 P -","- C13 H15 O8 P -","- C26 H30 O16 P2 -","2","1","NA1323","Olszak, Tomasz A.; Grabowski, Mieczysław J.; Modranka, R.; Kostka, K.; Olszak, Agnieszka","2<i>H</i>-1-Benzopyrans. III. 4-Hydroxy-3-methoxycarbonyl-2-dimethoxyphosphoryl-2<i>H</i>-1-benzopyran","Acta Crystallographica Section C","1998","54","10","1459","1461","10.1107/S0108270198005241","","","1.54178","CuKα","","0.055","0.047","","0.142","0.139","","","","1.142","1.231","1.231","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007741","9.118","0.001","9.149","0.002","17.633","0.001","90","","95.17","0.01","90","","1465","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","6,7-dihydroxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline hydrochloride","6,7-dihydroxy-1-phenyl-1,2,3,4-tetrahydroisoquinolinium chloride hydrate","","- C15 H18 Cl N O3 -","- C15 H18 Cl N O3 -","- C60 H72 Cl4 N4 O12 -","4","1","NA1324","Olszak, Tomasz A.","X-ray Structure Investigations of Potential β-Blockers. III","Acta Crystallographica Section C","1998","54","10","1456","1459","10.1107/S0108270198005459","","","1.54178","CuKα","","0.055","0.027","","","","0.057","","","","","","0.788","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007742","7.846","0.002","19.956","0.004","9.751","0.001","90","","94.6","0.01","90","","1521.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","6,7-dihydroxy-1-(2-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline hydrochloride","6,7-dihydroxy-1-(2-methoxyphenyl)-1,2,3,4-tetrahydroisoquinolinium chloride","","- C16 H18 Cl N O3 -","- C16 H18 Cl N O3 -","- C64 H72 Cl4 N4 O12 -","4","1","NA1324","Olszak, Tomasz A.","X-ray Structure Investigations of Potential β-Blockers. III","Acta Crystallographica Section C","1998","54","10","1456","1459","10.1107/S0108270198005459","","","1.54178","CuKα","","0.076","0.033","","","","0.062","","","","","","0.751","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007743","15.1362","0.0008","15.8851","0.0007","11.861","0.001","90","","90","","90","","2851.9","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","6,7-dihydroxy-1-(4-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline hydrochloride","6,7-dihydroxy-1-(4-nitrophenyl)-1,2,3,4-tetrahydroisoquinolinium chloride","","- C15 H15 Cl N2 O4 -","- C15 H15 Cl N2 O4 -","- C120 H120 Cl8 N16 O32 -","8","1","NA1324","Olszak, Tomasz A.","X-ray Structure Investigations of Potential β-Blockers. III","Acta Crystallographica Section C","1998","54","10","1456","1459","10.1107/S0108270198005459","","","1.54178","CuKα","","0.051","0.032","","","","0.084","","","","","","0.914","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007744","9.747","0.005","14.882","0.004","15.48","0.005","90","","90","","90","","2245.4","1.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,2,3,4,5,6,7,8,9,10-decahydro-3,3,6,6-tetramethyl-1,8-dioxo-10- vinylacridin-9-yl-methyl acetate","","- C23 H31 N O4 -","- C23 H31 N O4 -","- C92 H124 N4 O16 -","4","1","NA1326","R. Sankaranarayanan; D. Velmurugan; P. Murugan; N.Ramasubbu","1,2,3,4,5,6,7,8,9,10-Decahydro-3,3,6,6-tetramethyl-1,8-dioxo-10-vinylacridin-9-ylmethyl Acetate","Acta Crystallographica Section C","1998","54","10","1534","1535","10.1107/S0108270198005356","","","1.5418","CuKα","","0.108","0.052","","0.158","0.13","","","","1.089","1.175","1.175","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007745","11.301","0.002","8.665","0.001","13.422","0.001","90","","107.77","0.01","90","","1251.6","0.3","295","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C15 H13 N3 O -","- C15 H13 N3 O -","- C60 H52 N12 O4 -","4","1","NA1359","Kendi, Engin; Özbey, Süheyla; Karakurt, Arzu; Dalkara, Sevim","2-(Imidazol-1-yl)-1-(2-naphthyl)ethanone Oxime","Acta Crystallographica Section C","1998","54","10","1513","1515","10.1107/S0108270198005071","","","0.71069","MoKα","","","0.0452","","","0.0529","","","","","1.08","1.08","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007746","19.799","0.004","8.914","0.002","8.411","0.002","90","","107.75","0.01","90","","1413.8","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Tiosemicarbazide dihydrogen phosphate","Thiosemicarbazonium dihydrogen phosphate","","- C H8 N3 O4 P S -","- C H8 N3 O4 P S -","- C8 H64 N24 O32 P8 S8 -","8","1","NA1366","Waśkowska, Alicja","Thiosemicarbazid-1-ium Dihydrogenphosphate","Acta Crystallographica Section C","1998","54","10","1540","1542","10.1107/S0108270198006118","","","0.71073","MoKα","","0.061","0.039","","0.093","0.09","","","","1.049","1.107","1.107","","","","","has coordinates","209447","2020-10-21","18:00:00",""
"2007747","8.279","0.0001","13.2031","0.0001","9.6525","0.0001","90","","102.852","0.001","90","","1028.67","0.019","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Acetyl-4-methyl-heptanedinitrile","","- C10 H14 N2 O -","- C10 H14 N2 O -","- C40 H56 N8 O4 -","4","1","NA1367","Bolte, Michael; Pfizer, José; Weigand, Barbara-Sylvia","4-Acetyl-4-methylheptanedinitrile at 173K","Acta Crystallographica Section C","1998","54","10","1461","1462","10.1107/S0108270198006210","","","0.71073","MoKα","","0.044","0.04","","0.108","0.104","0.108","","","1.076","","","1.076","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007748","11.951","0.004","10.59","0.004","28.852","0.002","90","","91.57","0.01","90","","3650.2","1.9","296.2","","296","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H48 F6 N4 Ni O2 S2 -","- C32 H48 F6 N4 Ni O2 S2 -","- C128 H192 F24 N16 Ni4 O8 S8 -","4","1","OA1048","Ueyama, Norikazu; Tuji, Tomo-aki; Okamura,Taka-aki; Nakamura, Akira","Bis(tetraethylammonium) Bis[2-(trifluoroacetylamidato)benzenethiolato(2‒)-<i>S</i>,<i>N</i>]nickelate(II)","Acta Crystallographica Section C","1998","54","10","1424","1425","10.1107/S0108270198005551","","","0.7107","MoKα","","","0.045","","","0.047","","","","","1.828","1.828","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007749","9.872","0.001","15.779","0.001","7.229","0.001","96.31","0.01","91.13","0.01","82.2","0.01","1108.9","0.2","298.2","","298.2","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H28 N2 O2 -","- C26 H28 N2 O2 -","- C52 H56 N4 O4 -","2","1","OA1057","Mizuguchi, Jin","3,6-Bis(4-<i>tert</i>-butylphenyl)-1,2,4,5-tetrahydropyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione","Acta Crystallographica Section C","1998","54","10","1482","1484","10.1107/S0108270198005563","","","1.5418","CuKα","","","0.061","","","0.087","","","","","1.286","1.286","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007750","4.737","0.001","32.45","0.003","9.507","0.001","90","","100.27","0.01","90","","1438","0.4","298.2","","298.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-bis(2-phenylethyl)perylene-3,4:9,10-bis(dicarboximide)","","- C40 H26 N2 O4 -","- C40 H26 N2 O4 -","- C80 H52 N4 O8 -","2","0.5","OA1058","Mizuguchi, Jin","<i>N</i>,<i>N</i>'-Bis(2-phenethyl)perylene-3,4:9,10-bis(dicarboximide)","Acta Crystallographica Section C","1998","54","10","1479","1481","10.1107/S0108270198005575","","","1.5418","CuKα","","","0.076","","","0.109","","","","","1.34","1.34","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007751","14.939","0.003","6.078","0.004","19.74","0.002","90","","102.345","0.012","90","","1750.9","1.2","240","","240","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","8CB","4'-octyl-4-cyanobiphenyl","","- C21 H25 N -","- C21 H25 N -","- C84 H100 N4 -","4","1","OA1062","Kuribayashi, Miki; Hori, Kayako","4-Cyano-4'-octylbiphenyl","Acta Crystallographica Section C","1998","54","10","1475","1477","10.1107/S0108270198005952","","","1.54184","CuKα","","0.057","0.049","","0.153","0.144","","","","1.041","1.058","1.058","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007752","19.735","0.003","4.6","0.003","15.654","0.002","90","","104.22","0.02","90","","1377.5","0.9","303","2","303","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 Br N O2 -","- C16 H14 Br N O2 -","- C64 H56 Br4 N4 O8 -","4","1","OS1023","Elmali, Ayhan; Elerman, Yalc̨in; Svoboda, Ingrid","3-[(2-Bromo-4-methylphenyl)iminomethyl]-2-hydroxy-5-methylbenzaldehyde","Acta Crystallographica Section C","1998","54","10","1464","1466","10.1107/S0108270198008002","","","0.71073","MoKα","","0.124","0.041","","0.098","0.077","","","","0.989","1.133","1.133","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007753","17.232","0.001","7.294","0.001","23.241","0.002","90","","95.27","0.01","90","","2908.8","0.5","183","2","183","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(R,R)-trans-1,2-Bis(2-hydroxyphenyl)cyclopentane,bis(R)-O-methylmandelic acid ester","","- C35 H34 O6 -","- C35 H34 O6 -","- C140 H136 O24 -","4","2","QA0050","Lynch, Vincent M.; Apodaca, Richard; Whitesell, James K.; Chou, Ming I.","<i>trans</i>-(<i>R</i>,<i>R</i>)-2,2'-(Cyclopenta-1,2-diyl)diphenyl Bis[(<i>R</i>)-<i>O</i>-methylmandelate]","Acta Crystallographica Section C","1998","54","10","IUC9800052","","10.1107/S0108270198099296","","","0.71073","MoKα","","0.1099","0.052","","0.105","0.0856","","","","1.03","1.11","1.11","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007754","21.262","0.006","3.837","0.004","13.972","0.004","90","","108.02","0.02","90","","1084","1.2","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-pyridinecarboxylic acid","","- C6 H5 N O2 -","- C6 H5 N O2 -","- C48 H40 N8 O16 -","8","1","QA0051","Hamazaki, Hiroshi; Hosomi, Hiroyuki; Takeda, Sadamu; Kataoka, Hiroshi; Ohba, Shigeru","2-Pyridinecarboxylic Acid","Acta Crystallographica Section C","1998","54","10","IUC9800049","","10.1107/S0108270198099314","","","0.71073","MoKα","","","0.041","","","","0.041","","","","","","1.2","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007755","12.669","0.002","14.102","0.005","11.193","0.006","90","","99.21","0.03","90","","1973.9","1.3","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","sp-9-(o-tert-Butylphenyl)-3-(methylthio)fluorene","","- C24 H24 S -","- C24 H24 S -","- C96 H96 S4 -","4","1","QA0052","Robinson, Paul D.; Hou, Yuqing; Meyers, Cal Y.","<i>sp</i>-9-(<i>o</i>-<i>tert</i>-Butylphenyl)-3-(methylthio)fluorene: a Major Rearrangement Product from the Facile Uncatalyzed Decomposition of <i>ap</i>-9-(<i>o</i>-<i>tert</i>-Butylphenyl)-9-(methylthio)fluorene","Acta Crystallographica Section C","1998","54","10","IUC9800051","","10.1107/S0108270198099302","","","0.71069","MoKα","","0.1062","0.0415","","","","0.1431","","","","","","1.013","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007756","19.048","0.0009","19.048","0.0009","9.053","0.0004","90","","90","","120","","2844.6","0.2","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","catena-tris(μ-Glycine)-scandium(III) tri-perchlorate","","- C6 H15 Cl3 N3 O18 Sc -","- C6 H15 Cl3 N3 O18 Sc -","- C36 H90 Cl18 N18 O108 Sc6 -","6","0.333333","QA0053","Wang, Zhe-Ming; Lu, Zhi; Liao, Chun-Sheng; Yan, Chun-Hua","Tris(glycine)scandium(III) Triperchlorate: a Space-Group Correction","Acta Crystallographica Section C","1998","54","10","IUC9800050","","10.1107/S0108270198099338","","","0.71073","MoKα","","0.0362","0.0283","","","","0.0772","","","","","","1.083","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007757","17.186","0.003","18.936","0.004","17.406","0.004","90","","90","","90","","5665","2","298","","298","","","","","","","","","6","C m c a","-C 2ac 2","64","","Ethanaminium, N,N,N-triethyl-, tetra-.mu.-carbonyleicosacarbonyldithalla- hexaferrate (2-) (2Fe-Fe) (8Fe-Tl) (2:1)","","- C40 H40 Fe6 N2 O24 Tl2 -","- C40 H40 Fe6 N2 O24 Tl2 -","- C160 H160 Fe24 N8 O96 Tl8 -","4","","QA0054","Guzman-Jimenez, Ilse Y.; Whitmire, Kenton H.","Bis(tetraethylammonium) tetra-μ-carbonyl-icosacarbonylhexairondithallate(2 <i>Fe</i>—<i>Fe</i>)(8 <i>Fe</i>—<i>Tl</i>)(2‒)","Acta Crystallographica Section C","1998","54","10","IUC9800053","","10.1107/S0108270198099326","","","0.71073","MoKα","","0.1755","0.0492","","0.169","0.1163","","","","1.054","1.099","1.099","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007758","8.34","0.002","11.6","0.002","20.898","0.003","90","","101.27","0.03","90","","1982.8","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H34 Cu2 N14 O2 S4 -","- C32 H34 Cu2 N14 O2 S4 -","- C64 H68 Cu4 N28 O4 S8 -","2","0.5","SK1117","Chun-Ying, Duan; Xiao-Zeng, You; T.C.W.Mak","Bis[μ-(di-2-pyridyl ketone thiosemicarbazonato-<i>N</i>^1^,<i>N</i>'',<i>S</i>:<i>N</i>')]bis[(isothiocyanato-<i>N</i>)copper(II)] Bis(dimethylformamide) Solvate","Acta Crystallographica Section C","1998","54","10","1395","1397","10.1107/S0108270198004843","","","0.71073","MoKα","","0.0535","0.0396","","0.1207","0.1033","","","","1.118","1.176","1.176","","","","","has coordinates","197922","2020-10-21","18:00:00",""
"2007759","22.457","0.002","13.346","0.001","12.896","0.001","90","","113.66","0.01","90","","3540.2","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[di-[(2-pyridine)ketone thiosemicarbazone]copper(II) acetate ] dimethanol","","- C30 H34 Cu2 N10 O6 S2 -","- C30 H34 Cu2 N10 O6 S2 -","- C120 H136 Cu8 N40 O24 S8 -","4","0.5","SK1118","Chun-Ying Duan; Xiao-Zeng You; T.C.W. Mak","Bis[μ-(di-2-pyridyl ketone thiosemicarbazonato-<i>N</i>^1^,<i>N</i>'',<i>S</i>:<i>N</i>')]bis[(acetato-<i>O</i>)copper(II)] Dimethanol Solvate","Acta Crystallographica Section C","1998","54","10","1397","1399","10.1107/S0108270198004764","","","0.71073","MoKα","","0.107","0.0637","","0.2548","0.1682","","","","1.024","1.146","1.146","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007760","19.464","0.002","10.087","0.002","13.993","0.002","90","","105.993","0.009","90","","2641","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis{dimethyl[2,6-diacetylpyridinebis(2-furanecarboxylhydrazone)]tin(IV)} trans[dimethyltetraclorostannate(IV)]","","- C44 H50 Cl4 N10 O8 Sn3 -","- C44 H50 Cl4 N10 O8 Sn3 -","- C88 H100 Cl8 N20 O16 Sn6 -","2","0.5","SK1125","Francisco, Regina H. P.; Moreno, Patricia C.; Gambardella, M. Teresa do P.; Sousa, Gerimario F. de; Mangas, M. Beatriz P.; Abras, Anuar","Bis{[2,6-diacetylpyridine bis(2-furoylhydrazone)(1‒)]dimethyltin(IV)} <i>trans</i>-Tetrachlorodi-methylstannate(IV)","Acta Crystallographica Section C","1998","54","10","1444","1446","10.1107/S0108270198005940","","","0.71073","MoKα","","0.106","0.038","","0.092","0.068","","","","1.076","1.032","1.032","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007761","10.153","0.002","13.824","0.003","11.673","0.003","90","","110.14","0.02","90","","1538.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-diphenylguanidinium trifluoroacetate","","- C15 H14 F3 N3 O2 -","- C15 H14 F3 N3 O2 -","- C60 H56 F12 N12 O8 -","4","1","SK1182","Paixão, J. A.; Pereira Silva, P. S.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.","1,3-Diphenylguanidinium Trifluoroacetate","Acta Crystallographica Section C","1998","54","10","1484","1486","10.1107/S0108270198005095","","","0.71073","MoKα","","0.103","0.039","","","","0.123","","","","","","0.987","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007762","8.582","0.005","9.609","0.005","31.213","0.005","90","0.005","90","0.005","90","0.005","2574","2","292","2","292","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2-phenyl-cis-4,6-dimethyl-1,3-diselenane","","- C12 H16 Se2 -","- C12 H16 Se2 -","- C96 H128 Se16 -","8","1","SK1184","Baudoux, Guy; Norberg, Bernadette; Wouters, Johan; Defrère, Laurent; Krief, Alain; Evrard, Guy","<i>cis</i>-4,6-Dimethyl-2-phenyl-1,3-diselenane","Acta Crystallographica Section C","1998","54","10","1505","1507","10.1107/S0108270198004235","","","1.54178","CuKα","","0.0415","0.0371","","","","0.1025","","","","","","1.077","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007763","9.571","0.004","12.773","0.006","13.486","0.006","66.39","0.03","74.97","0.03","80.84","0.03","1456.1","1.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","bis(tetraphenylphosphonium) μ-oxalato-O^1^,O^2^:O^1^',O^2^' -bis[aqua(oxalato-O^1^,O^2^)oxovanadium(IV)] octahydrate","","- C54 H60 O24 P2 V2 -","- C54 H60 O24 P2 V2 -","- C54 H60 O24 P2 V2 -","1","0.5","SK1188","Zheng, Li-Min; Schmalle, Helmut W.; Ferlay, Sylvie; Decurtins, Silvio","A Dinuclear Vanadyl‒Oxalate Compound","Acta Crystallographica Section C","1998","54","10","1435","1438","10.1107/S0108270198006520","","","0.71073","MoKα","","0.101","0.044","","","","0.121","","","","","","1.092","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007764","29.1351","0.0009","10.4189","0.0002","20.0512","0.0006","90","","116.766","0.001","90","","5434.5","0.3","130","1","130","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,1,1-Tris(4-hydroxyphenyl)ethane-4,4'-bipyridyl (2/3)","","- C70 H60 N6 O6 -","- C70 H60 N6 O6 -","- C280 H240 N24 O24 -","4","0.5","SK1190","Bényei, Attila C.; Coupar, Pamela I.; Ferguson, George; Glidewell, Christopher; Lough, Alan J.; Meehan, Paul R.","Tenfold Interpenetration of Giant Hexagonal <i>R</i>^12^~12~(126) Nets in the Hydrogen-Bonded Structure of 1,1,1-Tris(4-hydroxyphenyl)ethane‒4,4'-Bipyridyl (2/3)","Acta Crystallographica Section C","1998","54","10","1515","1519","10.1107/S0108270198004624","","","0.7107","MolybdenumKα","","0.0646","0.0408","","","","0.1079","","","","","","0.938","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007765","6.5478","0.0002","9.9048","0.0003","10.8386","0.0004","90","","95.791","0.004","90","","699.35","0.04","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichlorodimethyltin.4,4'-bipyridine","","- C12 H14 Cl2 N2 Sn -","- C12 H14 Cl2 N2 Sn -","- C24 H28 Cl4 N4 Sn2 -","2","0.5","SK1191","Ng, Seik Weng","<i>catena</i>-Poly[(dichlorodimethyltin)-μ-(4,4'-bipyridine-<i>N</i>:<i>N</i>')]","Acta Crystallographica Section C","1998","54","10","1393","1395","10.1107/S0108270198005484","","","0.71073","MoKα","","0.029","0.023","","","","0.061","","","","","","1.019","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007766","8.1259","0.0006","32.017","0.002","13.011","0.001","90","","103.065","0.007","90","","3297.4","0.4","298","2","298","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Bis(aquatriphenyltin) succinate^.^2[2,4,6-tris(2-pyridyl)-1,3,5-triazine]","","- C76 H62 N12 O6 Sn2 -","- C76 H62 N12 O6 Sn2 -","- C152 H124 N24 O12 Sn4 -","2","0.5","SK1192","Ng, Seik Weng","Outer-Sphere Coordination of a Multidentate <i>N</i>-Heterocycle to Tin Through Water: Monoclinic and Triclinic Modifications of μ-Succinato-bis(aquatriphenyltin)‒2,4,6-Tris(2-pyridyl)-1,3,5-triazine (1/2)","Acta Crystallographica Section C","1998","54","10","1386","1389","10.1107/S0108270198004776","","","0.71073","MoKα","","0.073","0.0397","","","","0.0848","","","","","","0.99","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007767","9.2219","0.0008","12.567","0.002","15.616","0.002","78.73","0.01","73.681","0.009","80.395","0.009","1691.3","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis(aquatriphenyltin) succinate^.^2[2,4,6-tris(2-pyridyl)-1,3,5-triazine","","- C76 H62 N12 O6 Sn2 -","- C76 H62 N12 O6 Sn2 -","- C76 H62 N12 O6 Sn2 -","1","0.5","SK1192","Ng, Seik Weng","Outer-Sphere Coordination of a Multidentate <i>N</i>-Heterocycle to Tin Through Water: Monoclinic and Triclinic Modifications of μ-Succinato-bis(aquatriphenyltin)‒2,4,6-Tris(2-pyridyl)-1,3,5-triazine (1/2)","Acta Crystallographica Section C","1998","54","10","1386","1389","10.1107/S0108270198004776","","","0.71073","MoKα","","0.0605","0.0412","","","","0.0945","","","","","","1.016","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007768","8.9189","0.0011","18.2124","0.0014","16.813","0.002","90","","103.134","0.011","90","","2659.6","0.5","294","1","294","1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","1,4-Dimethylpyridinium [1,3-dithiole-2-thione-4,5-dithiolato)diphenyl(thiocyanato-N)stannate(1-)]","","- C23 H20 N2 S6 Sn -","- C23 H20 N2 S6 Sn -","- C92 H80 N8 S24 Sn4 -","4","1","SK1198","Khan, Abdullah; Low, John N.; Wardell, James L.; Ferguson, George","1,4-Dimethylpyridinium (1,3-dithiole-2-thione-4,5-dithiolato)(isothiocyanato)diphenylstannate(1‒)","Acta Crystallographica Section C","1998","54","10","1399","1401","10.1107/S0108270198005496","","","0.7107","MoKα","","0.07","0.038","","","","0.096","","","","","","1.004","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007769","11.0167","0.001","13.6197","0.0008","15.4733","0.0011","90","","90","","90","","2321.7","0.3","294","1","294","1","","","","","","","","7","P n m a","-P 2ac 2n","62","","Tetraethylammonium [bromo(1,3-dithiole-2-one-4,5-dithiolato) diethylstannate(1-)]","","- C15 H30 Br N O S4 Sn -","- C15 H26.34 Br N O S4 Sn -","- C60 H105.36 Br4 N4 O4 S16 Sn4 -","4","0.5","SK1200","Chohan, Zahid H.; Wardell, James L.; Low, John N.; Meehan, Paul R.; Ferguson, George","Tetraethylammonium Bromo(1,3-dithiol-2-one-4,5-dithiolato)diethylstannate(1‒)","Acta Crystallographica Section C","1998","54","10","1401","1403","10.1107/S0108270198006027","","","0.7107","MoKα","","0.11","0.048","","","","0.153","","","","","","1.021","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007770","13.378","0.0006","20.6464","0.0006","6.251","0.0004","90","","90","","90","","1726.57","0.14","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-amino-5-chloro-2-methoxy-N-[(2S,4S)-1-ethyl-2-hydroxymethyl-4-pyrrolidinyl ] benzamide","","- C15 H22 Cl N3 O3 -","- C15 H22 Cl N3 O3 -","- C60 H88 Cl4 N12 O12 -","4","1","SX1037","Tsutomu Adachi; Jun-Ichi Mizoguchi; Yasuo Hayashi; Yuko Yamashoji; Nobuko Kanehisa; Yasushi Kai; Yoshihisa Inoue","New Gastroprokinetic Agent TKS159: 4-Amino-5-chloro-<i>N</i>-[(2<i>S</i>,4<i>S</i>)-1-ethyl-2-hydroxymethyl-4-pyrrolidinyl]-2-methoxybenzamide","Acta Crystallographica Section C","1998","54","10","1527","1529","10.1107/S0108270198003722","","","1.54178","CuKα","","","0.046","","","0.0647","","","","","1.895","1.895","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007771","12.672","0.003","15.43","0.003","14.731","0.003","90","","114.77","0.03","90","","2615.3","1.2","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1H-1,3-oxazino[3,2-d][1,5]benzothiazepin-1-one","6-(4-chlorophenyl)-3-methyl-2,4a-diphenyl-4a,5,6,12-tetrahydro-1H- 1,3-oxazino[3,2-d][1,5]benzothiazepin-1-one","","- C31 H24 Cl N O2 S -","- C31 H24 Cl N O2 S -","- C124 H96 Cl4 N4 O8 S4 -","4","1","TA1209","Xu, Jiaxi; Jin, Sheng; Zhang, Zeying; Mak, Thomas C. W.","6-(4-Chlorophenyl)-3-methyl-2,4a-diphenyl-5,6-dihydro-1<i>H</i>,4a<i>H</i>-1,3-oxazino[2,3-<i>d</i>][1,5]benzothiazepin-1-one","Acta Crystallographica Section C","1998","54","10","1525","1527","10.1107/S0108270198005630","","","0.71073","MoKα","","0.135","0.055","","0.087","0.069","","","","0.973","1.48","1.48","","","","","has coordinates","198487","2020-10-21","18:00:00",""
"2007772","4.8635","0.0007","13.0125","0.0018","12.658","0.0018","90","","97.832","0.003","90","","793.61","0.19","203","2","203","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(R)-[Methyl 2,3-di-O-methyl-4,6-O-(phenylmethylene)α-D-glucopyranoside]","","- C16 H22 O6 -","- C16 H22 O6 -","- C32 H44 O12 -","2","1","TA1212","Rickard, Clifton E. F.; Woodgate, Paul D.; Zhao, Zhongde","η^6^-Tricarbonylchromium Complexes of Methyl 4,6-<i>O</i>-Benzylidene-α-<small>D</small>-glucopyranosides","Acta Crystallographica Section C","1998","54","10","1420","1424","10.1107/S0108270198005976","","","0.71073","MoKα","","0.146","0.072","","","","0.202","","","","","","0.945","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007773","8.3014","0.0002","13.8503","0.0002","17.7567","0.0005","90","","90","","90","","2041.61","0.08","203","2","203","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Tricarbonyl[(R)-[methyl 2,3-di-O-methyl-4,6-O-[(η^6^-phenyl)methylene]- α-D-glucopyranoside]chromium(0)","","- C19 H22 Cr O9 -","- C19 H22 Cr O9 -","- C76 H88 Cr4 O36 -","4","1","TA1212","Rickard, Clifton E. F.; Woodgate, Paul D.; Zhao, Zhongde","η^6^-Tricarbonylchromium Complexes of Methyl 4,6-<i>O</i>-Benzylidene-α-<small>D</small>-glucopyranosides","Acta Crystallographica Section C","1998","54","10","1420","1424","10.1107/S0108270198005976","","","0.71073","MoKα","","0.129","0.067","","","0.103","0.125","","","","","","1.065","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007774","7.9722","0.0002","8.5924","0.0002","16.0785","0.0004","90","","92.72","0.001","90","","1100.14","0.05","203","2","203","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(1'R,2'S')-Tricarbonyl[(R)-[methyl 2,3-di-O-methyl-4,6-O-[[1',2',3',4',5',6'- η]-2'-[(methylthio)phenyl]methylene]-α-D-glucopyranoside]chromium(0)","","- C20 H24 Cr O9 S -","- C20 H24 Cr O9 S -","- C40 H48 Cr2 O18 S2 -","2","1","TA1212","Rickard, Clifton E. F.; Woodgate, Paul D.; Zhao, Zhongde","η^6^-Tricarbonylchromium Complexes of Methyl 4,6-<i>O</i>-Benzylidene-α-<small>D</small>-glucopyranosides","Acta Crystallographica Section C","1998","54","10","1420","1424","10.1107/S0108270198005976","","","0.71073","MoKα","","0.04","0.034","","","0.092","0.103","","","","","","1.105","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007775","22.3782","0.0001","11.4738","0.0001","13.8548","0.0002","90","","108.007","0.001","90","","3383.15","0.06","203","2","203","2","","","","","","","","6","C 1 2 1","C 2y","5","","(1'R,2'S')-Tricarbonyl[(R)-[methyl 2,3-O-methyl-4,6-O-[[1',2',3',4',5',6'- η]-2'-[(diphenylphosphino)phenyl]methylene]-α-D-glucopyranoside]]- chromium(0) dichloromethane solvate","","- C32 H33 Cl2 Cr O9 P -","- C32 H33 Cl2 Cr O9 P -","- C128 H132 Cl8 Cr4 O36 P4 -","4","1","TA1212","Rickard, Clifton E. F.; Woodgate, Paul D.; Zhao, Zhongde","η^6^-Tricarbonylchromium Complexes of Methyl 4,6-<i>O</i>-Benzylidene-α-<small>D</small>-glucopyranosides","Acta Crystallographica Section C","1998","54","10","1420","1424","10.1107/S0108270198005976","","","0.71073","MoKα","","0.035","0.03","","","0.077","0.08","","","","","","1.045","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007776","8.482","0.0002","9.0429","0.0003","28.6178","0.0008","90","","90","","90","","2195.04","0.11","203","2","203","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Tricarbonyl[(R)-[methyl 2,3-di-O-methyl-4,6-O-[[1',2',3',4',5,'6'-η]-4'- (methoxyphenyl)methylene]-α-D-glucopyranoside]]chromium(0)","","- C20 H24 Cr O10 -","- C20 H24 Cr O10 -","- C80 H96 Cr4 O40 -","4","1","TA1212","Rickard, Clifton E. F.; Woodgate, Paul D.; Zhao, Zhongde","η^6^-Tricarbonylchromium Complexes of Methyl 4,6-<i>O</i>-Benzylidene-α-<small>D</small>-glucopyranosides","Acta Crystallographica Section C","1998","54","10","1420","1424","10.1107/S0108270198005976","","","0.71073","MoKα","","0.028","0.026","","","0.071","0.072","","","","","","1.061","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007777","5.2442","0.0005","8.938","0.002","9.731","0.002","75.01","0.02","77.72","0.02","73.06","0.01","416.8","0.14","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- H5 N O8 P2 Zn2 -","- H N O8 P2 Zn2 -","- H2 N2 O16 P4 Zn4 -","2","1","TA1214","Bircsak, Zsolt; Harrison, William T. A.","(NH~4~)Zn~2~(PO~4~)(HPO~4~)","Acta Crystallographica Section C","1998","54","10","1383","1385","10.1107/S0108270198005988","","","0.71073","MoKα","","","0.033","","","0.031","","","","","1.16","1.16","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007778","8.759","0.0005","10.554","0.0012","10.6064","0.0014","114.116","0.014","96.957","0.007","97.535","0.007","870.48","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H17 Cl N2 -","- C22 H17 Cl N2 -","- C44 H34 Cl2 N4 -","2","1","BK1362","Song, Hyun; Shin, Hyun-So","The Antifungal Drug Clotrimazole","Acta Crystallographica Section C","1998","54","11","1675","1677","10.1107/S0108270198006386","","","0.71069","MoKα","","0.0521","0.037","","0.0923","0.086","","","","1.01","1.06","1.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007779","7.4173","0.0011","14.326","0.002","13.077","0.003","90","","90.14","0.013","90","","1389.6","0.4","153","2","153.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H10 Cl N2 O3 Re -","- C13 H10 Cl N2 O3 Re0.5 -","- C52 H40 Cl4 N8 O12 Re2 -","4","0.5","BK1384","Suzanne Bélanger; Joseph T. Hupp; Charlotte L. Stern","<i>fac</i>-Tricarbonylchlorobis(pyridine-<i>N</i>)rhenium and <i>fac</i>-Tricarbonylchlorobis(4,4'-bipyridine-<i>N</i>)rhenium","Acta Crystallographica Section C","1998","54","11","1596","1600","10.1107/S0108270198006398","","","0.7107","MoKα","","0.0221","0.015","","0.02","0.019","","","","1.888","1.95","1.95","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007780","7.126","0.002","14.658","0.003","21.517","0.006","90","","98.63","0.02","90","","2222.1","1","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H16 Cl N4 O3 Re -","- C23 H16 Cl N4 O3 Re -","- C92 H64 Cl4 N16 O12 Re4 -","4","1","BK1384","Suzanne Bélanger; Joseph T. Hupp; Charlotte L. Stern","<i>fac</i>-Tricarbonylchlorobis(pyridine-<i>N</i>)rhenium and <i>fac</i>-Tricarbonylchlorobis(4,4'-bipyridine-<i>N</i>)rhenium","Acta Crystallographica Section C","1998","54","11","1596","1600","10.1107/S0108270198006398","","","0.7107","MoKα","","","0.033","","","0.028","","","","","1.49","1.49","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007781","5.0309","0.0006","7.7455","0.0006","16.276","0.001","90","","90","","90","","634.22","0.1","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(4R)-(-)-2-thioxothiazolidine-4-carboxylic acid","","","- C4 H5 N O2 S2 -","- C4 H5 N O2 S2 -","- C16 H20 N4 O8 S8 -","4","1","BK1393","Dobson, Allison J.; Gerkin, Roger E.","(4<i>R</i>)-({-})-2-Thioxothiazolidine-4-carboxylic Acid (Raphanusamic Acid)","Acta Crystallographica Section C","1998","54","11","1634","1637","10.1107/S0108270198006416","","","0.71073","MoKα","","","0.025","","","0.033","","","","","2.15","2.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007782","30.229","0.015","13.009","0.003","14.157","0.007","90","","102.42","0.04","90","","5437","4","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","cis-(2,2-Bipyridyl)(carbonyl)(carboxylato) (η^2^-2,2':6',2''-terpyridyl)ruthenium(II) Hexafluorophosphate","","- C27 H20 F6 N5 O3 P Ru -","- C27 H20 F5.96 N5 O3 P Ru -","- C216 H160 F47.68 N40 O24 P8 Ru8 -","8","1","BK1398","Gibson, Dorothy H.; Sleadd, Bradley A.; Mashuta, Mark S.; Richardson, John F.","<i>cis</i>-(2,2'-Bipyridyl-<i>N</i>,<i>N</i>')carbonyl(methanoato-<i>C</i>)(η^2^-2,2':6',2''-terpyridyl-<i>N</i>,<i>N</i>')ruthenium(II) Hexafluorophosphate","Acta Crystallographica Section C","1998","54","11","1584","1586","10.1107/S0108270198006428","","","0.7107","MoKα","","0.052","0.04","","0.045","0.044","","","","3.28","2.76","2.76","","","","","has coordinates","198851","2020-10-21","18:00:00",""
"2007783","20.674","0.003","20.674","0.003","5.804","0.001","90","","90","","90","","2480.7","0.7","293","2","293","2","","","","","","","","5","P 42/n :2","-P 4bc","86","Cu(prop)~2~(mpc)~2~.1/4H~2~O","","","- C20 H26.5 Cu N4 O8.25 -","- C20 H26 Cu N4 O8.24 -","- C80 H104 Cu4 N16 O32.96 -","4","0.5","BM1193","Koman, Marian; Melník, Milan; Glowiak, Tadeus","Bis(methyl 3-pyridyl-κ<i>N</i>^1^-carbamate)bis(propionato-κ<i>O</i>)copper(II)‒Water (4/1)","Acta Crystallographica Section C","1998","54","11","1604","1605","10.1107/S0108270198006313","","","1.5418","CuKα","","0.094","0.043","","0.165","0.117","","","","0.789","0.921","0.921","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007784","14.768","0.003","7.057","0.001","17.999","0.004","90","","112.81","0.03","90","","1729.1","0.7","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","spiro[fluorene-chromenes]","spiro[fluorene-9,2'-[2H]naphto[1,2-b]pyrane","","- C25 H16 O -","- C25 H16 O -","- C100 H64 O4 -","4","1","BM1220","Aldoshin, Sergei; Chuev, Igor; Filipenko, Olga; Pozzo, Jean Luc; Lokshin, Vladimir; Pèpe, Gérard","Photochromic Properties of Spiro[fluorene-chromenes]","Acta Crystallographica Section C","1998","54","11","1720","1722","10.1107/S0108270198004727","","","1.54178","CuKα","","0.0789","0.0383","","0.1438","0.1049","","","","1.18","1.122","1.122","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007785","9.876","0.003","11.156","0.004","11.281","0.004","64.72","0.02","65.51","0.02","80.78","0.02","1022.5","0.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Spiro[fluorene-chromenes]","spiro[7H-benzofurano[3,2-g]-chromene-7,9'-fluorene]","","- C28 H22 O2 -","- C28 H22 O2 -","- C56 H44 O4 -","2","1","BM1220","Aldoshin, Sergei; Chuev, Igor; Filipenko, Olga; Pozzo, Jean Luc; Lokshin, Vladimir; Pèpe, Gérard","Photochromic Properties of Spiro[fluorene-chromenes]","Acta Crystallographica Section C","1998","54","11","1720","1722","10.1107/S0108270198004727","","","0.71073","MoKα","","0.047","0.0441","","0.0911","0.0903","","","","1.005","1.227","1.227","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007786","8.769","0.0001","9.5801","0.0003","11.0747","0.0003","80.513","0.001","72.546","0.001","71.89","0.002","840.93","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dichlorobis(quinoline-N)zinc(II)","","- C18 H14 Cl2 N2 Zn -","- C18 H14 Cl2 N2 Zn -","- C36 H28 Cl4 N4 Zn2 -","2","1","BM1252","Yong Cui; Deliang Long; Wendan Chen; Jinshun Huang","Dichlorobis(quinoline-<i>N</i>)zinc(II)","Acta Crystallographica Section C","1998","54","11","1605","1607","10.1107/S0108270198007240","","","0.71073","MoKα","","0.056","0.049","","0.131","0.126","","","","1.02","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007787","9.466","0.003","9.564","0.003","14.842","0.006","77.46","0.03","71.93","0.03","73.94","0.03","1214.8","0.8","143","2","143","2","","","","","","","","6","P -1","-P 1","2","","1,4,7,1O,13,16-Hexaoxacyclooctadecane‒ Dimethyl Sulfoxide‒bis(4-fluorophenylsulfonyl)amine (1/2/2)","","- C40 H54 F4 N2 O16 S6 -","- C40 H54 F4 N2 O16 S6 -","- C40 H54 F4 N2 O16 S6 -","1","0.5","BM1256","Wijaya, Karna; Moers, Oliver; Blaschette, Armand; Jones, Peter G.","Polysulfonylamines. CVI. 1,4,7,10,13,16-Hexaoxacyclooctadecane‒Dimethyl Sulfoxide‒Bis(4-fluorophenylsulfonyl)amine (1/2/2)","Acta Crystallographica Section C","1998","54","11","1707","1710","10.1107/S0108270198007203","","","0.71073","MoKα","","0.034","0.031","","0.084","0.081","","","","1.061","1.073","1.073","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007788","10.935","0.001","15.064","0.001","17.577","0.001","84.467","0.006","80.458","0.007","86.175","0.007","2838.2","0.4","150","","150","","","","","","","","","3","P -1","-P 1","2","triphenylphosphine","triphenylphosphine","","- C18 H15 P -","- C18 H15 P -","- C144 H120 P8 -","8","4","BM1260","Kooijman, Huub; Spek, Anthony L.; Bommel, Kjeld J.C. van; Verboom, Willem; Reinhoudt, David N.","A Triclinic Modification of Triphenylphosphine","Acta Crystallographica Section C","1998","54","11","1695","1698","10.1107/S0108270198009305","","","0.71073","MoKα","","0.101","0.0532","","","","0.1346","","","","","","1.017","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007789","11.297","0.001","6.949","0.001","13.732","0.002","90","","91.95","0.01","90","","1077.4","0.2","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 N O3 -","- C13 H11 N O3 -","- C52 H44 N4 O12 -","4","1","BS1036","Duque Rodríguez, Julio; Pomés Hernández, Ramón; Punte, Graciela; Hechevarría, Gustavo; Suárez Navarro, Margarita; Verdecia Reyes, Yamila; Ochoa Rodríguez, Estael; Pita Mieres, Beatriz","5-Oxo-4-phenyl-1,2,3,4,5,7-hexahydrofuro[3,4-<i>b</i>]-2(1<i>H</i>)-pyridone","Acta Crystallographica Section C","1998","54","11","1642","1644","10.1107/S0108270197017988","","","0.71069","MoKα","","0.259","0.054","","0.182","0.088","","","","1.065","1.162","1.162","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007790","8.983","0.002","21.125","0.004","13.196","0.003","90","","90","","90","","2504.2","0.9","293","2","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H15 N O3 -","- C14 H15 N O3 -","- C112 H120 N8 O24 -","8","1","BS1040","Duque Rodríguez, Julio; Pomés Hernández, Ramón; Gómez González, Ariel; Suárez Navarro, Margarita; Verdecia Reyes, Yamila; Ochoa Rodríguez, Estael; Mascarenhas, Yvonne","5-Methoxycarbonyl-6-methyl-4-phenyl-3,4-dihydro-2(1<i>H</i>)-pyridone","Acta Crystallographica Section C","1998","54","11","1644","1645","10.1107/S010827019701799X","","","0.71069","MoKα","","0.168","0.0499","","0.1662","0.0996","","","","1.082","1.165","1.165","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007791","10.901","0.002","10.901","0.002","17.403","0.002","90","","90","","90","","2068","0.6","296.2","","296.2","","","","","","","","","6","I 4/m","-I 4","87","","hexamethylthiobenzenecopper(I) hexafluorophosphate","","- C12 H18 Cu F6 P S6 -","- C12 H18 Cu F6 P S6 -","- C48 H72 Cu4 F24 P4 S24 -","4","0.25","CF1226","Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Munakata, Megumu; Maekawa, Masahiko; Morimoto, Hiroshi","A Linear-Chain Copper(I) Coordination Polymer with Hexakis(methylthio)benzene","Acta Crystallographica Section C","1998","54","11","1566","1569","10.1107/S010827019800643X","","","0.7107","MoKα","","","0.031","","","0.04","","","","","1.31","1.31","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007792","9.7987","0.0008","19.1424","0.0014","13.3366","0.0011","90","","98.816","0.007","90","","2472","0.3","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,4-dichloro-6-exo-9-endo-bis(dimethylphenylphosphino)- arachno-decaborane(10)","","- C16 H32 B10 Cl2 P2 -","- C16 H32 B10 Cl2 P2 -","- C64 H128 B40 Cl8 P8 -","4","1","CF1228","Dörfler, Udo; McGrath, Thomas D.; Cooke, Paul A.; Kennedy, John D.; Thornton-Pett, Mark","2,4-Cl~2~-6,9-<i>exo</i>,<i>endo</i>-(PMe~2~Ph)~2~-<i>arachno</i>-B~10~H~10~","Acta Crystallographica Section C","1998","54","11","1703","1705","10.1107/S0108270198005666","","","1.54186","CuKα","","0.039","0.034","","","","0.09","","","","","","1.054","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007793","7.3161","0.0005","10.9267","0.0014","11.2045","0.001","83.479","0.009","76.746","0.008","73.386","0.007","834.33","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis acetato-2,2'-bipyridylamine copper(II). Dihydrate","","- C14 H19 Cu N3 O6 -","- C14 H19 Cu N3 O6 -","- C28 H38 Cu2 N6 O12 -","2","1","CF1235","Sujittra Youngme; Chaveng Pakawatchai; Hoong-Kun Fun; Kandasamy Chinnakali","Bis(acetato-κ^2^<i>O</i>,<i>O</i>')(di-2-pyridyl-κ<i>N</i>-amine)copper(II) Dihydrate","Acta Crystallographica Section C","1998","54","11","1586","1588","10.1107/S0108270198006441","","","0.71073","MoKα","","0.032","0.03","","0.085","0.084","","","","1.071","1.103","1.103","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007794","5.161","0.001","17.694","0.004","13.155","0.003","90","","96.64","0.03","90","","1193.2","0.5","293","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(1,4-dioxano [5,6-b]) acridinone","","- C15 H11 N O3 -","- C15 H11 N O3 -","- C60 H44 N4 O12 -","4","1","CF1238","Karolak-Wojciechowska, Janina; Mrozek, Agnieszka; Trzeźwińska, Barbara; Morel, Sandrine; Galy, Jean-Pierre; Barbe, Jacques","2,3-Dihydrodioxin[2,3-<i>b</i>]acridin-11(6<i>H</i>)-one","Acta Crystallographica Section C","1998","54","11","1689","1690","10.1107/S0108270198006738","","","1.54178","CuKα","","0.0419","0.0378","","0.1158","0.1123","","","","1.11","1.11","1.11","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007795","13.957","0.003","13.877","0.003","21.831","0.004","90","","102.9","0.03","90","","4121.5","1.5","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis(tripenylphosphino)-2,2-dicyano-1,1-ethylenedithiolate palladium(II)","","- C44 H36 N4 P2 Pd S2 -","- C44 H30 N4 P2 Pd S2 -","- C176 H120 N16 P8 Pd4 S8 -","4","1","DA1006","Bao, Mutai; Cao, Rong; Su, Weiping; Hong, Maochun","(1,1-Dimercaptoethene-2,2-dicarbonitrilato-<i>S</i>,<i>S</i>')bis(triphenylphosphine)palladium(II) Diacetonitrile Solvate","Acta Crystallographica Section C","1998","54","11","1622","1624","10.1107/S0108270198006465","","","0.71073","MoKα","","0.051","0.037","","0.092","0.07","","","","1.162","1.122","1.122","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007796","10.8912","0.0006","7.4907","0.0004","11.2879","0.0006","90","","111.214","0.001","90","","858.49","0.08","203","2","203","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H28 O5 -","- C19 H28 O5 -","- C38 H56 O10 -","2","1","DA1020","Cambie, Richard C.; Mitchell, Lorna H.; Rickard, Clifton E. F.; Rutledge, P. Stewart","12,12-Ethylenedioxy-8α,9α-epoxypodocarpan-19-oic Acid","Acta Crystallographica Section C","1998","54","11","1672","1673","10.1107/S0108270198008269","","","0.71073","MoKα","","0.051","0.048","","","0.125","0.126","","","","","","1.03","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007797","7.855","0.002","8.669","0.001","11.115","0.002","70.38","0.01","69.39","0.01","73.97","0.01","656.5","0.2","293","2","300","","","","","","","","","4","P -1","-P 1","2","Indole","Ethyl 5-Ethoxy-3-Methyl-2-Indolecarboxylate","","- C14 H17 N O3 -","- C14 H17 N O3 -","- C28 H34 N2 O6 -","2","1","DE1073","Chandrakantha, T. N.; Puttaraja; Kokila, M. K.; Shivaprakash, N. C.","Ethyl 5-Ethoxy-3-methyl-1<i>H</i>-indole-2-carboxylate","Acta Crystallographica Section C","1998","54","11","1685","1687","10.1107/S010827019800568X","","","1.5418","CuKα","","0.055","0.045","","0.16","0.131","","","","1.084","1.144","1.144","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007798","8.049","0.002","12.756","0.002","6.209","0.002","98.82","0.02","100.94","0.03","93.99","0.02","615.3","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-(N, N-dimethylaminomethylene)-2-(2-nitrophenyl)-2-oxazolin-5-one","","- C12 H11 N3 O4 -","- C12 H11 N3 O4 -","- C24 H22 N6 O8 -","2","1","DE1078","Vijayalakshmi, L; Parthasarathi, V; Perumal, P.T; Majo, V.J","4-(Dimethylaminomethylene)-2-(2-nitrophenyl)oxazol-5(4<i>H</i>)-one","Acta Crystallographica Section C","1998","54","11","1683","1685","10.1107/S010827019800403X","","","0.70173","MoKα","","0.1031","0.041","","0.1341","0.1151","","","","1.06","1.064","1.064","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007799","15.1675","0.0004","11.964","0.0003","24.1413","0.0004","90","","103.156","0.001","90","","4265.8","0.17","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H52 Mo2 N O8 S2 -","- C38 H51 Mo2 N O8 S2 -","- C152 H204 Mo8 N4 O32 S8 -","4","1","DE1087","Pan, Guohua; Zhuang, Botao; Chen, Jiutong","A New Dinuclear Molybdenum Compound, (Bu~4~ N)[Mo~2~(CO)~6~(SPh)~2~(CH~2~CCH~3~COO)]","Acta Crystallographica Section C","1998","54","11","1580","1582","10.1107/S010827019800571X","","","0.71073","MoKα","","0.078","0.048","","0.098","0.086","","","","1.09","1.14","1.14","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007800","9.049","0.003","12.898","0.004","9.391","0.002","90","","115.65","0.02","90","","988","0.5","288","2","288","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-ethyl-1-methyl-imidazolium tetrachloropalladate(II)","","- C12 H22 Cl4 N4 Pd -","- C12 H22 Cl4 N4 Pd -","- C24 H44 Cl8 N8 Pd2 -","2","0.5","FG1431","Ortwerth, Michael F.; Wyzlic, Michael J.; Baughman, Russell G.","Bis(1-ethyl-3-methylimidazolium) Tetrachloropalladate(II)","Acta Crystallographica Section C","1998","54","11","1594","1596","10.1107/S0108270198006829","","","0.71073","MoKα","","0.042","0.03","","0.078","0.071","","","","1.081","1.105","1.105","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007801","12.435","0.003","7.517","0.003","28.79","0.004","90","","93.344","0.017","90","","2686.5","1.3","293","1","293","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Oxa-4-thia-spiro[4.5]decane(s)","","- C13 H22 O2 S -","- C13 H22 O2 S -","- C104 H176 O16 S8 -","8","2","FG1452","Parvez, Masood; Yadav, Veejendra K.; Jeyaraj, Duraiswamy A.","2-(7-Ethylidene-6-methyl-1-oxa-4-thiaspiro[4.5]dec-7-yl)ethanol","Acta Crystallographica Section C","1998","54","11","1679","1681","10.1107/S010827019800780X","","","0.71069","MoKα","","0.2293","0.0564","","","","0.1866","","","","","","1.033","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007802","12.235","0.003","9.645","0.002","18.596","0.006","90","","105.97","0.02","90","","2109.8","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(3,3'-dimethyl-2,2'-biquinoline)bromotricarbonylrhenium(I)","","- C23 H16 Br N2 O3 Re -","- C23 H16 Br N2 O3 Re -","- C92 H64 Br4 N8 O12 Re4 -","4","1","FG1459","Juan Guerrero; Sergio A. Moya; María Teresa Garland; Ricardo F. Baggio","Bromotricarbonyl(3,3'-dimethyl-2,2'-biquinoline-<i>N</i>,<i>N</i>')rhenium(I)","Acta Crystallographica Section C","1998","54","11","1592","1594","10.1107/S010827019800691X","","","0.71073","MoKα","","0.0585","0.0268","","","","0.0549","","","","","","0.926","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007803","6.2457","0.0011","11.9757","0.0009","17.1228","0.0014","90","","90.081","0.002","90","","1280.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Bis(methoxyacetato)nitratoaquoneodymium(III)","","- C6 H12 N Nd O10 -","- C6 H12 N Nd O10 -","- C24 H48 N4 Nd4 O40 -","4","1","FG1460","Mague, Joel T.; Apblett, Allen W.; Walker, Edwin H.","Metal Alkoxycarboxylate Complexes. I. Poly[aquabis(methoxyacetato)(nitrato)neodymium(III)]","Acta Crystallographica Section C","1998","54","11","1588","1590","10.1107/S0108270198006921","","","0.71073","MoKα","","0.048","0.033","","0.094","","0.088","","","1.167","","","1.222","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007804","13.7463","0.0008","8.6401","0.0004","11.9943","0.0012","90","","90","","90","","1424.56","0.18","213","2","213","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","ferrocenium tetrachloroferrate","","- C10 H10 Cl4 Fe2 -","- C10 H10 Cl4 Fe2 -","- C40 H40 Cl16 Fe8 -","4","0.5","FG1462","Cotton, F. Albert; Daniels, Lee M.; Pascual, Isabel","Ferrocenium Tetrachloroferrate Revisited, and Ferrocenium Tetrachloroaluminate","Acta Crystallographica Section C","1998","54","11","1575","1578","10.1107/S0108270198007215","","","0.71073","MoKα","","0.038","0.035","","0.084","0.082","","","","1.179","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007805","13.788","0.006","8.643","0.002","12.009","0.006","90","","90","","90","","1431.1","1","213","2","213","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","ferrocenium tetrochloroaluminate","","- C10 H10 Al Cl4 Fe -","- C10 H10 Al Cl4 Fe -","- C40 H40 Al4 Cl16 Fe4 -","4","0.5","FG1462","Cotton, F. Albert; Daniels, Lee M.; Pascual, Isabel","Ferrocenium Tetrachloroferrate Revisited, and Ferrocenium Tetrachloroaluminate","Acta Crystallographica Section C","1998","54","11","1575","1578","10.1107/S0108270198007215","","","0.71073","MoKα","","0.073","0.059","","0.144","0.134","","","","1.146","1.159","1.159","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007806","13.342","0.002","16.839","0.001","7.052","0.002","90","","90","","90","","1584.3","0.5","173","1","173","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(+)-tazettine","(+)-(3S,4aS,6aS,13bS)-3-methoxy-5-methyl-4,4a,5,6-tetrahydro-3H,8H-[1,3]dioxolo[ 6,7][2]benzopyrano[3,4-c]indol-6a-ol","","- C18 H21 N O5 -","- C18 H21 N O5 -","- C72 H84 N4 O20 -","4","1","FG1465","Linden, Anthony; Akineri, Gülnur; Noyan, Seda; Gözler, Tekant; Hesse, Manfred","<i>Amaryllidaceae</i> Alkaloids: (+)-Tazettine, (+)-3-<i>O</i>-Demethylcriwelline and (+)-3-Epimacronine at 173 K","Acta Crystallographica Section C","1998","54","11","1653","1659","10.1107/S0108270198006933","","","0.71069","MoKα","","0.052","0.039","","","","0.109","","","","","","1.034","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007807","7.297","0.005","11.083","0.002","9.531","0.003","90","","104.3","0.03","90","","746.9","0.6","173","1","173","1","","","","","","","","4","P 1 21 1","P 2yb","4","(+)-3-O-demethylcriwelline","(+)-(3R,4aS,6aS,13bS)-5-methyl-4,4a,5,6-tetrahydro-3H,8H-[1,3]dioxolo[6,7][2]ben zopyrano[3,4-c]indole-3,6a-diol","","- C17 H19 N O5 -","- C17 H19 N O5 -","- C34 H38 N2 O10 -","2","1","FG1465","Linden, Anthony; Akineri, Gülnur; Noyan, Seda; Gözler, Tekant; Hesse, Manfred","<i>Amaryllidaceae</i> Alkaloids: (+)-Tazettine, (+)-3-<i>O</i>-Demethylcriwelline and (+)-3-Epimacronine at 173 K","Acta Crystallographica Section C","1998","54","11","1653","1659","10.1107/S0108270198006933","","","0.71069","MoKα","","0.051","0.036","","","","0.095","","","","","","1.036","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007808","8.176","0.002","17.666","0.002","11.0743","0.0009","90","","95.054","0.009","90","","1593.3","0.4","173","1","173","1","","","","","","","","4","P 1 21 1","P 2yb","4","(+)-3-epimacronine","(+)-(3S,4aS,6aR,13bS)-3-methoxy-5-methyl-3,4,4a,5,6,6a-hexahydro-[1,3]dioxolo[6, 7][2]benzopyrano[3,4-c]indol-8-one","","- C18 H19.132 N O5.066 -","- C18 H19.132 N O5.066 -","- C72 H76.528 N4 O20.264 -","4","2","FG1465","Linden, Anthony; Akineri, Gülnur; Noyan, Seda; Gözler, Tekant; Hesse, Manfred","<i>Amaryllidaceae</i> Alkaloids: (+)-Tazettine, (+)-3-<i>O</i>-Demethylcriwelline and (+)-3-Epimacronine at 173 K","Acta Crystallographica Section C","1998","54","11","1653","1659","10.1107/S0108270198006933","","","0.71069","MoKα","","0.044","0.035","","","","0.09","","","","","","1.031","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2007809","9.182","0.002","10.917","0.002","21.955","0.004","90","","90","","90","","2200.8","0.7","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","(+/-)-cis-10-Carboxymethyl-2-decalone","(+/-)-cis-4a-carboxymethyloctahydro-2(1H)-napthalenone","","- C12 H18 O3 -","- C12 H18 O3 -","- C96 H144 O24 -","8","1","FG1471","Zewge, Daniel; Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","(±)-<i>cis</i>-10-Carboxymethyl-2-decalone: Catemeric Hydrogen Bonding in an ε-Keto Acid","Acta Crystallographica Section C","1998","54","11","1651","1653","10.1107/S0108270198007495","","","0.71073","MoKα","","0.12","0.054","","0.135","0.108","","","","1.001","1.17","1.17","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007810","7.6013","0.0006","11.771","0.001","14.896","0.002","90","","90","","90","","1332.8","0.2","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 O2 S -","- C15 H18 O2 S -","- C60 H72 O8 S4 -","4","1","FG1476","Zukerman-Schpector, J.; Monteiro, Hugo J.","Intermediates in the Synthesis of (+)-Grandisol. III. (1<i>S</i>,5<i>R</i>)-2,5-Dimethyl-1-(phenylsulfonyl)bicyclo[3.2.0]hept-2-ene","Acta Crystallographica Section C","1998","54","11","1673","1675","10.1107/S0108270198007811","","","0.71073","MoKα","","0.0664","0.0339","","0.0892","","0.0796","","","1.077","","","1.1","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007811","12.112","0.002","13.46","0.002","7.946","0.002","97.72","0.02","102.21","0.02","102.98","0.01","1211.1","0.4","173","1","173","1","","","","","","","","6","P -1","-P 1","2","","3-(dimethylamino)-5,6,7,8,9,10-hexahydro-12,13-dimethoxy-4H-spiro[benzo-1-thia-2 ,5-diazacyclododecene-4,1'-cyclobutan]-6-one 1,1-dioxide dichloromethane solvate (1/1)","","- C21 H31 Cl2 N3 O5 S -","- C21 H31 Cl2 N3 O5 S -","- C42 H62 Cl4 N6 O10 S2 -","2","1","FG1482","Linden, Anthony; Mihova, Tonya R.; Heimgartner, Heinz","3-(Dimethylamino)-5,6,7,8,9,10-hexahydro-12,13-dimethoxy-4<i>H</i>-spiro[benzo-1-thia-2,5-diazacyclododecene-4,1'-cyclobutan]-6-one 1,1-Dioxide Dichloromethane Solvate (1/1) at 173K","Acta Crystallographica Section C","1998","54","11","1659","1662","10.1107/S0108270198008476","","","0.71069","MoKα","","0.1023","0.0565","","","","0.1608","","","","","","1.056","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2007812","7.7771","0.0012","13.148","0.002","10.0967","0.0015","90","","90.944","0.009","90","","1032.3","0.3","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Cl4 Hf2 -","- C20 H20 Cl4 Hf2 -","- C40 H40 Cl8 Hf4 -","2","0.5","FR1091","Morris, Robert J.; Shaw, Scott L.; Huffman, John C.; Bollinger, John C.","Di-μ-chloro-bis[chloro(η^5^-indenyl)methylhafnium(IV)]","Acta Crystallographica Section C","1998","54","11","1617","1618","10.1107/S0108270198005368","","","0.71069","MoKα","","","0.028","","","","0.028","","","","","","1.259","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2007813","10.526","0.006","14.03","0.004","16.884","0.004","93.16","0.02","103.19","0.03","110.99","0.03","2240.7","1.6","293","","","","","","","","","","","7","P -1","-P 1","2","","pyridino-1κN-μ-nitrobenzolate-2κO;3κO'- tris(diethoxyldithiophosphate)-1κ^2^S,S';2κ^2^S,S';3κ^2^S,S'-μ~3~- thio-tri-μ-thio-1:2κ^2^S;1:3κ^2^S;2:3κ^2^S-triangulo-trimolybdenum","","- C24 H39 Mo3 N2 O10 P3 S10 -","- C24 H39 Mo3 N2 O10 P3 S10 -","- C48 H78 Mo6 N4 O20 P6 S20 -","2","1","FR1109","Xia, Ji-Bo; Yao, Yuan-Gen; Wu, Ling; Huang, Xiao-Ying; Lu, Jia-Xi","A Trinuclear Molybdenum Cluster Coordinated by <i>o</i>-Nitrobenzoate","Acta Crystallographica Section C","1998","54","11","1612","1615","10.1107/S010827019800482X","","","0.71069","MoKα","","","0.044","","","0.055","","","","","1.8","1.8","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007814","22.8039","0.0011","10.334","0.0008","26.1543","0.0015","90","","90","","90","","6163.4","0.7","296","1","296","1","","","","","","","","7","P n a 21","P 2c -2n","33","","(μ-κO,O'-1,9-(2,4-pentanedioneimino)-3,7-dithianonane)- bis(bromotri(p-tolyl)tin(IV))","","- C59 H72 Br2 N2 O2 S2 Sn2 -","- C59 H72 Br2 N2 O2 S2 Sn2 -","- C236 H288 Br8 N8 O8 S8 Sn8 -","4","1","FR1121","Bajue, Stanley A.; Bramwell, Fitzgerald B.; Brock, Carolyn Pratt; Bontemps, Jeuneviette","2:1 Adducts of Halotris(<i>p</i>-tolyl)tin(IV) with 1,9-Bis(4-oxopent-2-en-2-ylamino)-3,7-dithianonane","Acta Crystallographica Section C","1998","54","11","1618","1622","10.1107/S0108270198006209","","","0.71073","MoKα","","0.158","0.044","","0.131","0.101","","","","1.01","1.16","1.16","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007815","22.7565","0.0012","10.3774","0.0011","26.752","0.003","90","","90","","90","","6317.6","1","296","1","296","1","","","","","","","","7","P n a 21","P 2c -2n","33","","(μ-κO,O'-1,9-(2,4-pentanedioneimino)-3,7-dithianonane)- bis(iodotri(p-tolyl)tin(IV))","","- C59 H72 I2 N2 O2 S2 Sn2 -","- C59 H72 I2 N2 O2 S2 Sn2 -","- C236 H288 I8 N8 O8 S8 Sn8 -","4","1","FR1121","Bajue, Stanley A.; Bramwell, Fitzgerald B.; Brock, Carolyn Pratt; Bontemps, Jeuneviette","2:1 Adducts of Halotris(<i>p</i>-tolyl)tin(IV) with 1,9-Bis(4-oxopent-2-en-2-ylamino)-3,7-dithianonane","Acta Crystallographica Section C","1998","54","11","1618","1622","10.1107/S0108270198006209","","","0.71073","MoKα","","0.096","0.028","","0.073","0.054","","","","1.04","1.104","1.104","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007816","16.555","0.001","10.062","0.001","12.972","0.002","90","","93.153","0.008","90","","2157.6","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","μ‒oxobis[(endo‒isodicyclopentadienyl)dichlorotitanium(IV)]","","","- C20 H22 Cl4 O Ti2 -","- C20 H22 Cl4 O Ti2 -","- C80 H88 Cl16 O4 Ti8 -","4","1","FR1123","Gallucci, Judith C.; Kozmina, Natasha; Paquette, Leo A.","A [{TiCl~2~(isodiCp)}~2~(μ-O)] Dimer and a Twinned Cyclic [TiCl(isodiCp)(μ-O)]~4~ Tetramer","Acta Crystallographica Section C","1998","54","11","1609","1612","10.1107/S0108270198006945","","","0.7093","MoKα","","0.125","0.047","","0.096","0.079","","","","1.198","1.325","1.325","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007817","16.331","0.001","16.331","0.001","7.498","0.001","90","","90","","90","","1999.7","0.3","296","2","296","2","","","","","","","","5","P 42/n :2","-P 4bc","86","cyclo-tetrakis[μ‒oxo(endo‒isodicylopentadienyl)chlorotitanium(IV)]","","","- C40 H44 Cl4 O4 Ti4 -","- C40 H44 Cl4 O4 Ti4 -","- C80 H88 Cl8 O8 Ti8 -","2","0.25","FR1123","Gallucci, Judith C.; Kozmina, Natasha; Paquette, Leo A.","A [{TiCl~2~(isodiCp)}~2~(μ-O)] Dimer and a Twinned Cyclic [TiCl(isodiCp)(μ-O)]~4~ Tetramer","Acta Crystallographica Section C","1998","54","11","1609","1612","10.1107/S0108270198006945","","","0.7093","MoKα","","0.045","0.026","","0.073","0.064","","","","1.176","1.167","1.167","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007818","8.411","0.0007","11.8372","0.0009","11.1004","0.0009","90","","100.066","0.001","90","","1088.17","0.15","173","1","173","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H20 B N O Si -","- C7 H20 B N O Si -","- C28 H80 B4 N4 O4 Si4 -","4","1","FR1124","Ramon Huertas; Jesus R. Medina; John A. Soderquist; Songping D. Huang","<i>N</i>-Borane-<i>N</i>-(trimethylsilyl)morpholine","Acta Crystallographica Section C","1998","54","11","1645","1647","10.1107/S0108270198007410","","","0.7107","MoKα","","0.045","0.032","","0.0557","","0.05","","","1.124","","","1.17","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007819","9.224","0.002","27.735","0.006","10.497","0.003","90","","112.42","0.01","90","","2482.4","1.1","163","","163","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","cis-syn-cis-dicyclohexano-18-crown-6 sodium perrhenate","cis-syn-cis-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.0^9,14^]hexacosane sodium perrhenate","","- C20 H36 Na O10 Re -","- C20 H36 Na O10 Re -","- C80 H144 Na4 O40 Re4 -","4","1","FR1125","Bryan, Jeffrey C.","<i>cis</i>‒<i>syn</i>‒<i>cis</i>-Dicyclohexano-18-crown-6 Sodium Perrhenate","Acta Crystallographica Section C","1998","54","11","1569","1571","10.1107/S0108270198007422","","","0.71073","MoKα","","0.054","0.035","","0.095","0.086","","","","1.12","1.16","1.16","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007820","8.044","0.001","17.093","0.001","6.949","0.001","90","","105.92","0.01","90","","918.81","0.19","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","5-ammoniosalicylic acid chloride monohydrate","5-ammoniosalicylic acid chloride monohydrate","","- C7 H10 Cl N O4 -","- C7 H10 Cl N O4 -","- C28 H40 Cl4 N4 O16 -","4","1","FR1127","Dobson, Allison J.; Gerkin, Roger E.","5-Ammoniosalicylic Acid Chloride Monohydrate","Acta Crystallographica Section C","1998","54","11","1632","1634","10.1107/S0108270198007045","","","0.71073","MoKα","","","0.036","","","0.057","","","","","2.98","2.98","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007821","7.9494","0.0009","13.3702","0.0007","14.9355","0.0008","90","","90","","90","","1587.4","0.2","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","bis-1,2-(o-nitrophenoxy)benzene","","","- C18 H12 N2 O6 -","- C18 H12 N2 O6 -","- C72 H48 N8 O24 -","4","1","FR1128","Bryan, Jeffrey C.; Lavis, Jérôme L.; Sachleben, Richard A.","Highly Rigid Crown Ether Fragments: Phenyl and Cyclohexyl Catechol Ethers","Acta Crystallographica Section C","1998","54","11","1662","1666","10.1107/S0108270198006490","","","0.71073","MoKα","","0.042","0.042","","0.114","","0.114","","","1.025","1.05","1.05","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007822","10.9111","0.0007","18.0088","0.0009","7.583","0.0006","90","","93.362","0.008","90","","1487.46","0.17","173","","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis-1,2-(o-aminophenoxy)benzene","","","- C18 H16 N2 O2 -","- C18 H16 N2 O2 -","- C72 H64 N8 O8 -","4","1","FR1128","Bryan, Jeffrey C.; Lavis, Jérôme L.; Sachleben, Richard A.","Highly Rigid Crown Ether Fragments: Phenyl and Cyclohexyl Catechol Ethers","Acta Crystallographica Section C","1998","54","11","1662","1666","10.1107/S0108270198006490","","","0.71073","MoKα","","0.057","0.039","","","","0.111","","","","","","1.04","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007823","8.6656","0.0006","17.7913","0.0014","10.7602","0.0006","90","","97.548","0.006","90","","1644.6","0.2","296","","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","meso-bis-1,2-(2'-hydroxycyclohexyloxy)benzene","","","- C18 H26 O4 -","- C18 H26 O4 -","- C72 H104 O16 -","4","1","FR1128","Bryan, Jeffrey C.; Lavis, Jérôme L.; Sachleben, Richard A.","Highly Rigid Crown Ether Fragments: Phenyl and Cyclohexyl Catechol Ethers","Acta Crystallographica Section C","1998","54","11","1662","1666","10.1107/S0108270198006490","","","0.71073","MoKα","","0.06","0.033","","","","0.09","","","1.03","1.09","1.09","1.04","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007824","4.8554","0.0006","4.8554","0.0006","23.2156","0.0017","90","","90","","120","","473.98","0.09","298","2","298","2","","","","","","","","4","R -3 :H","-R 3","148","","Barium cobalt(II) phosphate","","- Ba Co2 O8 P2 -","- Ba Co2 O8 P2 -","- Ba3 Co6 O24 P6 -","3","0.166667","FR1136","Bircsak, Zsolt; Harrison, William T. A.","Barium Cobalt Phosphate, BaCo~2~(PO~4~)~2~","Acta Crystallographica Section C","1998","54","11","1554","1556","10.1107/S010827019800794X","","","0.71073","MoKα","","0.0175","0.017","","","","0.045","","","","","","1.178","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007825","18.797","0.002","9.5553","0.0006","19.4819","0.0013","90","","109.574","0.006","90","","3296.9","0.5","173","","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","mer-(triphenylphosphine)(triphenylphosphine oxide)trichlorooxorhenium(V)","","","- C36 H30 Cl3 O2 P2 Re -","- C36 H30 Cl3 O2 P2 Re -","- C144 H120 Cl12 O8 P8 Re4 -","4","1","FR1142","Bryan, Jeffrey C.; Perry, Marc C.; Arterburn, Jeffrey B.","Trichlorooxo(triphenylphosphine)(triphenylphosphine oxide)rhenium(V)","Acta Crystallographica Section C","1998","54","11","1607","1608","10.1107/S010827019800818X","","","0.71073","MoKα","","0.07","0.0399","","0.11","0.0986","","","","1.031","1.074","1.074","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007826","6.027","0.003","8.608","0.002","22.935","0.004","97.75","0.02","93.72","0.04","98.87","0.04","1160.4","0.7","294","","294","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H33 N O4 P -","- C23 H33 N O4 P -","- C46 H66 N2 O8 P2 -","2","1","GS1002","Grimaldi, Sandra; Siri, Didier; Finet, Jean-Pierre; Tordo, Paul","<i>N</i>-<i>tert</i>-Butyl-<i>N</i>-(1-dibenzylphosphono-2,2-dimethylpropyl)nitroxide","Acta Crystallographica Section C","1998","54","11","1712","1714","10.1107/S0108270198005216","","","0.71073","MoKα","","0.126","0.049","","","0.067","","","","","1.102","1.102","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2007827","13.385","0.004","5.215","0.001","22.159","0.004","90","","107.29","0.04","90","","1476.9","0.7","293","2","293","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","L'Anhydride Cis-1,2,3,6-Tétrahydrophtalique","","- C8 H8 O3 -","- C8 H8 O3 -","- C64 H64 O24 -","8","2","GS1003","Ben Fredj, Arij; Ben Redjeb, Sadok; Ben Amor, Fatma; Driss, Ahmed","L'Anhydride <i>cis</i>-1,2,3,6-Tétrahydrophtalique","Acta Crystallographica Section C","1998","54","11","1710","1712","10.1107/S0108270198006957","","","0.71069","MoKα","","0.091","0.045","","0.114","0.099","","","","1.082","1.252","1.252","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007828","7.2694","0.0011","9.649","0.002","25.045","0.004","90","","90","","90","","1756.7","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","9-(3-furyl)-1,4,4a,5,9,10,10a,10b-octahydro-4-hydroxy-4a,10a-dimethyl-1,4- etheno-3H,7H-benzo[1,2-c:3,4-c']dipyran-3,7-dione","","- C20 H20 O6 -","- C20 H20 O6 -","- C80 H80 O24 -","4","1","HA1216","Nor Aziyah Bakhari; Sam Teng Wah; Kandasamy Chinnakali; Hoong-Kun Fun; Ibrahim Abdul Razak","Fibleucin from <i>Fibraurea chloroleuca</i> Miers","Acta Crystallographica Section C","1998","54","11","1649","1651","10.1107/S0108270198007069","","","0.71073","MoKα","","0.088","0.053","","0.142","0.129","","","","0.912","1.093","1.093","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007829","9.0498","0.0002","5.2275","0.0001","25.0771","0.0002","90","","97.71","","90","","1175.62","0.04","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","o-Phenylenediamine and Pyrocatechol (1:1) monohydrate complex","","- C12 H15 N2 O2.5 -","- C12 H15 N2 O2.5 -","- C48 H60 N8 O10 -","4","1","HA1221","Shyamaprosad Goswami; Reshmi Mukherjee; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun","<i>o</i>-Phenylenediamine Pyrocatechol Hemihydrate Complex","Acta Crystallographica Section C","1998","54","11","1647","1649","10.1107/S0108270198006751","","","0.71073","MoKα","","0.0601","0.0411","","0.1066","0.0959","","","","1.057","1.113","1.113","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007830","8.205","0.001","10.319","0.001","27.168","0.003","90","","90","","90","","2300.2","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4R,5S,2'R)-1,5-Dimethyl-4-phenyl-3-acetyl-[2'-phenyl-2'(1-naphthyl)] -imidazolidin-2-one","","- C29 H26 N2 O2 -","- C29 H26 N2 O2 -","- C116 H104 N8 O8 -","4","1","HA1223","Baggio, Ricardo; Lotz, Guillermo; Palacios, Sara; Mariezcurrena, Raúl A.","(4<i>S</i>,5<i>R</i>,2'<i>R</i>)-3,4-Dimethyl-1-[2'-(1-naphthyl)-2'-phenylacetyl]-5-phenylimidazolidin-2-one","Acta Crystallographica Section C","1998","54","11","1677","1679","10.1107/S0108270198006453","","","0.71073","MoKα","","0.073","0.04","","","","0.087","","","","","","0.991","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007831","11.438","0.002","8.902","0.001","17.189","0.003","90","","96.35","0.01","90","","1739.5","0.5","300","2","300","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H16 Br2 N2 O2 -","- C17 H16 Br2 N2 O2 -","- C68 H64 Br8 N8 O8 -","4","1","JZ1285","Elerman, Yalc̨in; Elmali, Ayhan; Kabak, Mehmet; Svoboda, Ingrid","<i>N</i>,<i>N</i>'-Bis(5-bromo-2-hydroxybenzylidene)-1,3-propanediamine","Acta Crystallographica Section C","1998","54","11","1701","1703","10.1107/S0108270198005046","","","0.71069","MoKα","","0.1253","0.0365","","0.0967","0.0727","","","","0.98","1.09","1.09","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007832","7.788","0.001","7.796","0.001","9.457","0.001","68.11","0.01","72.9","0.01","87.94","0.01","507.47","0.12","292","","292","","","","","","","","","5","P -1","-P 1","2","","1,3-Propanediammonium Tetrachloromercurate","","- C3 H12 Cl4 Hg N2 -","- C3 H12 Cl4 Hg N2 -","- C6 H24 Cl8 Hg2 N4 -","2","1","JZ1287","Spengler, Roland; Zouari, Ridha; Zimmermann, Helmuth; Ben Salah, Abdelhamid; Burzlaff, Hans","1,3-Propanediammonium Tetrachloromercurate","Acta Crystallographica Section C","1998","54","11","1628","1631","10.1107/S0108270198008282","","","0.70926","MoKα","","0.034","0.034","","0.071","0.048","","","","","1.12","1.12","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007833","12.7462","0.001","9.1967","0.0005","11.495","0.0009","90","","114.977","0.007","90","","1221.46","0.17","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Trichloro-1,2,3-trimethylbenzenebismuth(III)","","- C9 H12 Bi Cl3 -","- C9 H12 Bi Cl3 -","- C36 H48 Bi4 Cl12 -","4","1","JZ1297","Frank, Walter; Reiland, Vera","Heavy-Metal π Complexes. 13. Trichloro(1,2,3-trimethylbenzene)bismuth(III)","Acta Crystallographica Section C","1998","54","11","1626","1628","10.1107/S0108270198008294","","","0.71073","MoKα","","0.0308","0.0261","","","","0.0629","","","","","","1.006","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007834","6.291","0.002","11.009","0.002","20.185","0.0011","90","","93.939","0.011","90","","1394.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 Cl3 O4 -","- C11 H13 Cl3 O4 -","- C44 H52 Cl12 O16 -","4","1","KA1266","Zsolt Böcskei; Zoltán Hell; Zoltán Finta; László Töke; Kálmán Simon","A Bicyclic Cyclopropane Carboxylic Acid Lactone from a Solid‒Liquid PTC Reaction","Acta Crystallographica Section C","1998","54","11","1694","1695","10.1107/S0108270198007951","","","1.54178","CuKα","","0.1216","0.0587","","0.1896","0.1399","","","","1.088","1.102","1.102","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007835","14.346","0.007","8.431","0.003","6.019","0.002","90","","99.48","0.05","90","","718.1","0.5","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Poly-[(Ammine)0.7-(aqua)0.3-zinc(II)-tricyanocuprate(I)]","","- C3 H2.7 Cu N3.7 O0.3 Zn -","- C3 Cu N3.7 O0.3 Zn -","- C12 Cu4 N14.8 O1.2 Zn4 -","4","0.5","KA1270","Černák, Juraj; Žák, Zdirad; Chomič, Jozef; Kappenstein, Charles","Copper‒Zinc Oxide Catalysts. VII. Zn(NH~3~)~0.7~(H~2~ O)~0.3~Cu(CN)~3~","Acta Crystallographica Section C","1998","54","11","1551","1553","10.1107/S0108270198007021","","","0.71073","MoKα","","0.074","0.036","","0.133","0.106","","","","1.155","1.242","1.242","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007836","10.167","0.002","14.499","0.003","17.86","0.004","90","","92.5","0.03","90","","2630.3","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","hexa potassium μ-oxo-bis{[2-hydroxy-κO-1,2,3-propanetricarboxylato(4-)-O^1^,O^2^] dioxomolybdenum(IV)} dihydrate","","- C12 H12 K6 Mo2 O21 -","- C24 H16 K12 Mo4 O42 -","- C48 H32 K24 Mo8 O84 -","2","0.25","KA1274","Xing, Yong-Heng; Xu, Ji-Qing; Sun, Hao-Ran; Li, Dong-Mei; Wang, Ren-Zhang; Wang, Tie-Gang; Bu, Wei-Ming; Ye, Ling; Yang, Guang-Di; Fan, Yu-Guo","Hexapotassium μ-Oxo-bis[(citrato)dioxomolybdenum] Dihydrate","Acta Crystallographica Section C","1998","54","11","1615","1616","10.1107/S0108270198006519","","","0.71073","MoKα","","0.05","0.04","","0.108","0.102","","","","1.068","1.103","1.103","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007837","7.303","0.001","8.583","0.002","10.489","0.002","100.92","0.03","103.27","0.03","98.88","0.03","614.7","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(4,5-Dihydroimidazol-2-yl)phthalazinone-1 Hydroiodides","","- C11 H11 I N4 O -","- C11 H11 I N4 O -","- C22 H22 I2 N8 O2 -","2","1","KA1276","Główka, Marek L.; Książek, Waldemar","2-(1,2-Dihydro-1-oxophthalazin-2-yl)-4,5-dihydroimidazolium Iodide and 2-(1,2-Dihydro-1-oxophthalazin-2-yl)-4,5,6,7-tetrahydro-1,3-diazepinium Iodide","Acta Crystallographica Section C","1998","54","","1691","1693","10.1107/S010827019800701X","","","1.54178","CuKα","","0.047","0.042","","","0.115","0.119","","","","","","1.062","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007838","8.196","0.002","8.55","0.002","10.787","0.002","77.43","0.03","73.15","0.03","83.58","0.03","705.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(4,5,6,7-Tetrahydrodiazepin2-yl)phthalazinone-1 Hydroiodides","","- C13 H15 I N4 O -","- C13 H15 I N4 O -","- C26 H30 I2 N8 O2 -","2","1","KA1276","Główka, Marek L.; Książek, Waldemar","2-(1,2-Dihydro-1-oxophthalazin-2-yl)-4,5-dihydroimidazolium Iodide and 2-(1,2-Dihydro-1-oxophthalazin-2-yl)-4,5,6,7-tetrahydro-1,3-diazepinium Iodide","Acta Crystallographica Section C","1998","54","","1691","1693","10.1107/S010827019800701X","","","1.54178","CuKα","","0.05","0.043","","","0.111","0.119","","","","","","1.092","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007839","7.631","0.002","10.888","0.002","9.917","0.002","90","","94.14","0.03","90","","821.8","0.3","293","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,5 Dinitroindazole","","","- C7 H4 N4 O4 -","- C7 H4 N4 O4 -","- C28 H16 N16 O16 -","4","1","KA1282","Zaleski, Jacek; Daszkiewicz, Zdzisław; Kyzioł, Janusz","1,5-Dinitro-1<i>H</i>-indazole","Acta Crystallographica Section C","1998","54","11","1687","1689","10.1107/S0108270198007434","","","0.71073","MoKα","","0.051","0.041","","","","0.117","","","","","","1.183","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007840","9.022","0.001","11.052","0.001","26.58","0.003","90","","90","","90","","2650.3","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Ter-butoxy carbonyl glycyl-L-valyl-L-tryptophan methyl ester","","- C24 H34 N4 O6 -","- C24 H34 N4 O6 -","- C96 H136 N16 O24 -","4","1","NA1355","Sankaran Banumathi; Devadasan Velmurugan; Easwara Subramanian; Sethuram Bandacharya Katti; Wahajul Haq","Methyl <i>N</i>-(<i>tert</i>-Butoxycarbonyl)glycyl-<small>L</small>-valyl-<small>L</small>-tryptophanate","Acta Crystallographica Section C","1998","54","11","1681","1683","10.1107/S0108270198005460","","","1.5418","CuKα","","0.064","0.051","","","","0.178","","","","","","0.913","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007841","7.055","0.002","12.531","0.002","24.464","0.002","90","","90","","90","","2162.8","0.7","291","1","291","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H25 N O3 S3 -","- C20 H25 N O3 S3 -","- C80 H100 N4 O12 S12 -","4","1","NA1360","Kuhl, Alexander; Schürmann, Markus; Preut, Hans; Kreiser, Wolfgang","13,13-Ethylenedithio-3-mesyloxy-18-nor-13,17-secoestra-1,3,5(10)-triene-17-nitrile","Acta Crystallographica Section C","1998","54","11","1714","1716","10.1107/S0108270198005472","","","0.71069","MoKα","","0.149","0.058","","","","0.109","","","","","","1.148","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007842","12.243","0.002","12.243","0.002","32.923","0.004","90","","90","","90","","4934.9","1.3","293","","293","","","","","","","","","5","I 41/a :2","-I 4ad","88","","octa(μ-methoxo)octa(μ-oxo)octaoxotetrapyridineoctamolybdenum(V)","","- C28 H44 Mo8 N4 O24 -","- C28 H44 Mo8 N4 O24 -","- C112 H176 Mo32 N16 O96 -","4","0.25","NA1365","Modec, Barbara; Brenčič, Jurij V.; Rotar, Rok; Golič, Ljubo; Prout, Keith","An Oxomolybdenum(V) Cluster, [Mo~8~O~16~(OCH~3~)~8~(C~5~H~5~N)~4~]","Acta Crystallographica Section C","1998","54","11","1573","1575","10.1107/S0108270198006106","","","0.71069","MoKα","","","0.027","","","","0.028","","","","","","0.976","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007843","8.341","0.0011","9.2516","0.0011","13.522","0.002","81.329","0.009","84.722","0.009","68.05","0.007","956","0.2","293","2","293","2","","","","","","","","5","P 1","P 1","1","","(S)-5-fluoroformyl-1-triphenylmethylpyrrolid-2-one","","- C24 H20 F N O2 -","- C24 H20 F N O2 -","- C48 H40 F2 N2 O4 -","2","2","NA1368","Vassilios Nastopoulos; George Karigiannis; Petros Mamos; Dionissios Papaioannou; Constantin Kavounis","(<i>S</i>)-<i>N</i>-Triphenylmethylpyroglutamyl Fluoride","Acta Crystallographica Section C","1998","54","11","1718","1720","10.1107/S010827019800729X","","","0.71069","MoKα","","0.07","0.042","","","","0.12","","","","","","1.062","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007844","8.65","0.004","14.309","0.006","11.042","0.003","90","","105.83","0.03","90","","1314.9","0.9","150","","150","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H44 Cl2 Cu N4 O5 -","- C20 H44 Cl2 Cu N4 O5 -","- C40 H88 Cl4 Cu2 N8 O10 -","2","1","OA1052","Kojima, Yoshitane; Seki, Yoshio; Yasuda, Showji; Hirotsu, Ken; Miyake, Hiroyuki","A Copper(II) Complex of a Structurally Reinforced Chiral 14-Membered Aza-Macrocycle","Acta Crystallographica Section C","1998","54","11","1602","1604","10.1107/S0108270198002637","","","0.7107","MoKα","","","0.046","","","0.053","","","","","","","1.367","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007845","17.036","0.006","16.501","0.004","19.517","0.005","90","","104.62","0.02","90","","5309","3","160","2","160","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(pentafluoro)phenylborane-water","","- C23 H12 B Cl2 F15 O3 -","- C23 H12 B Cl2 F15 O3 -","- C184 H96 B8 Cl16 F120 O24 -","8","1","OS1004","Janiak, Christoph; Braun, Lothar; Scharmann, Tobias G.; Girgsdies, Frank","A Water Adduct of Tris(pentafluorophenyl)borane: (C~6~F~5~)~3~B(OH~2~)‒Dioxane‒CH~2~Cl~2~ (1/1/1)","Acta Crystallographica Section C","1998","54","11","1722","1724","10.1107/S0108270198007252","","","0.71069","MoKα","","0.119","0.046","","0.124","0.099","","","","1.003","1.138","1.138","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007846","5.129","0.001","8.84","0.002","10.1","0.002","90","","91.36","0.03","90","","457.81","0.16","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- B Co Li O3 -","- B Co Li O3 -","- B8 Co8 Li8 O24 -","8","1","OS1009","Piffard, Yves; Rangan, Krishnaswamy Kasthuri; An, Yonglin; Guyomard, Dominique; Tournoux, Michel","Cobalt Lithium Orthoborate, LiCoBO~3~","Acta Crystallographica Section C","1998","54","11","1561","1563","10.1107/S0108270198007458","","","0.71073","MoKα","","0.081","0.033","","0.069","0.058","","","","0.977","1.06","1.06","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007847","8.736","0.002","9.909","0.002","12.705","0.003","70.37","0.03","76.86","0.03","88.74","0.03","1007","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","bis(mu)~2~-chloro)-bis(η-5]-trimethylsilyl-cyclopentadienyl)samarium(iii))","","- C32 H52 Cl2 Si4 Sm2 -","- C16 H26 Cl Si2 Sm -","- C32 H52 Cl2 Si4 Sm2 -","2","1","OS1010","Marie-Rose Spirlet; Jean Goffart","Dicyclopentadienyl Complexes of Samarium(III): [Sm(η^5^-C~5~H~4~SiMe~3~)~2~(μ-Cl)]~2~","Acta Crystallographica Section C","1998","54","11","1624","1626","10.1107/S0108270198008300","","","0.71073","MoKα","","0.07","0.0613","","0.0673","0.0673","","","","2.65","2.64","2.64","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007848","21.198","0.008","6.3283","0.0009","35.442","0.009","90","","104.44","0.02","90","","4604","2","122","0.5","122","2","","","","","","","","4","C 1 2 1","C 2y","5","","Quininium (S,S)-hydrogen tartrate hemihydrate","","- C48 H62 N4 O17 -","- C48 H62 N4 O17 -","- C192 H248 N16 O68 -","4","1","OS1012","Ryttersgaard, Carsten; Larsen, Sine","Quininium Hydrogen (<i>S</i>,<i>S</i>)-Tartrate Hemihydrate, a Salt with a Unique Conformation of the Hydrogen Tartrate Ion","Acta Crystallographica Section C","1998","54","11","1698","1701","10.1107/S0108270198004399","","","1.5418","CuKα","","0.039","0.0366","","","","0.0976","","","","","","1.036","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007849","13.637","0.002","7.866","0.002","12.844","0.001","90","","109.574","0.008","90","","1298.1","0.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(2-mercaptoethyl)-2-methyl-1,2-dicarba-closo-dodecaborane(12)","","- C5 H18 B10 S -","- C5 H18 B10 S -","- C20 H72 B40 S4 -","4","1","OS1018","Raikko Kivekäs; Josefina Pedrajas; Francesc Teixidor; Reijo Sillanpää","1-(2-Mercaptoethyl)-2-methyl-1,2-dicarba-<i>closo</i>-dodecaborane(12)","Acta Crystallographica Section C","1998","54","11","1716","1718","10.1107/S0108270198007264","","","0.71069","MoKα","","0.085","0.051","","0.172","0.145","","","","1.055","1.109","1.109","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007850","8.553","0.004","12.86","0.005","15.53","0.007","90","","104.08","0.04","90","","1656.9","1.3","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Dichloro(tetrahydrofuran-O)[tris(1-pyrazolyl-N^2^)borato]vanadium(III)","","- C13 H18 B Cl2 N6 O V -","- C13 H18 B Cl2 N6 O V -","- C52 H72 B4 Cl8 N24 O4 V4 -","4","1","OS1019","Rehder, Dieter; Gailus, Hartmut; Schmidt, Hauke","Dichloro(tetrahydrofuran-<i>O</i>)[tris(1-pyrazolyl-<i>N</i>^2^)borato]vanadium(III)","Acta Crystallographica Section C","1998","54","11","1590","1592","10.1107/S010827019800612X","","","0.71073","MoKα","","0.086","0.057","","0.151","0.136","","","","1.031","1.097","1.097","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007851","10.881","0.005","10.878","0.005","13.794","0.004","90","","109.77","0.03","90","","1536.5","1.1","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H16 O3 -","- C21 H16 O3 -","- C84 H64 O12 -","4","1","OS1031","Pajunen, Aarne; Mariitta Kokko","1,5-Diphenylbicyclo[2.2.1]hept-5-ene-<i>endo</i>-2,<i>endo</i>-3-dicarboxylic Anhydride and 1,5-diphenylbicyclo[2.2.1]hept-5-ene-<i>exo</i>-2,<i>exo</i>-3-dicarboxylic Anhydride","Acta Crystallographica Section C","1998","54","11","1724","1727","10.1107/S010827019800849X","","","0.71073","MoKα","","0.0529","0.0475","","","","0.1317","","","","","","1.078","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007852","6.455","0.001","24.917","0.005","10.016","0.002","90","","103.11","0.03","90","","1569","0.5","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H16 O3 -","- C21 H16 O3 -","- C84 H64 O12 -","4","1","OS1031","Pajunen, Aarne; Mariitta Kokko","1,5-Diphenylbicyclo[2.2.1]hept-5-ene-<i>endo</i>-2,<i>endo</i>-3-dicarboxylic Anhydride and 1,5-diphenylbicyclo[2.2.1]hept-5-ene-<i>exo</i>-2,<i>exo</i>-3-dicarboxylic Anhydride","Acta Crystallographica Section C","1998","54","11","1724","1727","10.1107/S010827019800849X","","","0.71073","MoKα","","0.069","0.0509","","","","0.1134","","","","","","1.061","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007853","9.897","0.001","12.97","0.002","13.516","0.003","86.92","0.01","83.19","0.01","76.28","0.01","1673","0.5","300","2","300","2","","","","","","","","5","P -1","-P 1","2","","Tetracyclohexylcyclotetraphosphinepentacarbonylchrom(0)","","- C29 H44 Cr O5 P4 -","- C29 H44 Cr O5 P4 -","- C58 H88 Cr2 O10 P8 -","2","1","QA0055","Deeg, Axel; Wunderlich, Hartmut","Pentacarbonyl(1,2,3,4-tetracyclohexylcyclotetraphosphane-<i>P</i>)chromium(0), [Cr(CO)~5~(chexP)~4~]","Acta Crystallographica Section C","1998","54","11","IUC9800054","","10.1107/S0108270198099260","","","0.71073","MoKα","","0.0483","0.0328","","","","0.0985","","","","","","1.063","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007854","6.4252","0.0009","8.6755","0.0014","14.856","0.003","73.359","0.013","83.302","0.013","74.22","0.012","762.8","0.2","125","2","125","2","","","","","","","","2","P -1","-P 1","2","","E-2,5-Bis(dimethyl)-3,4-diisopropyl-hexa-3-ene","","- C16 H32 -","- C16 H32 -","- C32 H64 -","2","1","QA0056","Boese, Roland; Roth, Wolfgang R.; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","(<i>E</i>)-3,4-Diisopropyl-2,5-dimethylhex-3-ene at 125K","Acta Crystallographica Section C","1998","54","11","IUC9800055","","10.1107/S0108270198099247","","","0.71073","MoKα","","0.071","0.0466","","","","0.124","","","","","","1.053","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007855","15.096","0.004","7.329","0.002","16.176","0.004","90","","90","","90","","1789.7","0.8","298","2","298","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","","(1-Methylimidazole-N^3^)triphenylboron","","- C22 H21 B N2 -","- C22 H21 B N2 -","- C88 H84 B4 N8 -","4","1","QA0057","Bélanger, Suzanne; Beauchamp, André L.","(1-Methylimidazole-<i>N</i>^3^)triphenylboron","Acta Crystallographica Section C","1998","54","11","IUC9800057","","10.1107/S0108270198099223","","","1.54056","CuKα","","0.073","0.037","","0.078","","0.068","","","0.95","","","0.96","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007856","7.837","0.004","15.807","0.009","7.02","0.006","90.41","0.06","108.66","0.05","86.73","0.05","822.5","1","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","(±)-(1S)-2-(2-Methyl-1,3-dioxolan-2-yl)-1-[(1S)-2-methylenecyclopropyl] ethyl-4-nitro-1-benzenecarboxylate","","- C17 H19 N O6 -","- C17 H19 N O6 -","- C34 H38 N2 O12 -","2","1","QA0058","Boffey, Raymond J.; Kilburn, Jeremy D.; Webster, Michael","(±)-(1<i>S</i>)-2-(2-Methyl-1,3-dioxolan-2-yl)-1-[(1<i>S</i>)-2-methylenecyclopropyl]-1-ethyl 4-Nitrobenzoate","Acta Crystallographica Section C","1998","54","11","IUC9800056","","10.1107/S0108270198099235","","","0.71073","MoKα","","0.1246","0.0539","","","","0.1784","","","","","","1.03","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007857","16.232","0.001","7.449","0.0004","16.125","0.001","90","","103.8","0.01","90","","1893.4","0.2","298","","298","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","tetra(methylammonium)chloride hexachloroindiumate","","- C4 H24 Cl7 In N4 -","- C4 H24 Cl7 In N4 -","- C16 H96 Cl28 In4 N16 -","4","1","QA0060","Rothammel, Walter; Spengler, Roland; Burzlaff, Hans; Jarraya, S.; Ben Salah, Abdelhamid","Redetermination of Tetrakis(methylammonium) Hexachloroindate Chloride","Acta Crystallographica Section C","1998","54","11","IUC9800059","","10.1107/S0108270198099284","","","0.70926","MoKα","","","0.052","","","0.03","","","","","1.7","1.7","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007858","9.9115","0.0013","12.4531","0.0013","16.053","0.003","90","","90","","90","","1981.4","0.5","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3S,4S,4aR,10as)-5,10-Diacetyl-3,4,4a,5,6,7,10,10a-octahydro-8-methoxy-6-oxo -2H-pyrano[3,2g]pteridin-3,4-diyl diacetate","","- C17 H22 N4 O8 -","- C17 H22 N4 O8 -","- C68 H88 N16 O32 -","4","1","QA0061","Low, John N.; Ferguson, George; López M. Dolores; Quijano M. Luisa; Sánchez, Adolfo; Nogueras, Manuel; Cobo, Justo","(3<i>S</i>,4<i>S</i>,4a<i>R</i>,10a<i>S</i>)-5-Acetyl-3,4,4a,5,6,7,10,10a-octahydro-8-methoxy-7-methyl-6-oxo-2<i>H</i>-pyrano[3,2-<i>g</i>]pteridine-3,4-diyl Diacetate","Acta Crystallographica Section C","1998","54","11","IUC9800060","","10.1107/S0108270198099211","","","0.7107","MoKα","","0.095","0.051","","","","0.124","","","","","","0.95","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007859","13.543","0.004","10.2302","0.0015","8.894","0.003","90","","108.54","0.03","90","","1168.3","0.6","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","ammonium manganese (II) gallium phosphate dihydrate","","- Ga2 H4 Mn N O14 P3 -","- Ga2 H4 Mn N O14 P3 -","- Ga8 H16 Mn4 N4 O56 P12 -","4","0.5","QA0062","Chippindale, Ann M.; Cowley, Andrew R.; Bond, Andrew D.","A New Ammonium Manganese(II) Gallium Phosphate Hydrate: NH~4~[MnGa~2~(PO~4~)~3~(H~2~ O)~2~]","Acta Crystallographica Section C","1998","54","11","IUC9800061","","10.1107/S0108270198099272","","","1.5418","CuKα","","","0.03","","","0.034","","","","","1.081","1.081","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007860","14.649","0.003","12.893","0.003","26.218","0.005","90","","93.14","0.02","90","","4944.3","1.8","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47.98 H12.54 Cl F20 Fe N4 -","- C44 H8 Cl F20 Fe N4 -","- C176 H32 Cl4 F80 Fe4 N16 -","4","1","QB0063","Song, Byungho; Swenson, Dale C.; Goff, Harold M.","Chloro[5,10,15,20-tetrakis(pentafluorophenyl)porphinato]iron(III) 0.57-Toluene Solvate","Acta Crystallographica Section C","1998","54","11","IUC9800058","","10.1107/S0108270198099259","","","0.7107","MoKα","","0.153","0.069","","","","0.216","","","","","","0.879","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007861","12.1159","0.0016","12.7354","0.0019","13.824","0.003","112.98","0.02","93.55","0.02","104.94","0.02","1865.4","0.7","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H46 Cu2 N4 O5 -","- C40 H46 Cu2 N4 O5 -","- C80 H92 Cu4 N8 O10 -","2","1","SK1071","Lu, Tian-Huey; Yao, Hsueh-Hua; Lo, Jem-Mau; Tung, Shu-Fang","An Ethanol-Solvated Copper(II) Complex of 1,3-Bis(2-hydroxybenzylimino)pentane","Acta Crystallographica Section C","1998","54","11","1600","1602","10.1107/S0108270198004831","","","0.71073","MolybdenumKα","","0.051","0.051","","0.041","0.041","","","","","2.07","2.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007862","7.796","0.003","9.627","0.004","12.792","0.004","90","0.03","90","0.03","90","0.03","960.1","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R,7S,8aS)-1,7-dihydroxyindolizidine","","- C8 H17 N O3 -","- C8 H17 N O3 -","- C32 H68 N4 O12 -","4","1","SK1094","Garofano, Lidia; Guerri, Annalisa; Orioli, Pierluigi","(1<i>R</i>,7<i>S</i>,8a<i>S</i>)-1,7-Dihydroxyindolizidine Hydrate","Acta Crystallographica Section C","1998","54","11","1705","1707","10.1107/S0108270198005939","","","0.71069","MoKα","","0.056","0.043","","0.131","0.122","","","","1.062","1.101","1.101","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007863","22.943","0.004","5.893","0.013","20.541","0.005","90","","90.49","0.03","90","","2777","6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquabis(oxo-5 prolinato)zinc(II)","","- C10 H16 N2 O8 Zn -","- C10 H16 N2 O8 Zn -","- C80 H128 N16 O64 Zn8 -","8","1","SK1173","Loireau-Lozach, A. M.; Céolin, R.; Solans, X.; Font-Bardia, M.","Racemic Phase of Diaquabis(5-oxoprolinato)zinc(II)","Acta Crystallographica Section C","1998","54","11","1571","1573","10.1107/S0108270198006039","","","0.71069","MoKα","","0.102","0.059","","0.181","0.145","","","","1.041","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007864","11.311","0.001","3.61","0.001","4.8","0.001","90","","90","","90","","196","0.07","295","","295","","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- Na O5 V2 -","- Na O5 V2 -","- Na2 O10 V4 -","2","0.25","SK1183","Meetsma, Auke; de Boer, Jan L.; Damascelli, A.; Jegoudez, J.; Revcolevschi, A.; Palstra, T.T.M.","Inversion Symmetry in the Spin-Peierls Compound α'-NaV~2~O~5~","Acta Crystallographica Section C","1998","54","11","1558","1561","10.1107/S0108270198004855","","","0.71073","MoKα","","0.0176","0.0151","","","","0.0386","","","","","","1.126","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007865","9.331","0.004","10.678","0.003","12.884","0.003","65.94","0.02","78.75","0.02","83.8","0.03","1149.1","0.7","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Aqua(4,4'-dicarbomethoxy-2,2'-bipyridine-N,N')(3,6-dichloro-2,5- dihydroxy-1,4-benzoquinato-O,O')copper(II)-Acetonitrile Solvate","","- C21 H15.5 Cl2 Cu N2.5 O9 -","- C21 H15.5 Cl2 Cu N2.5 O9 -","- C42 H31 Cl4 Cu2 N5 O18 -","2","1","SK1187","Zheng, Li-Min; Schmalle, Helmut W.; Ferlay, Sylvie; Decurtins, Silvio","Aqua(4,4'-dicarbomethoxy-2,2'-bipyridine-<i>N</i>,<i>N</i>')(3,6-dichloro-4,5-dihydroxy-1,2-benzoquinonato-<i>O</i>^4^,<i>O</i>^5^)copper(II) Acetonitrile Hemisolvate","Acta Crystallographica Section C","1998","54","11","1578","1580","10.1107/S0108270198006507","","","0.71073","MoKα","","0.1666","0.0566","","","","0.1449","","","","","","1.074","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007866","13.7975","0.0013","11.9811","0.0007","14.261","0.002","90","","110.516","0.01","90","","2208","0.4","294","1","294","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3,5-Trihydroxybenzene‒2,2'-Bipyridyl (1/2)","","- C26 H22 N4 O3 -","- C26 H22 N4 O3 -","- C104 H88 N16 O12 -","4","1","SK1206","Lavender, Emma S.; Glidewell, Christopher; Ferguson, George","1,3,5-Trihydroxybenzene‒2,2'-Bipyridyl (1/2): a Hydrogen-Bonded Structure Based on a Stem-and-Leaves Motif","Acta Crystallographica Section C","1998","54","11","1637","1639","10.1107/S0108270198007483","","","0.7107","MoKα","","0.087","0.038","","","","0.098","","","","","","0.992","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007867","8.468","0.0007","11.0388","0.0009","21.743","0.0017","90","","97.897","0.006","90","","2013.2","0.3","294","1","294","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4'-Sulfonyldiphenol‒2,2'bipyridyl (1/1)","","- C22 H18 N2 O4 S -","- C22 H18 N2 O4 S -","- C88 H72 N8 O16 S4 -","4","1","SK1207","Lavender, Emma S.; Glidewell, Christopher; Ferguson, George","Pairwise-Interlocked Chains in 4,4'-Sulfonyldiphenol‒2,2'-Bipyridyl (1/1)","Acta Crystallographica Section C","1998","54","11","1639","1642","10.1107/S0108270198007471","","","0.7107","MoKα","","0.057","0.038","","","","0.096","","","","","","1.026","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007868","6.5872","0.0006","16.06","0.002","14.876","0.001","90","","98.759","0.006","90","","1555.4","0.3","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","αlpha, αlpha-bis(4-chlorophenyl)-5-pyrimidinemethanol","","- C17 H12 Cl2 N2 O -","- C17 H12 Cl2 N2 O -","- C68 H48 Cl8 N8 O4 -","4","1","SX1057","Caruso, Francesco; Rossi, Miriam","Bis(4-chlorophenyl)(5-pyrimidinyl)methanol","Acta Crystallographica Section C","1998","54","11","1668","1670","10.1107/S0108270198003485","","","1.54178","CuKα","","0.072","0.072","","0.098","0.098","","","","1","1","1","","","","","has coordinates","278321","2022-10-03","12:07:34",""
"2007869","12.288","0.012","17.557","0.014","7.96","0.015","90","","90","","90","","1717","4","296","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","{1,3,4,7,7a,8,9,10,11,13,14,14a-dodecahydro-7,14-methano-2H,6H-dipyrido [1,2-a:1',2'-e][1,5]diazocine-N,N'}dinitrito-O;O,O'-copper(II)","","- C15 H26 Cu N4 O4 -","- C15 H26 Cu N4 O4 -","- C60 H104 Cu4 N16 O16 -","4","1","TA1191","Lee, Yong-Min; Choi, Sung-Nak; Suh, Il-Hwan; Bereman, Robert D.","({-})-Sparteine Copper(II) Dinitrite","Acta Crystallographica Section C","1998","54","11","1582","1584","10.1107/S0108270198005617","","","0.71073","MoKα","","","0.057","","","","0.084","","","","","","1.203","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007870","17.942","0.003","17.942","0.003","28.45","0.006","90","","90","","120","","7931","3","293","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- As6 H14 K6 O49 V15 -","- As6 K6 O49 V15 -","- As36 K36 O294 V90 -","6","0.166667","TA1192","Guo-Yu Yang; Lian-Shan Chen; Ji-Qing Xu; Ya-Feng Li; Hao-Ran Sun; Zhi-Wu Pei; Qiang Su; Yong-Hua Lin; Yan Xing; Heng-Qing Jia","K~6~[As~6~V~15~O~42~(H~2~O)].6H~2~O","Acta Crystallographica Section C","1998","54","11","1556","1558","10.1107/S0108270198005629","","","0.71073","MoKα","","0.042","0.031","","0.088","0.081","","","","1.143","1.269","1.269","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007871","9.925","0.002","9.472","0.002","10.347","0.002","90","","91.26","0.02","90","","972.5","0.3","130","2","130","2","","","","","","","","7","I 1 2/c 1","-I 2yc","15","","","","- C H4.65 Al0.35 Co0.65 N O4 P -","- C H4.64 Al0.348 Co0.652 N O4 P -","- C8 H37.12 Al2.784 Co5.216 N8 O32 P8 -","8","1","TA1204","Gainsford, Graeme J.; Morgan, Keith R.; Rae, A. David","A Cobalt Aluminophosphate with Encapsulated Ethylenediamine: Co~0.65~Al~0.35~PO~4~.0.5NH~2.65~CH~2~CH~2~NH~2.65~","Acta Crystallographica Section C","1998","54","11","1564","1566","10.1107/S0108270198006842","","","0.71073","MoKα","","","0.054","","","0.064","","","","","1.358","1.358","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007872","4.669","0.002","9.622","0.003","16.377","0.006","90","","94.57","0.05","90","","733.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-bis(imidazol-1-ylmethyl)benzene dihydrate","","- C14 H18 N4 O2 -","- C14 H18 N4 O2 -","- C28 H36 N8 O4 -","2","0.5","TA1210","Abrahams, Brendan F.; Hoskins, Bernard F.; Robson, Richard; Slizys, Damian A.","1,4-Bis(imidazol-1-ylmethyl)benzene Dihydrate","Acta Crystallographica Section C","1998","54","11","1666","1668","10.1107/S0108270198004806","","","0.71069","MoKα","","0.15","0.07","","0.255","0.194","","","","1.011","1.161","1.161","","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2007873","5.4367","0.0007","8.0061","0.0008","29.452","0.003","90","","90","","90","","1282","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H17 N O6 -","- C13 H14 N O6 -","- C52 H56 N4 O24 -","4","1","VJ1081","Sriram, D.; Srinivasan, S.; Priya, K.; Aruna, V.; Loganathan, D.","β-1-<i>N</i>-Benzamido-<small>D</small>-glucopyranose","Acta Crystallographica Section C","1998","54","11","1670","1672","10.1107/S0108270198007306","","","1.5418","CuKα","","0.057","0.055","","0.161","0.157","","","","1.085","1.096","1.096","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007874","28.834","0.003","6.2885","0.0005","30.971","0.003","90","","93.778","0.013","90","","5603.5","0.9","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H36 N2 O3 S Si -","- C30 H36 N2 O3 S Si -","- C240 H288 N16 O24 S8 Si8 -","8","1","AB1537","Boss, Christoph; Stoeckli-Evans, Helen; Keese, Reinhart","<i>trans</i>-7,7-Diphenyl-7-silabicyclo[3.3.0]octan-3-one <i>p</i>-Tosylhydrazone Tetrahydrofuran Solvate","Acta Crystallographica Section C","1998","54","12","1856","1858","10.1107/S0108270198005198","","","0.71073","MoKα","","0.104","0.077","","","","0.225","","","","","","0.989","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007875","9.0124","0.0011","9.0124","0.0011","21.08","0.006","90","","90","","120","","1482.8","0.5","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","Hexakis(imidazole-N^3^)nickel(II) carbonate pentahydrate.","","- C19 H34 N12 Ni O8 -","- C19 H31.98 N12 Ni O8 -","- C38 H63.96 N24 Ni2 O16 -","2","0.166667","BK1383","Povse, Vicente; Perec, Mireille; Baggio, Ricardo; Garland, Maria Teresa","Hexakis(imidazole-<i>N</i>^3^)nickel(II) Carbonate Pentahydrate","Acta Crystallographica Section C","1998","54","12","1817","1820","10.1107/S0108270198007409","","","0.71073","MoKα","","0.081","0.038","","0.112","0.091","","","","1.02","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007876","12.669","0.0004","12.6905","0.0004","15.8223","0.0005","73.092","0.001","78.875","0.001","78.849","0.001","2362.48","0.13","295","","295","","","","","","","","","5","P -1","-P 1","2","","tetrakis-tetramethylammonium dihydrogen-decavanadate acetic acid hydrate","","- C18 H59.6 N4 O32.8 V10 -","- C18 H59.58 N4 O32.79 V10 -","- C36 H119.16 N8 O65.58 V20 -","2","1","BK1385","Pecquenard, Brigitte; Zavalij, Peter Y.; Whittingham, M. Stanley","Tetrakis(tetramethylammonium) Dihydrogendecavanadate Acetic Acid 2.8-Hydrate, [N(CH~3~)~4~]~4~[H~2~V~10~O~28~].CH~3~COOH.2.8H~2~O","Acta Crystallographica Section C","1998","54","12","1833","1835","10.1107/S0108270198009044","","","0.7107","MoKα","","","0.046","","","0.071","","","","","1.82","1.82","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007877","13.1568","0.0006","7.9676","0.0004","16.1884","0.001","90","","96.246","0.005","90","","1686.93","0.16","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[N-(2-amino-ethyl-N)-1,2-ethylenediamine-N, N'](isonicotinate-N)(water) Copper(II) hexafluorophosphate","","- C10 H19 Cu F6 N4 O3 P -","- C10 H19 Cu F6 N4 O3 P -","- C40 H76 Cu4 F24 N16 O12 P4 -","4","1","BK1389","Nie, Feng-Mei; Wang, Zhe-Ming; Li, Yan-Mei; Zhao, Yu-Fen; Yan, Chun-Hua","Aqua(diethylenetriamine)(isonicotinato)copper(II) Hexafluorophosphate","Acta Crystallographica Section C","1998","54","12","1853","1855","10.1107/S0108270198010725","","","0.71073","MoKα","","0.0393","0.0305","","","","0.0763","","","","","","1.12","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007878","14.566","0.003","7.886","0.002","14.395","0.003","90","","96.84","0.03","90","","1641.7","0.6","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","5-ethylthio-3H-1,2-dithiole-3-thione","","- C5 H6 S4 -","- C5 H6 S4 -","- C40 H48 S32 -","8","1","BK1396","Ricardo Baggio; Leandro L. Aimar; Rita H. de Rossi; Leopoldo Suescun","5-<i>R</i>-3<i>H</i>-1,2-Dithiole-3-thione (<i>R</i> = Ethylthio and Methylthio)","Acta Crystallographica Section C","1998","54","12","1902","1905","10.1107/S0108270198007793","","","0.71073","MoKα","","0.0327","0.0246","","","","0.0725","","","","","","1.04","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007879","8.831","0.002","7.454","0.002","10.769","0.002","90","","100.74","0.03","90","","696.5","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5-methylthio-3H-1,2-dithiole-3-thione","","- C4 H4 S4 -","- C4 H4 S4 -","- C16 H16 S16 -","4","1","BK1396","Ricardo Baggio; Leandro L. Aimar; Rita H. de Rossi; Leopoldo Suescun","5-<i>R</i>-3<i>H</i>-1,2-Dithiole-3-thione (<i>R</i> = Ethylthio and Methylthio)","Acta Crystallographica Section C","1998","54","12","1902","1905","10.1107/S0108270198007793","","","0.71073","MoKα","","0.0457","0.0328","","0.0963","0.0876","","","","1.1","1.12","1.12","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007880","15.865","0.003","16.781","0.003","12.691","0.003","90","","124.72","0.02","90","","2777.1","1.2","273.2","","273.2","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C10 H32 F12 N10 Ni2 P2 S2 -","- C10 H32 F12 N10 Ni2 P2 S2 -","- C40 H128 F48 N40 Ni8 P8 S8 -","4","0.5","BK1401","James, Michael; Kawaguchi, Hiroyuki; Tatsumi, Kazuyuki; Hambley, Trevor W.","Bis[bis(ethylenediamine-<i>N</i>,<i>N</i>')(μ~<i>N~,{ıt S</i>}-thiocyanato)nickel(II)] Bis(hexafluorophosphate)","Acta Crystallographica Section C","1998","54","12","1809","1811","10.1107/S0108270198008841","","","0.7107","MoKα","","0.034","0.034","","0.047","","0.047","","","1.49","","","1.49","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007881","7.41","0.004","14.392","0.001","7.368","0.004","90","","90","","90","","785.8","0.6","291.2","","291","","","","","","","","","5","P n n m","-P 2 2n","58","","","","- C4 H16 Cl6 N2 Te -","- C4 H16 Cl6 N2 Te -","- C8 H32 Cl12 N4 Te2 -","2","0.25","BK1402","Ishida, Hiroyuki; Kashino, Setsuo","Bis(dimethylammonium) Hexachlorotellurate(IV)","Acta Crystallographica Section C","1998","54","12","1811","1813","10.1107/S0108270198009226","","","0.71073","MoKα","","0.075","0.033","","0.034","","0.032","","","2.195","","","2.65","","","","has coordinates","199444","2020-10-21","18:00:00",""
"2007882","7.831","0.001","9.9159","0.0008","10.2115","0.0005","113.128","0.007","91.309","0.007","103.504","0.006","703.21","0.12","296","","296","","","","","","","","","3","P -1","-P 1","2","1-(o-tolylmethyl)naphthalene-2-carboxylic acid","","","- C19 H16 O2 -","- C19 H16 O2 -","- C38 H32 O4 -","2","1","BK1403","Gerkin, Roger E.","1-(<i>o</i>-Tolylmethyl)naphthalene-2-carboxylic Acid","Acta Crystallographica Section C","1998","54","12","1885","1887","10.1107/S0108270198009214","","","0.71073","MoKα","","","0.043","","","","0.056","","","","","","2.53","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007883","14.171","0.002","4.338","0.002","16.217","0.002","90","","99.64","0.01","90","","982.8","0.5","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","fluorene-2-carboxaldehyde","","","- C14 H10 O -","- C14 H10 O -","- C56 H40 O4 -","4","1","BK1406","Dobson, Allison J.; Gerkin, Roger E.","9<i>H</i>-Fluorene-2-carboxaldehyde","Acta Crystallographica Section C","1998","54","12","1890","1892","10.1107/S0108270198009056","","","0.71073","MoKα","","","0.042","","","0.065","","","","","1.71","1.71","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007884","7.998","0.005","5.413","0.002","19.435","0.005","90","","100.06","0.04","90","","828.5","0.6","293","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,6-dichlorophthalic anhydride","","- C8 H2 Cl2 O3 -","- C8 H2 Cl2 O3 -","- C32 H8 Cl8 O12 -","4","1","BK1409","Britton, Doyle","3,6-Dichlorophthalic Anhydride","Acta Crystallographica Section C","1998","54","12","1892","1894","10.1107/S0108270198009433","","","0.71073","MoKα","","0.061","0.04","","0.11","0.098","","","","1.025","1.087","1.087","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007885","11.8","0.002","16.538","0.004","12.565","0.003","90","","90","","90","","2452","0.9","295","2","295","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C13 H12 N3 O2.5 -","- C13 H12 N3 O2.5 -","- C104 H96 N24 O20 -","8","1","BM1204","Wang, Zuoxiang; Jian, Fangfang; Duan, Chunying; Bai, Zhiping; You, Xiaozeng","2-(2-Hydroxybenzylidene)-1-(2-picoloyl)hydrazine Hemihydrate","Acta Crystallographica Section C","1998","54","12","1927","1929","10.1107/S0108270198003527","","","0.71073","MoKα","","0.138","0.065","","0.227","0.16","","","","1.083","1.063","1.063","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007886","8.413","0.001","20.534","0.002","11.36","0.001","90","","90","","90","","1962.5","0.3","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","phenylethylthioamidinium chloride","","- C8 H11 Cl N2 S -","- C8 H11 Cl N2 S -","- C64 H88 Cl8 N16 S8 -","8","1","BM1211","Barker, James; Powell, Harold R.","<i>S</i>-Benzylisothiouronium Chloride","Acta Crystallographica Section C","1998","54","12","2019","2021","10.1107/S0108270198008166","","","1.5418","CuKα","","","0.0419","","","0.0502","","","","","1.0859","1.0859","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007887","9.003","0.002","12.643","0.003","5.937","0.001","98.41","0.02","93.13","0.02","97.95","0.02","660.2","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Pentasodium bis(dihydroxytetraoxotellurium(VI))gold(III) hexadecahydrate","","- Au H36 Na5 O28 Te2 -","- Au H36 Na5 O28 Te2 -","- Au H36 Na5 O28 Te2 -","1","0.5","BM1229","Levason, William; Webster, Michael","Pentasodium Bis[dihydroxytetraoxotellurium(VI)]gold(III) Hexadecahydrate","Acta Crystallographica Section C","1998","54","12","1729","1731","10.1107/S0108270198007604","","","0.71073","MoKα","","0.032","0.031","","","","0.084","","","","","","1.058","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007888","6.2064","0.0015","18.379","0.004","14.943","0.004","90","","96.18","0.02","90","","1694.6","0.7","178","2","178","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","dimesityl diselenide","","- C18 H22 Se2 -","- C18 H22 Se2 -","- C72 H88 Se8 -","4","1","BM1242","Jeske, Jörg; Salzen, Andreas Martens-von; du Mont, Wolf-Walther; Jones, Peter G.","Two Organic Diselenides: Dimesityl Diselenide and Bis(2,4,6-triisopropylphenyl) Diselenide","Acta Crystallographica Section C","1998","54","12","1873","1875","10.1107/S0108270198010579","","","0.71073","MoKα","","0.038","0.0304","","0.0835","0.078","","","","1.042","1.061","1.061","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007889","15.177","0.003","22.357","0.004","17.653","0.004","90","","90","","90","","5990","2","178","2","178","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","di(2,4,6-triisopropylphenyl)diselenide","","- C30 H46 Se2 -","- C30 H46 Se2 -","- C240 H368 Se16 -","8","1","BM1242","Jeske, Jörg; Salzen, Andreas Martens-von; du Mont, Wolf-Walther; Jones, Peter G.","Two Organic Diselenides: Dimesityl Diselenide and Bis(2,4,6-triisopropylphenyl) Diselenide","Acta Crystallographica Section C","1998","54","12","1873","1875","10.1107/S0108270198010579","","","0.71073","MoKα","","0.0844","0.0341","","0.1033","0.0817","","","","0.952","1.034","1.034","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007890","14.349","0.003","12.298","0.003","15.173","0.003","90","","105.27","0.03","90","","2583","1","220","2","220","2","","","","","","","","4","C 1 2 1","C 2y","5","","Brucinium Fumarate","","- C27 H33 N2 O9.5 -","- C27 H33 N2 O9.5 -","- C108 H132 N8 O38 -","4","1","BM1243","Dijksma, Fokke J. J.; Gould, Robert O.; Parsons, Simon; Walkinshaw, Malcolm D.","Brucinium Hydrogen Fumarate Sesquihydrate and Brucinium Hydrogen Maleate","Acta Crystallographica Section C","1998","54","12","1948","1951","10.1107/S0108270198010324","","","1.54184","CuKα","","0.046","0.038","","","","0.096","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2007891","7.941","0.0016","13.838","0.003","11.37","0.002","90","","111.27","0.03","90","","1164.3","0.5","220","2","220","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Brucinium Maleate","","- C27 H30 N2 O8 -","- C27 H30 N2 O8 -","- C54 H60 N4 O16 -","2","1","BM1243","Dijksma, Fokke J. J.; Gould, Robert O.; Parsons, Simon; Walkinshaw, Malcolm D.","Brucinium Hydrogen Fumarate Sesquihydrate and Brucinium Hydrogen Maleate","Acta Crystallographica Section C","1998","54","12","1948","1951","10.1107/S0108270198010324","","","1.54184","CuKα","","0.074","0.069","","","","0.177","","","","","","1.091","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007892","7.469","0.002","8.106","0.002","18.238","0.004","90","","93.78","0.03","90","","1101.8","0.5","143","2","143","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,2-Dimethyl-pyrido[2,1-b]benzimidazole-4-carbonitrile","","- C14 H11 N3 -","- C14 H11 N3 -","- C56 H44 N12 -","4","1","BM1261","Elgemeie, Galal E. H.; Metwally, Nadia H.; Jones, Peter G.","1,2-Dimethylpyrido[1,2-<i>a</i>]benzimidazole-4-carbonitrile","Acta Crystallographica Section C","1998","54","12","1871","1873","10.1107/S0108270198008221","","","0.71073","MoKα","","0.072","0.049","","","","0.132","","","","","","1.043","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007893","12.519","0.002","12.519","0.002","10.257","0.003","90","","90","","120","","1392.2","0.5","173","2","173","2","","","","","","","","6","P 31","P 31","144","","Polymeric (triphenyltrithiophosphite)chlorocopper(I)","","- C18 H15 Cl Cu P S3 -","- C18 H15 Cl Cu P S3 -","- C54 H45 Cl3 Cu3 P3 S9 -","3","1","BM1265","Jones, Peter G.; Fischer, Axel K.; Frolova, Lilya; Schmutzler, Reinhard","Polymeric Chloro(triphenyl trithiophosphite)copper(I)","Acta Crystallographica Section C","1998","54","12","1842","1844","10.1107/S0108270198008671","","","0.71073","MoKα","","0.072","0.041","","","","0.097","","","","","","1.018","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007894","33.756","0.002","7.391","0.0004","17.087","0.001","90","","118.42","0.001","90","","3749.3","0.4","173","","173","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bromo(hydrido)ethylbis(3,4-dimethylpyridine-N)silicon Bromide","","- C16 H24 Br2 N2 Si -","- C16 H24 Br2 N2 Si -","- C128 H192 Br16 N16 Si8 -","8","1","BM1278","Hensen, Karl; Kettner, Markus; Bolte, Michael","Bromo(ethyl)hydridobis(3,4-dimethylpyridine-<i>N</i>)silicon Bromide at 173K","Acta Crystallographica Section C","1998","54","12","1863","1865","10.1107/S0108270198009925","","","0.71073","MoKα","","0.065","0.038","","0.082","0.072","0.082","","","1.052","","","1.052","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007895","8.2441","0.0003","14.5329","0.0005","8.5294","0.0003","90","","100.777","0.003","90","","1003.89","0.06","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-hydroxybenzofuran-2-carboxylate","","- C11 H10 O4 -","- C11 H10 O4 -","- C44 H40 O16 -","4","1","BM1279","Gould, Robert O.; Guest, Martyn F.; Joswig, Jan-Ole; Palmer, Michael H.; Parsons, Simon","Ethyl 3-Hydroxybenzo[<i>b</i>]furan-2-carboxylate","Acta Crystallographica Section C","1998","54","12","1951","1954","10.1107/S0108270198010336","","","1.5418","CuKα","","0.0656","0.0461","","0.1281","0.115","","","","1.051","1.118","1.118","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007896","13.734","0.002","10.543","0.002","9.83","0.002","90","","90","","90","","1423.4","0.4","298","","298","","","","","","","","","4","P c c a","-P 2a 2ac","54","","Sodium Nickel Polyphosphate","","- Na Ni O9 P3 -","- Na Ni O9 P3 -","- Na8 Ni8 O72 P24 -","8","1","BR1195","Erragh, Fatima; Boukhari, Ali; Sadel, Abderahim; Holt, Elizabeth M.","Sodium Nickel Polyphosphate","Acta Crystallographica Section C","1998","54","12","1746","1747","10.1107/S0108270198006258","","","0.71073","MoKα","","","0.03","","","","0.043","","","","","","1.06","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2007897","8.234","0.004","12.781","0.007","7.168","0.002","97.76","0.03","98.36","0.02","85.38","0.04","738.1","0.6","150","","150","","","","","","","","","4","P -1","-P 1","2","","Octaaquabromouranium(IV) Tribromide Monohydrate","","- Br4 H18 O9 U -","- Br4 H18 O9 U -","- Br8 H36 O18 U2 -","2","1","BR1209","Rabinovich, Daniel; Schimek, George L.; Pennington, William T.; Nielsen, Jon B.; Abney, Kent D.","Octaaquabromouranium(IV) Tribromide Monohydrate, [UBr(H~2~O)~8~]Br~3~.H~2~O","Acta Crystallographica Section C","1998","54","12","1740","1742","10.1107/S0108270198008233","","","0.71073","MoKα","","0.053","0.051","","0.079","","0.078","","","","","","1.07","","","","has coordinates","189213","2020-10-21","18:00:00",""
"2007898","9.901","0.002","13.314","0.003","9.555","0.002","100.34","0.03","117.81","0.03","69.25","0.03","1041.7","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[tetrakis(imidazole-N^3^)copper(II)]-μ-[dichromato-O:O]]","","- C12 H16 Cr2 Cu N8 O7 -","- C12 H16 Cr2 Cu N8 O7 -","- C24 H32 Cr4 Cu2 N16 O14 -","2","1","CF1190","Pan, Long; Zheng, Nengwu; Zhou, Xiaoyu; Wu, Yonggang; Wu, Qingsheng; Jin, Xianglin","<i>catena</i>-Poly[[tetrakis(imidazole-<i>N</i>^3^)copper(II)]-μ-(dichromato-<i>O</i>:<i>O</i>')]","Acta Crystallographica Section C","1998","54","12","1802","1804","10.1107/S0108270198006660","","","0.71073","MoKα","","0.06","0.035","","","","0.091","","","","","","1.033","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007899","12.204","0.002","14.957","0.002","6.527","0.001","90","","102.41","0.01","90","","1163.6","0.3","296","2","","","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C29 H26 O4 -","- C29 H26 O4 -","- C58 H52 O8 -","2","1","CF1195","Yu , Jianhua; Hu, Yulai; Huang, Qibin; Yu, Kaibei; Yang, Shiyan","7-Methoxy-1-[1-(6-methoxy-2-naphthoyl)ethyl]-2-methyl-2,3-dihydro-1<i>H</i>-cyclopenta[<i>a</i>]naphthalen-3-one","Acta Crystallographica Section C","1998","54","12","2009","2011","10.1107/S0108270198009135","","","0.71073","MoKα","","","0.034","","","","0.069","","","","","","0.997","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007900","4.556","0.002","9.689","0.002","10.752","0.002","91.3","0.02","95.16","0.02","100.71","0.02","464.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Monoprotonated-Orthophenylenediamine Dihydrogenphosphate","","- C6 H11 N2 O4 P -","- C6 H11 N2 O4 P -","- C12 H22 N4 O8 P2 -","2","1","CF1225","Trojette, Basma; Hajem, Amen Allah; Driss, Ahmed; Jouini, Tahar","Monoprotonated <i>o</i>-Phenylenediamine Dihydrogenphosphate","Acta Crystallographica Section C","1998","54","12","1867","1869","10.1107/S0108270198009147","","","0.71069","MoKα","","0.0424","0.032","","0.091","0.0831","","","","1.092","1.104","1.104","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007901","11.1794","0.0009","18.505","0.002","22.409","0.002","90","","90","","90","","4635.9","0.7","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Tetracyclo-Tri-μ-(N-ethylthiourea)-tris(iodocopper(I)) Monohydrate","","- C18 H50 Cu4 I4 N12 O S6 -","- C18 H48 Cu4 I4 N12 O S6 -","- C72 H192 Cu16 I16 N48 O4 S24 -","4","1","CF1242","Chaveng Pakawatchai; Yupa Thanyasirikul; Tapanee Saepae; Suwaluk Pansook; Hoong-Kun Fun; Kandasamy Chinnakali","Hexakis(μ-<i>N</i>-ethylthiourea-<i>S</i>)tetrakis[iodocopper(I)] Monohydrate","Acta Crystallographica Section C","1998","54","12","1750","1752","10.1107/S0108270198010440","","","0.71073","MoKα","","0.0942","0.0408","","0.0924","0.0783","","","","0.794","0.971","0.971","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007902","13.135","0.003","10.309","0.002","19.363","0.004","90","","99.99","0.03","90","","2582.2","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H16 I N8 V -","- C32 H16 I N8 V -","- C128 H64 I4 N32 V4 -","4","1","CF1259","Krzysztof Ejsmont; Ryszard Kubiak","Iodo(phthalocyaninato)vanadium(III)","Acta Crystallographica Section C","1998","54","12","1844","1846","10.1107/S0108270198008105","","","0.71073","MoKα","","0.096","0.047","","","","0.13","","","","","","1.039","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007903","12.556","0.002","7.618","0.001","15.26","0.002","90","","109.76","0.01","90","","1373.7","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-Nitro-4'-(N,N-dimethylamino)azobenzene","(4-dimethylaminophenyl)(2-nitrophenyl)diazene","","- C14 H14 N4 O2 -","- C14 H14 N4 O2 -","- C56 H56 N16 O8 -","4","1","CF1260","Zhang, De-Chun; Ge, Li-Qin; Fei, Zheng-Hao; Zhang, Yan-Qiu; Yu, Kai-Bei","4'-(Dimethylamino)-2-nitroazobenzene","Acta Crystallographica Section C","1998","54","12","1909","1911","10.1107/S0108270198007616","","","0.71073","MoKα","","0.104","0.037","","0.13","0.076","","","","0.748","1.061","1.061","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007904","7.733","0.002","10.648","0.002","10.894","0.002","90","","90.09","0.03","90","","897","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H11 N3 O4 -","- C6 H11 N3 O4 -","- C24 H44 N12 O16 -","4","1","CF1261","Bujak, Maciej; Ejsmont, Krzysztof; Kyzioł, Janusz; Daszkiewicz, Zdzisław; Zaleski, Jacek","1,4-Dihydro-1-methyl-4-nitriminopyridine Dihydrate","Acta Crystallographica Section C","1998","54","12","1945","1948","10.1107/S0108270198008348","","","0.71073","MoKα","","0.0506","0.0377","","","","0.115","","","","","","1.096","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007905","28.851","0.005","11.615","0.002","19.992","0.004","90","","127.42","0.01","90","","5320.7","1.8","293","2","293","2","","","","","","","","8","C 1 c 1","C -2yc","9","","7,11-(μ-thiobenzoate-S:O)-7,10-di(triphenylphosphine-P)-8,9-di-μH- 7-platina-nido-undecaborane-chloroform (1/1.5)","","- C44.5 H45.5 B10 Cl4.5 O P2 Pt S -","- C44.5 H44.5 B10 Cl4.5 O P2 Pt S -","- C178 H178 B40 Cl18 O4 P8 Pt4 S4 -","4","1","CF1268","Chun-Hua Hu; Jian-Min Dou; Hai-Jun Yao; Jing-De Wei; Ruo-Shui Jin; Jie Sun; Pei-Ju Zheng","An Exopolyhedral Cyclized Platinaundecaborane: [(PPh~3~)(PhCOS)PtB~10~H~9~(PPh~3~)].1.5CHCl~3~","Acta Crystallographica Section C","1998","54","12","1835","1837","10.1107/S0108270198010452","","","0.71069","MoKα","","","0.0369","","","","0.1041","","","","","","1.07","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007906","5.872","0.002","10.529","0.002","19.096","0.005","105.01","0.02","93.85","0.02","105","0.02","1090","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Methyl 6-Chloro-9-purine-9-acetate","ethyl 6-chloropurine-9-acetate","","- C9 H9 Cl N4 O2 -","- C9 H9 Cl N4 O2 -","- C36 H36 Cl4 N16 O8 -","4","2","CF1279","Sood, Geeta; Schwalbe, Carl H.; Fraser, William","9-(Carboxymethyl)-6-chloropurine Ethyl Ester","Acta Crystallographica Section C","1998","54","12","1907","1909","10.1107/S0108270198012360","","","1.54178","CuKα","","0.087","0.078","","0.234","0.226","","","","1.099","1.148","1.148","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007907","7.185","0.001","15.46","0.001","10.254","0.001","90","","97.41","0.007","90","","1129.5","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","17α-Acetoxy-6-bromo-16β-methylpregna-4,6-diene-3,20-dione","","- C24 H31 Br O4 -","- C24 H31 Br O4 -","- C48 H62 Br2 O8 -","2","1","DA1005","Soriano-García, Manuel; Hernández-Ortega, Simón; Bratoeff, Eugene; Flores, Gregoria; Ramírez, Elena","17α-Acetoxy-6-bromo-16β-methylpregna-4,6-diene-3,20-dione","Acta Crystallographica Section C","1998","54","12","2022","2024","10.1107/S010827019800211X","","","0.71073","MoKα","","0.111","0.048","","0.11","","0.095","","","1.001","","","1.001","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007908","8.777","0.002","12.557","0.002","27.324","0.005","90","","90","","90","","3011.5","1","298","","298","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-benzoyl-4-hydroxy-6-6-dimethyl-1,5,7-tri(3-methyl-2-butenyl)bicyclo[3.3.1] non-3-ene-2,9-dione","","- C33 H42 O4 -","- C33 H42 O4 -","- C132 H168 O16 -","4","1","DA1009","Santos, Marcelo H.; Speziali, Nivaldo L.; Nagem, Tanus J.; Oliveira, Tânia T.","Epiclusianone: a New Natural Product Derivative of Bicyclo[3.3.1]nonane-2,4,9-trione","Acta Crystallographica Section C","1998","54","12","1990","1992","10.1107/S0108270198006477","","","0.71073","MoKα","","","0.0648","","","0.0585","","","","","1.54","1.54","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007909","9.4915","0.001","10.3342","0.0008","9.193","0.0009","89.607","0.007","90.489","0.008","93.555","0.008","899.93","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(dihydroxophosphato) [(1SR,4SR,8RS,11RS)-1,4,8,11-tetraazacyclotetradecane-κ^4^N]nickel(II)","","- C10 H28 N4 Ni O8 P2 -","- C10 H28 N4 Ni O8 P2 -","- C20 H56 N8 Ni2 O16 P4 -","2","1","DA1017","Namouchi Cherni, Saoussen; Driss, Ahmed; El Maaoui, Mohamed; Jouini, Tahar","Bis(dihydrogen phosphato-<i>O</i>)[(1<i>SR</i>,4<i>SR</i>,8<i>RS</i>,11<i>RS</i>)-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>]nickel(II)","Acta Crystallographica Section C","1998","54","12","1768","1770","10.1107/S0108270198008245","","","0.71069","MoKα","","0.0269","0.0218","","0.057","0.0542","","","","1.066","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007910","10.571","0.003","6.3565","0.0015","24.36","0.01","90","","100.37","0.04","90","","1610.1","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-aza-1-tertbuthyl-4-methyl-9-methoxy-1,2,3,4-tetrahydro-fluoren-2-one.","","- C18 H23 N O2 -","- C18 H23 N O2 -","- C72 H92 N4 O8 -","4","1","DA1018","García-Granda, Santiago; Santiago-García, Rafael; Sanni, S. Bamidele; Suárez-Sobrino, Angel; Santamaría, Javier","1-<i>tert</i>-Butyl-9-methoxy-4-methyl-1,2,3,4-tetrahydro-2-azafluoren-3-one, a Novel Fluorenone","Acta Crystallographica Section C","1998","54","12","1961","1963","10.1107/S0108270198008257","","","0.71073","MoKα","","0.172","0.048","","","","0.145","","","","","","0.979","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007911","16.476","0.001","16.476","0.001","16.476","0.001","90","","90","","90","","4472.6","0.5","293","2","293","2","","","","","","","","4","P -4 3 n","P -4n 2 3","218","tris(methylacetylacetonato)cobalt(III)","Tris(O,O'-4-methyl-2,4-pentanedionato)cobalt(III)","","- C18 H29.3 Co O7.65 -","- C18 H27 Co O7.657 -","- C144 H216 Co8 O61.256 -","8","0.333333","DA1026","Abrahams, Brendan F.; Hoskins, Bernard F.; McFadyen, David W.; Perrin, Leah C.","Tris(3-methyl-2,4-pentanedionato-<i>O</i>,<i>O</i>')cobalt(III)","Acta Crystallographica Section C","1998","54","12","1807","1809","10.1107/S0108270198008592","","","1.5418","CuKα","","0.069","0.051","","0.158","0.143","","","","1.138","1.212","1.212","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007912","8.0403","0.0006","15.1514","0.0011","16.4575","0.001","108.076","0.006","90.971","0.006","96.484","0.007","1890.9","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","tris(methylacetylacetonate)cobalt(III)","tris(3-methyl-2,4-pentandionato)cobalt(III)","","- C18 H27 Co O6 -","- C18 H27 Co O6 -","- C72 H108 Co4 O24 -","4","2","DA1026","Abrahams, Brendan F.; Hoskins, Bernard F.; McFadyen, David W.; Perrin, Leah C.","Tris(3-methyl-2,4-pentanedionato-<i>O</i>,<i>O</i>')cobalt(III)","Acta Crystallographica Section C","1998","54","12","1807","1809","10.1107/S0108270198008592","","","1.5418","CuKα","","0.17","0.083","","0.239","0.185","","","","1.035","1.169","1.169","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007913","6.6583","0.0005","9.4161","0.0007","9.5481","0.0007","96.087","0.002","103.348","0.002","90.026","0.001","578.97","0.07","190","","190","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H19 Cl2 Cu N3 -","- C7 H19 Cl2 Cu N3 -","- C14 H38 Cl4 Cu2 N6 -","2","1","DA1028","McCasland, Anne K.; Alcock, Nathaniel W.; Busch, Daryle H.","[<i>N</i>-(3-Aminopropyl)-<i>N</i>-methyl-1,3-propanediamine-κ^3^<i>N</i>]dichlorocopper(II)","Acta Crystallographica Section C","1998","54","12","1837","1839","10.1107/S0108270198009731","","","0.71073","MoKα","","0.0599","0.0448","","0.0967","0.094","","","","0.888","1.054","1.054","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007914","7.123","0.001","10.149","0.001","10.223","0.002","103.33","0.01","109.79","0.02","92.43","0.02","670.8","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Piromidic acid","8-Ethyl-5,8-dihydro-5-oxo-2-(-1-pyrrolidinyl)pyrido[2,3-d]pyrimidine-6- carboxylic acid","","- C14 H16 N4 O3 -","- C14 H16 N4 O3 -","- C28 H32 N8 O6 -","2","1","DE1074","H. Song.; H. S. Shin; K. I. Park.; S. I. Cho","The Antifungal Agent 8-Ethyl-5,8-dihydro-5-oxo-2-(1-pyrrolidinyl)pyrido[2,3-<i>d</i>]pyrimidine-6-carboxylic Acid (Piromidic Acid)","Acta Crystallographica Section C","1998","54","12","1915","1917","10.1107/S0108270198007628","","","0.71069","MoKα","","0.109","0.048","","0.144","0.109","","","","1.056","1.116","1.116","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007915","16.734","0.005","7.83","0.004","12.028","0.005","90","","119.12","0.03","90","","1376.8","1.1","293","","293","","","","","","","","","4","C 1 2 1","C 2y","5","6-Propylcytidine","1-(β-D-ribofuranosyl)-6-Propylcytosine","","- C12 H19 N3 O5 -","- C12 H19 N3 O5 -","- C48 H76 N12 O20 -","4","1","FG1416","Birnbaum, Karin Bjåmer; Shugar, David; Felczak, Krzysztof","1-(β-<small>D</small>-Ribofuranosyl)-6-propylcytosine","Acta Crystallographica Section C","1998","54","12","1959","1961","10.1107/S0108270198008683","","","0.71073","MolybdenumKα","","0.034","0.029","","0.037","0.036","","","","","1.69","1.69","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007916","12.0267","0.0002","11.3835","0.0002","14.5357","0.0002","90","","90","","90","","1990.02","0.06","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,5-Diethoxy-1,4-bis(3,4-ethylenedioxy-2-thienyl)benzene","","- C22 H22 O6 S2 -","- C22 H22 O6 S2 -","- C88 H88 O24 S8 -","4","0.5","FG1445","Abboud, Khalil A.; Irvin, David J.; Reynolds, John R.","2,5-Diethoxy-1,4-bis(3,4-ethylenedioxy-2-thienyl)benzene and its Tetrahydrofuran 0.33-Solvate","Acta Crystallographica Section C","1998","54","12","1994","1997","10.1107/S0108270198009536","","","0.71073","MoKα","","0.041","0.035","","","","0.099","","","","","","1.074","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007917","29.3123","0.0001","29.3123","0.0001","6.8706","0.0001","90","","90","","120","","5112.4","0.08","173","2","173","2","","","","","","","","4","R -3 :H","-R 3","148","","2,5-Diethoxy-1,4-bis(3,4-ethylenedioxy-2-thienyl)benzene tetrahydrofuran solvate","","- C23.33 H24.67 O6.33 S2 -","- C22 H22 O6 S2 -","- C198 H198 O54 S18 -","9","0.5","FG1445","Abboud, Khalil A.; Irvin, David J.; Reynolds, John R.","2,5-Diethoxy-1,4-bis(3,4-ethylenedioxy-2-thienyl)benzene and its Tetrahydrofuran 0.33-Solvate","Acta Crystallographica Section C","1998","54","12","1994","1997","10.1107/S0108270198009536","","","0.71073","MoKα","","0.04","0.035","","","","0.096","","","","","","1.06","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007918","9.481","0.0009","19.836","0.0019","13.178","0.0014","90","","90","","90","","2478.3","0.4","296","","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1,2-bis(2-pyridylformimidoyl)hydrazine","","- C12 H12 N6 -","- C12 H12 N6 -","- C96 H96 N48 -","8","1","FG1463","Armstrong, Jennifer A.; Barnes, John C.; Weakley, Timothy J.R.","1,2-Bis(2-pyridylformimidoyl)hydrazine","Acta Crystallographica Section C","1998","54","12","1923","1925","10.1107/S0108270198008014","","","0.71073","MoKα","","0.068","0.036","","","","0.135","","","","","","0.951","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007919","7.436","0.002","8.438","0.002","19.607","0.003","90","","90","","90","","1230.2","0.5","287","2","287","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-(4-hydroxy-5-hydroxymethyltetrahydrofuran-2-yl)-5-methyl-4-methylamino- (1H)-pyrimidin-2-one","","- C11 H17 N3 O4 -","- C11 H17 N3 O4 -","- C44 H68 N12 O16 -","4","1","FG1466","Audette, Gerald F.; Kumar, Sashi V.P.; Gupta, Sagar V.; Quail, J. Wilson","<i>N</i>^4^,5-Dimethyl-2'-deoxycytidine","Acta Crystallographica Section C","1998","54","12","1987","1990","10.1107/S0108270198008026","","","0.7093","MolybdenumKα","","0.0565","0.0364","","","","0.1064","","","","","","1.058","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007920","7.5811","0.0006","11.6974","0.0008","8.78","0.0006","90","","97.129","0.007","90","","772.58","0.1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,4-Dioxane dichloro-germanium","","- C4 H8 Cl2 Ge O2 -","- C4 H8 Cl2 Ge O2 -","- C16 H32 Cl8 Ge4 O8 -","4","0.5","FG1469","Denk, Michael K.; Khan, Maryam; Lough, Alan J.; Shuchi, Kumra","Redetermination of the Germanium Dichloride Complex with 1,4-Dioxane at 173K","Acta Crystallographica Section C","1998","54","12","1830","1832","10.1107/S0108270198009548","","","0.71073","MoKα","","0.0238","0.0216","","0.0533","0.0527","","","","1.075","1.1","1.1","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007921","10.258","0.002","6.9198","0.0009","17.66","0.004","90","","90.65","0.02","90","","1253.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Catena-[bis(3-hydroxypropionato)diaquoyttrium(III)] Bromide","","- C6 H14 Br O8 Y -","- C6 H14 Br O8 Y -","- C24 H56 Br4 O32 Y4 -","4","1","FG1475","Mague, Joel T.; Apblett, Allen W.; Todorova, Galina","Metal Alkoxycarboxylate Complexes. II. Poly[diaquabis(3-hydroxypropionato)yttrium(III)] Bromide and <i>catena</i>-Poly[pentaaqua(3-hydroxypropionato)yttrium(III)] Bromide Chloride","Acta Crystallographica Section C","1998","54","12","1784","1787","10.1107/S010827019800955X","","","0.71073","MoKα","","0.0821","0.0499","","0.1513","","0.1356","","","1.052","","","1.086","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007922","7.564","0.002","11.619","0.002","14.361","0.003","90","","90","","90","","1262.1","0.5","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Catena-[(3-hydroxypropionato)pentaaquoyttrium(III)] Bromide Chloride","","- C3 H15 Br Cl O8 Y -","- C3 H13 Br Cl O8 Y -","- C12 H52 Br4 Cl4 O32 Y4 -","4","1","FG1475","Mague, Joel T.; Apblett, Allen W.; Todorova, Galina","Metal Alkoxycarboxylate Complexes. II. Poly[diaquabis(3-hydroxypropionato)yttrium(III)] Bromide and <i>catena</i>-Poly[pentaaqua(3-hydroxypropionato)yttrium(III)] Bromide Chloride","Acta Crystallographica Section C","1998","54","12","1784","1787","10.1107/S010827019800955X","","","0.71073","MoKα","","0.0496","0.0313","","0.096","","0.0896","","","1.089","","","1.118","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007923","7.3756","0.0001","21.9934","0.0002","9.6991","0.0001","90","","108.843","0.001","90","","1489.02","0.03","218","2","218","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 Cr N O3 -","- C16 H17 Cr N O3 -","- C64 H68 Cr4 N4 O12 -","4","1","FG1479","Pigge, F. Christopher; Rath, Nigam P.; Fang, Shiyue","<i>exo</i>-and <i>endo</i>-Tricarbonyl[(4b,5,6,7,8,8a-η)-<i>cis</i>-<i>N</i>-methyl-2,3,4,4a,9,9a-hexahydro-1<i>H</i>-carbazole]chromium(0)","Acta Crystallographica Section C","1998","54","12","1825","1827","10.1107/S0108270198009561","","","0.71073","MoKα","","0.04","0.032","","0.082","0.078","","","","1.081","1.121","1.121","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007924","9.5188","0.0001","10.3406","0.0001","14.6223","0.0002","90","","91.379","0.001","90","","1438.86","0.03","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H17 Cr N O3 -","- C16 H17 Cr N O3 -","- C64 H68 Cr4 N4 O12 -","4","1","FG1479","Pigge, F. Christopher; Rath, Nigam P.; Fang, Shiyue","<i>exo</i>-and <i>endo</i>-Tricarbonyl[(4b,5,6,7,8,8a-η)-<i>cis</i>-<i>N</i>-methyl-2,3,4,4a,9,9a-hexahydro-1<i>H</i>-carbazole]chromium(0)","Acta Crystallographica Section C","1998","54","12","1825","1827","10.1107/S0108270198009561","","","0.71073","MoKα","","0.039","0.032","","0.088","0.082","","","","1.03","1.045","1.045","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007925","13.4327","0.0002","13.1953","0.0006","16.7801","0.0006","90","","90","","90","","2974.25","0.18","208","2","208","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H19 Co N4 O4 -","- C10 H19 Co N4 O4 -","- C80 H152 Co8 N32 O32 -","8","1","FG1480","Mareque Rivas, Juan C.; Brammer, Lee","N—H···N, N-H···O and N-H···π~CO~ Hydrogen Bonding in [<i>N</i>,<i>N</i>-Bis(2-aminoethyl)-2-aminoethyl]ammonium Tetracarbonylcobaltate(1-)","Acta Crystallographica Section C","1998","54","12","1799","1802","10.1107/S0108270198008956","","","0.71073","MoKα","","0.072","0.042","","0.055","0.05","","","","1.44","1.576","1.576","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007926","7.9543","0.0005","8.962","0.001","9.4344","0.0009","90.36","0.009","105.946","0.006","95.091","0.007","643.78","0.1","293","","","","","","","","","","","5","P -1","-P 1","2","","","","- C7 H13 Br3 O Te -","- C7 H13 Br3 O Te -","- C14 H26 Br6 O2 Te2 -","2","1","FG1481","Zukerman-Schpector, J.; Stefani, Hélio A.; Silva, Diogo de O.; Braga, Antonio L.; Dornelles, Luciano; Silveira, Claudio da C.; Caracelli, I.","Dibromo[(<i>Z</i>)-2-bromo-2-(hydroxymethyl)vinyl](<i>n</i>-butyl)tellurium(IV)","Acta Crystallographica Section C","1998","54","12","2007","2009","10.1107/S0108270198009573","","","0.71073","MoKα","","0.0637","0.0325","","0.089","","0.0783","","","1.051","","","1.085","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007927","8.7367","0.0005","10.2118","0.0005","8.3386","0.0008","111.508","0.006","95.216","0.006","87.374","0.004","689.22","0.09","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2-(1-phenyl-1,3-butadien-2-yl)benzoic acid","","- C17 H14 O2 -","- C17 H14 O2 -","- C34 H28 O4 -","2","1","FG1488","Mague, Joel T.; Hua, Xiao-Gang; Li, Chao-Jun","An Unexpected Product of an Indium-Mediated Carbon‒Carbon Coupling: 2-(1-Phenyl-1,3-butadien-2-yl)benzoic Acid","Acta Crystallographica Section C","1998","54","12","1934","1936","10.1107/S0108270198010117","","","0.71073","MoKα","","0.073","0.038","","0.113","","0.098","","","1.03","","","1.098","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007928","9.1055","0.0008","13.124","0.002","13.796","0.003","90","","92.429","0.011","90","","1647.1","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 S8 -","- C14 H10 S8 -","- C56 H40 S32 -","4","1","FG1493","Mézière, Cécile; Sallé, Marc; Fourmigué, Marc","2'-(1,3-Dithiolan-2-ylidene)-4'-(1,3-dithiol-2-ylidene)spiro[1,3-dithiole-2,5'-(4'<i>H</i>-5',6'-dihydro-1',3'-dithiapentalene)], the Self-Condensation Product of an Extended Tetrathiafulvalene Derivative","Acta Crystallographica Section C","1998","54","12","2005","2007","10.1107/S0108270198009809","","","0.71073","MoKα","","0.14","0.04","","0.108","","0.086","","","1.013","","","1.116","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007929","7.617","0.003","15.433","0.006","13.652","0.005","90","","90.112","0.01","90","","1604.8","1.1","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5,5'-bis(acetylamino)-2,2'-dihydroxybiphenyl monohydrate","","- C16 H18 N2 O5 -","- C16 H18 N2 O5 -","- C64 H72 N8 O20 -","4","0.5","FG1496","Clegg, William; Teat, Simon J.; Prasad, Korlakunte V. R.; Ristic, Radoljub I.; Sheen, David B.; Shepherd, Evelyn A.; Sherwood, John N.; Vrcelj, Ranko M.; Shepherd, Evelyn A.","An Oxidatively Coupled Dimer of Paracetamol","Acta Crystallographica Section C","1998","54","12","1881","1882","10.1107/S0108270198009445","","","0.6874","synchrotron","","0.078","0.062","","","","0.158","","","","","","0.933","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007930","7.5204","0.001","17.061","0.002","12.2921","0.0017","90","","92.187","0.004","90","","1576","0.4","160","2","160","2","","","","","","","","5","C 1 c 1","C -2yc","9","","2-methylpyridinium bis(pyrocatecholato-O,O')borate","","- C18 H16 B N O4 -","- C18 H16 B N O4 -","- C72 H64 B4 N4 O16 -","4","1","FG1497","Clegg, William; Scott, Andrew J.; Lawlor, Fiona J.; Norman, Nicholas C.; Marder, Todd B.; Dai, Chaoyang; Nguyen, Paul","Salts of the Bis(catecholato)borate Anion with Organic Cations","Acta Crystallographica Section C","1998","54","12","1875","1880","10.1107/S0108270198009810","","","0.71073","MoKα","","0.05","0.044","","","","0.111","","","","","","1.088","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007931","11.6469","0.0014","10.9779","0.0014","13.5215","0.0017","90","","112.482","0.003","90","","1597.4","0.3","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-methylpyridinium bis(pyrocatecholato-O,O')borate","","- C18 H16 B N O4 -","- C18 H16 B N O4 -","- C72 H64 B4 N4 O16 -","4","1","FG1497","Clegg, William; Scott, Andrew J.; Lawlor, Fiona J.; Norman, Nicholas C.; Marder, Todd B.; Dai, Chaoyang; Nguyen, Paul","Salts of the Bis(catecholato)borate Anion with Organic Cations","Acta Crystallographica Section C","1998","54","12","1875","1880","10.1107/S0108270198009810","","","0.71073","MoKα","","0.07","0.043","","","","0.109","","","","","","1.027","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007932","9.944","0.003","11.116","0.003","14.491","0.004","90","","94.9","0.015","90","","1595.9","0.8","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-methylpyridinium bis(pyrocatecholato-O,O')borate","","- C18 H16 B N O4 -","- C18 H16 B N O4 -","- C72 H64 B4 N4 O16 -","4","1","FG1497","Clegg, William; Scott, Andrew J.; Lawlor, Fiona J.; Norman, Nicholas C.; Marder, Todd B.; Dai, Chaoyang; Nguyen, Paul","Salts of the Bis(catecholato)borate Anion with Organic Cations","Acta Crystallographica Section C","1998","54","12","1875","1880","10.1107/S0108270198009810","","","0.71073","MoKα","","0.067","0.042","","","","0.103","","","","","","1.051","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007933","16.12","0.002","15.959","0.002","14.9294","0.0019","90","","90","","90","","3840.7","0.8","160","2","160","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","1,10-phenanthrolinium bis(pyrocatecholato-O,O')borate","","- C24 H17 B N2 O4 -","- C24 H17 B N2 O4 -","- C192 H136 B8 N16 O32 -","8","1","FG1497","Clegg, William; Scott, Andrew J.; Lawlor, Fiona J.; Norman, Nicholas C.; Marder, Todd B.; Dai, Chaoyang; Nguyen, Paul","Salts of the Bis(catecholato)borate Anion with Organic Cations","Acta Crystallographica Section C","1998","54","12","1875","1880","10.1107/S0108270198009810","","","0.71073","MoKα","","0.095","0.055","","","","0.177","","","","","","1.025","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007934","10.3594","0.0011","11.0153","0.0011","12.0742","0.0013","96.361","0.002","107.932","0.002","115.848","0.002","1130.4","0.2","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","1,10-phenanthrolinium bis(pyrocatecholato-O,O')borate dichloromethane solvate","","- C25 H19 B Cl2 N2 O4 -","- C25 H19 B Cl2 N2 O4 -","- C50 H38 B2 Cl4 N4 O8 -","2","1","FG1497","Clegg, William; Scott, Andrew J.; Lawlor, Fiona J.; Norman, Nicholas C.; Marder, Todd B.; Dai, Chaoyang; Nguyen, Paul","Salts of the Bis(catecholato)borate Anion with Organic Cations","Acta Crystallographica Section C","1998","54","12","1875","1880","10.1107/S0108270198009810","","","0.71073","MoKα","","0.06","0.043","","","","0.1","","","","","","1.095","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007935","22.417","0.003","8.439","0.0009","17.4208","0.0019","90","","110.477","0.003","90","","3087.4","0.6","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trimethylphosphonium bis(pyrocatecholato-O,O')borate","","- C15 H18 B O4 P -","- C15 H18 B O4 P -","- C120 H144 B8 O32 P8 -","8","2","FG1497","Clegg, William; Scott, Andrew J.; Lawlor, Fiona J.; Norman, Nicholas C.; Marder, Todd B.; Dai, Chaoyang; Nguyen, Paul","Salts of the Bis(catecholato)borate Anion with Organic Cations","Acta Crystallographica Section C","1998","54","12","1875","1880","10.1107/S0108270198009810","","","0.71073","MoKα","","0.085","0.049","","","","0.115","","","","","","1.033","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007936","7.6299","0.0008","7.5234","0.0009","13.6917","0.0008","90","","93.28","0.007","90","","784.65","0.13","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","quinoline-4-carboxylic acid","","","- C10 H7 N O2 -","- C10 H7 N O2 -","- C40 H28 N4 O8 -","4","1","FG1498","Dobson, Allison J.; Gerkin, Roger E.","Quinoline-4-carboxylic Acid","Acta Crystallographica Section C","1998","54","12","1883","1885","10.1107/S0108270198009585","","","0.71073","MoKα","","","0.036","","","0.085","","","","","1.86","1.86","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007937","11.67","0.003","9.78","0.002","17.777","0.005","90","","90.37","0.02","90","","2028.9","0.9","170","1","170","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Tripelennamine tetrachlorocobaltate(II)","N-Benzyl-N',N'-dimethyl-N-(2-pyridinio)-1,2-ethanediammonium tetrachlorocobaltate(II)","","- C16 H23 Cl4 Co N3 -","- C16 H23 Cl4 Co N3 -","- C64 H92 Cl16 Co4 N12 -","4","1","FG1505","Parvez, Masood","Tripelennamine Tetrachlorocobaltate(II)","Acta Crystallographica Section C","1998","54","12","1748","1750","10.1107/S0108270198009457","","","0.71069","MoKα","","0.177","0.047","","","","0.161","","","","","","0.98","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007938","6.978","0.0001","17.156","0.003","13.996","0.003","90","","90","","90","","1675.5","0.5","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","(Maleate)(aqua)(4,4'dimethyl-2,2'-bipyridine) copper(II) dihydrate","","- C15 H20 Cu N2 O7 -","- C15 H20 Cu N2 O7 -","- C60 H80 Cu4 N8 O28 -","4","0.5","FR1117","Gasque, Laura; Moreno-Esparza, Rafael; Mollins, Elies; Briansó-Penalva, José Luis; Ruiz-Ramírez, Lena; Medina-Dickinson, Gerardo","Aqua(4,4'-dimethyl-2,2'-bipyridine-<i>N</i>,<i>N</i>')(malonato-<i>O</i>,<i>O</i>')copper(II) Dihydrate","Acta Crystallographica Section C","1998","54","12","1848","1850","10.1107/S0108270198008178","","","0.71073","MoKα","","0.13","0.041","","","0.102","0.115","","","","","","0.956","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007939","12.6472","0.0007","11.3613","0.0006","13.6908","0.0007","90","","110.363","0.001","90","","1844.28","0.17","296","1","296","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Ce2 H40 N8 O36 S8 -","- Ce2 H40 N8 O36 S8 -","- Ce4 H80 N16 O72 S16 -","2","0.5","FR1130","Yongkui Shan; Songping D. Huang","(NH~4~)~8~[Ce~2~(SO~4~)~8~] .4H~2~O","Acta Crystallographica Section C","1998","54","12","1744","1745","10.1107/S0108270198007057","","","0.7107","MoKα","","0.027","0.022","","0.035","","0.034","","","0.942","","","0.973","","","","has coordinates","187340","2020-10-21","18:00:00",""
"2007940","10.2266","0.0009","10.7507","0.0011","11.0355","0.0008","64.4","0.007","70.297","0.007","78.614","0.008","1028.2","0.17","295","","","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H46 Cd Cu2 N4 O10 -","- C42 H46 Cd Cu2 N4 O10 -","- C42 H46 Cd Cu2 N4 O10 -","1","0.5","FR1131","Ercan, Filiz; Ülkü, Dinçer; Atakol, Orhan; Dinçer, F. Nazlι","Bis{(μ-acetato)[μ-bis(salicylidene)-1,3-propanediaminato]copper(II)}cadmium(II) Dioxane Solvate","Acta Crystallographica Section C","1998","54","12","1787","1790","10.1107/S010827019800835X","","","0.71073","MoKα","","","0.033","","","0.042","","","","","1.08","1.08","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007941","9.069","0.002","17.009","0.003","15.104","0.002","90","","99.47","0.02","90","","2298.1","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2,3-diethoxy-1-(1,10-phenanthroline-N,N')-1-ruthena-closo-undecaborane","","- C16 H26 B10 N2 O2 Ru -","- C16 H26 B10 N2 O2 Ru -","- C64 H104 B40 N8 O8 Ru4 -","4","1","FR1135","Yong Nie; Chun-Hua Hu; Jian-Min Dou; Hai-Jun Yao; Jie Sun; Ruo-Shui Jin; Pei-Ju Zheng","A 1,10-Phenanthroline-Ligated <i>closo</i>-Ruthenaundecaborane: [(C~12~H~8~N~2~)RuB~10~H~8~(OC~2~H~5~)~2~]","Acta Crystallographica Section C","1998","54","12","1813","1815","10.1107/S0108270198007938","","","0.71069","MoKα","","","0.029","","","","0.086","","","","","","1.009","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007942","8.4414","0.0005","7.7207","0.0005","19.412","0.0018","90","","90.342","0.006","90","","1265.13","0.16","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H10 I2 N4 Pt -","- C8 H10 I2 N4 Pt -","- C32 H40 I8 N16 Pt4 -","4","1","FR1137","Casas, Jose S.; Castiñeiras, Alfonso; Parajó, Yolanda; Sordo, José; Varela, José M.","(1,1'-Dimethyl-2,2'-biimidazole-<i>N</i>^3^,<i>N</i>^3'^)diiodoplatinum(II)","Acta Crystallographica Section C","1998","54","12","1777","1779","10.1107/S0108270198009950","","","0.71073","MoKα","","0.06","0.027","","","","0.062","","","","","","1.046","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007943","9.299","0.0014","18.698","0.001","9.0381","0.0016","90","","91.75","0.03","90","","1570.7","0.4","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","theobromine","3,7-dihydro-3,7-dimethyl-1H-purine-2,6-dione","","- C7 H8 N4 O2 -","- C7 H8 N4 O2 -","- C56 H64 N32 O16 -","8","2","FR1140","Ford, Kimberly A.; Ebisuzaki, Yukiko; Boyle, Paul D.","Methylxanthines. II. Anhydrous Theobromine","Acta Crystallographica Section C","1998","54","12","1980","1983","10.1107/S0108270198009469","","","0.71073","MolybdenumKα","","","0.067","","0.074","0.074","","","","","1.58","1.58","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007944","18.955","0.002","12.143","0.001","18.773","0.002","90","","103.739","0.006","90","","4197.4","0.7","296","","296","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","4,4'-dimethylbiphenyl-2,2'-dicarboxylic acid","","","- C16 H14 O4 -","- C16 H14 O4 -","- C192 H168 O48 -","12","1.5","FR1147","Gerkin, Roger E.","Hydrogen-Bonded Trimers in 4,4'-Dimethylbiphenyl-2,2'-dicarboxylic Acid","Acta Crystallographica Section C","1998","54","12","1887","1889","10.1107/S0108270198009597","","","0.71073","MoKα","","","0.057","","","0.094","","","","","1.79","1.79","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007945","10.041","0.003","12.127","0.003","7.039","0.002","92.08","0.02","90.67","0.03","97.72","0.02","848.7","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Pentasodium dibismuth arsenate bis(diarsenate)","","- As5 Bi2 Na5 O18 -","- As5 Bi2 Na5 O18 -","- As10 Bi4 Na10 O36 -","2","1","GS1000","Boughzala, Habib; Jouini, Tahar","Na~5~Bi~2~(AsO~4~)(As~2~O~7~)~2~","Acta Crystallographica Section C","1998","54","12","1731","1733","10.1107/S010827019800674X","","","0.71069","MoKα","","0.0491","0.0285","","0.0837","0.0645","","","","1.145","1.013","1.013","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007946","14.07","0.002","11.328","0.002","26.375","0.003","90","","101.458","0.009","90","","4120","1.1","173","","173","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","vanadyl mésopentafluorophenylporphyrine","[(5,10,15,20-tetrapentafluorophenylporphyrinato)-oxo-vanadium(IV)] dichloromethane solvate","","- C45 H10 Cl2 F20 N4 O V -","- C45 H10 Cl2 F20 N4 O V -","- C180 H40 Cl8 F80 N16 O4 V4 -","4","1","GS1004","Duval, Hugues; Bulach, Véronique; Fischer, Jean; Weiss, Raymond","Vanadyl Tetrakis(pentafluorophenyl)porphyrin Dichloromethane Solvate","Acta Crystallographica Section C","1998","54","12","1781","1784","10.1107/S0108270198008038","","","0.71073","MoKα","","0.084","0.046","","0.105","","0.072","","","2.108","","","1.479","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007947","9.444","0.001","10.676","0.001","11.408","0.001","82.44","0.001","85.41","0.001","67.95","0.001","1056.22","0.18","298","","","","","","","","","","","3","P -1","-P 1","2","","","","- C24 H14 N10 -","- C24 H14 N10 -","- C48 H28 N20 -","2","1","GS1005","Mernari, B.; El Azhar, M.; El Attari, H.; Lagrenée, M.; Pierrot, M.","Complexe de Tétracyanoquinodiméthane et 4-Amino-3,5-bis(2-pyridyle)-1,2,4-triazole (TCNQ:abpt)","Acta Crystallographica Section C","1998","54","12","1983","1986","10.1107/S0108270198008427","","","0.71073","MoKα","","","0.057","","","0.068","","","","","1.211","1.211","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007948","6.721","0.002","12.278","0.004","11.096","0.002","90","","93.87","0.02","90","","913.6","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,3-Dihydro Naphto[2,3-b]1,4-Dioxine","","- C12 H10 O2 -","- C12 H9.16 O2 -","- C48 H36.64 O8 -","4","1","GS1007","Namouchi Cherni, Saoussen; Haloui, Asma; Driss, Ahmed; Meganem, Faouzi","2,3-Dihydronaphto[2,3-<i>b</i>][1,4]dioxine","Acta Crystallographica Section C","1998","54","12","1865","1867","10.1107/S0108270198009470","","","0.71069","MoKα","","0.072","0.0399","","0.1275","0.1076","","","","1.052","1.137","1.137","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007949","7.449","0.003","10.724","0.004","17.733","0.01","90","","90","","90","","1416.6","1.1","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4,7,7,12-Tetramethyl-2-oxa-tricyclo[6.4.0.0 ^4,9^]dodecane-3(R),12(R)-diol","","- C15 H26 O3 -","- C15 H26 O3 -","- C60 H104 O12 -","4","1","GS1013","Chiaroni, Angèle; Riche, Claude; Lassaba, Essediya; Benharref, Ahmed","(3<i>R</i>,12<i>R</i>)-4,7,7,12-Tétraméthyl-2-oxatricyclo[6,4,0,0^4,9^]dodécane-3,12-diol. Produit de Réarrangement d'un Diépoxyde d'α-<i>cis</i>-Himachalène","Acta Crystallographica Section C","1998","54","12","1964","1965","10.1107/S0108270198009317","","","0.7109","MoKα","","0.0533","0.0403","","0.1325","0.1112","","","","1.09","1.086","1.086","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007950","13.3229","0.0008","15.9278","0.0013","32.613","0.002","90","","90","","90","","6920.6","0.8","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H47 N5 O4 Si3 -","- C27 H46.5 N5 O4 Si3 -","- C216 H372 N40 O32 Si24 -","8","2","HA1212","Rolf Buff; Helen Stoeckli-Evans; Jürg Hunziker","2'-Deoxy-3',5'-<i>O</i>-(1,1,3,3-tetraisopropyldisiloxane-1,3-diyl)-2'-<i>C</i>-(2-trimethylsilylethynyl)-<small>D</small>-adenosine","Acta Crystallographica Section C","1998","54","12","1860","1862","10.1107/S0108270198008117","","","0.71073","MoKα","","0.0652","0.0363","","","","0.0779","","","","","","0.828","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007951","9.215","0.005","9.607","0.008","10.575","0.005","113.24","0.04","91.76","0.03","90.84","0.05","859.5","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aquabis(2,3-butanedione dioximato)(cyclopentyl)cobalt(III)","","- C13 H25 Co N4 O5 -","- C13 H25 Co N4 O5 -","- C26 H50 Co2 N8 O10 -","2","1","HA1217","Chen, Ying; Chen, Hui-Lan; Duan, Chun-Ying; Liu, Yong-Jiang","Aquabis(2,3-butanedione dioximato-<i>N</i>,<i>N</i>')(cyclopentyl)cobalt(III)","Acta Crystallographica Section C","1998","54","12","1823","1825","10.1107/S0108270198009068","","","0.71073","MoKα","","0.083","0.068","","0.157","0.15","","","","0.954","1.099","1.099","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007952","11.532","0.0002","11.2967","0.0002","10.3406","0.0002","90","","96.312","0.001","90","","1338.94","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4,4a,4b,5,6,7,8,8a,9a-Decahydro-8,8a-epoxy-1,4-methano-7-methyl-5- nitro fluoren-9(9H)-one","","- C15 H17 N O4 -","- C15 H17 N O4 -","- C60 H68 N4 O16 -","4","1","HA1220","fun, Hoong-Kun; Chinnakali, Kandasamy; Hazra, Nirmal Kumar; Mal, Dipakranjan; Nigam, Gur Dayal; Razak, Ibrahim Abdul","1,9a-Epoxy-1,2,3,4,4a,4b,5,8,8a,9a-decahydro-2-methyl-4-nitro-5,8-methano-9<i>H</i>-fluoren-9-one","Acta Crystallographica Section C","1998","54","12","1925","1927","10.1107/S0108270198007549","","","0.71073","MoKα","","0.066","0.048","","0.132","0.119","","","","1.054","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007953","18.155","0.005","6.871","0.002","11.077","0.003","90","","110.96","0.02","90","","1290.3","0.6","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Neocuproine dihydrate","2,9-Dimethyl-1,10-phenanthroline dihydrate","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C56 H64 N8 O8 -","4","0.5","HA1227","Sergio Baggio; Ricardo Baggio; Alvaro W. Mombrú","2,9-Dimethyl-1,10-phenanthroline Dihydrate","Acta Crystallographica Section C","1998","54","12","1900","1902","10.1107/S0108270198009743","","","0.71073","MoKα","","0.069","0.047","","","","0.139","","","","","","1.01","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007954","15.081","0.001","15.081","0.001","16.979","0.002","90","","90","","90","","3861.6","0.6","293","2","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","Bis[cadmium(en)3]-tetraiodocadmat-diiodid","Bis[tris(1,2-ethandiamin)cadmium]-tetraiodocadmat-diiodid","","- C12 H48 Cd3 I6 N12 -","- C12 H48 Cd3 I6 N12 -","- C48 H192 Cd12 I24 N48 -","4","0.25","JZ1291","Wieczorrek, Carsten; Tebbe, Karl-Friedrich","Bis[tris(1,2-ethandiamin)cadmium]-tetraiodocadmat-diiodid","Acta Crystallographica Section C","1998","54","12","1804","1807","10.1107/S0108270198007859","","","0.71073","MoKα","","0.029","0.021","","0.033","","0.033","","","0.966","","","1.08","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007955","9.952","0.003","14.687","0.002","11.599","0.005","90","","90","","90","","1695.4","0.9","293","2","293","2","","","","","","","","3","P n a m","-P 2c 2n","62","Cesium-zinc-iodide","Tricesium-zinc-pentaiodide","","- Cs3 I5 Zn -","- Cs3 I5 Zn -","- Cs12 I20 Zn4 -","4","0.5","JZ1293","Friese, K.; Madariaga, G.; Breczewski, T.","Tricaesium Tetraiodozincate(II) Iodide, Cs~3~ZnI~5~","Acta Crystallographica Section C","1998","54","12","1737","1739","10.1107/S0108270198008361","","","0.71073","MoKα","","0.056","0.051","","0.136","0.1312","","","","1.106","1.127","1.127","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007956","13.137","0.005","9.405","0.005","12.416","0.008","90","","96.72","0.04","90","","1523.5","1.4","126","2","126","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,10,15,20-Tetrabutylbacteriochlorin","","- C36 H50 N4 -","- C36 H50 N4 -","- C72 H100 N8 -","2","0.5","JZ1301","Senge, Mathias O.; Runge, Steffen","Structure and Conformation of Photosynthetic Pigments and Related Compounds. XI. 5,10,15,20-Tetrabutylbacteriochlorin","Acta Crystallographica Section C","1998","54","12","1917","1919","10.1107/S0108270198008749","","","0.71073","MoKα","","0.091","0.056","","","","0.141","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2007957","11.483","0.002","20.709","0.004","15.652","0.003","90","","118.71","0.01","90","","3264.5","1.1","95","2","95","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Bis(trichlorophosphine)iminium Hexachlorophosphate","Trichloro[(trichlorophosphoranylidene)iminio]phosphorus(V)hexachlorophosphate","","- Cl12 N P3 -","- Cl12 N P3 -","- Cl96 N8 P24 -","8","2","JZ1304","Belaj, Ferdinand","Bis(trichlorophosphine)iminium Hexachlorophosphate","Acta Crystallographica Section C","1998","54","12","1735","1737","10.1107/S0108270198009706","","","0.71069","MoKα","","0.0539","0.0392","","","","0.0919","","","","","","1.115","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007958","7.1135","0.0007","16.1388","0.0016","10.9876","0.001","90","","99.439","0.011","90","","1244.3","0.2","240","2","240","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-Pyrazine-N:N'-bis[aqua(N-salicylideneglycinato-O,N,O')copper(II)] dihydrate","","- C22 H26 Cu2 N4 O10 -","- C22 H26 Cu2 N4 O10 -","- C44 H52 Cu4 N8 O20 -","2","0.5","JZ1309","Warda, Salam A.","μ-Pyrazine-<i>N</i>:<i>N</i>'-bis[aqua(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)] Dihydrate","Acta Crystallographica Section C","1998","54","12","1756","1758","10.1107/S0108270198008440","","","0.71073","MoKα","","","0.029","","","","0.073","","","","","","0.972","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007959","13.6203","0.0008","10.8747","0.0004","9.9647","0.0003","90","","93.774","0.004","90","","1472.74","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(2-methylpyridine-N)(N-salicylideneglycinato-O,N,O`)copper(II)","","- C15 H16 Cu N2 O4 -","- C15 H16 Cu N2 O4 -","- C60 H64 Cu4 N8 O16 -","4","1","JZ1310","Warda, Salam A.","Aqua(2-methylpyridine-<i>N</i>)(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1998","54","12","1754","1755","10.1107/S0108270198009238","","","1.54178","CuKα","","","0.0465","","","","0.1123","","","","","","1.017","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007960","22.112","0.012","11.091","0.008","15.208","0.01","90","","120.88","0.05","90","","3201","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(Di-n-butylstanio)-bis(thio-2-phenylquinazolin)","","- C36 H36 N4 S2 Sn -","- C36 H36 N4 S2 Sn -","- C144 H144 N16 S8 Sn4 -","4","0.5","KA1265","Viktor Vrábel; Drahomír Oktavec; Július Sivý; Ivan Skačani","Di-<i>n</i>-butylbis(2-phenylquinazoline-4-thiolato-<i>N</i>^3^,<i>S</i>)tin(IV)","Acta Crystallographica Section C","1998","54","12","1790","1791","10.1107/S0108270198007574","","","0.71069","MoKα","","0.112","0.043","","0.07","0.063","","","","0.822","1.043","1.043","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007961","8.595","0.002","10.449","0.002","11.243","0.002","68.96","0.03","81.14","0.03","66.9","0.03","866.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","tetraammonium disodium octacosaoxo(dimolybdo)octavanadate decahydrate","","- H36 Mo2 N4 Na2 O38 V8 -","- Mo2.02 N4 Na2 O38 V7.98 -","- Mo2.02 N4 Na2 O38 V7.98 -","1","0.5","KA1273","Xu, Yan; Xu, Ji-Qing; Yang, Guo-Yu; Xing, Yan; Lin, Yong-Hua; Jia, Heng-Qing","(NH~4~)~4~Na~2~[Mo~2~V^IV^~2~V^V^~6~O~28~].10H~2~O","Acta Crystallographica Section C","1998","54","12","1733","1735","10.1107/S0108270198008853","","","0.71073","MoKα","","0.0514","0.0464","","0.1507","0.1473","","","","1.065","1.119","1.119","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007962","8.291","0.003","11.303","0.006","13.967","0.005","90.12","0.04","98.17","0.03","111.83","0.03","1200.5","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(2,2'-bipyridine-N,N')(isothiocyanato-N)copper(II) Tricyanomethanide","","- C25 H16 Cu N8 S -","- C25 H16 Cu N8 S -","- C50 H32 Cu2 N16 S2 -","2","1","KA1277","Potočňák, Ivan; Dunaj-Jurčo, Michal; Mikloš, Dušan; Jäger, Lothar","Bis(2,2'-bipyridine-<i>N</i>,<i>N</i>')(isothiocyanato-<i>N</i>)copper(II) Tricyanomethanide","Acta Crystallographica Section C","1998","54","12","1760","1763","10.1107/S0108270198007963","","","0.71073","MoKα","","0.112","0.033","","0.098","","0.078","","","0.645","","","0.74","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007963","6.416","0.003","10.109","0.004","10.2","0.004","109.8","0.04","103.93","0.04","95.95","0.03","591.6","0.5","150","2","150","2","","","","","","","","5","P 1","P 1","1","","tris[tris{(2-hydroxymethyl)methyl}ammonium] D-3-phosphoglycerate","","- C15 H40 N3 O16 P -","- C15 H40 N3 O16 P -","- C15 H40 N3 O16 P -","1","1","KA1281","Jerzykiewicz, Lucjan B.; Lis, Tadeusz","Tris{[tris(2-hydroxymethyl)methyl]ammonium} <small>D</small>-3-Phosphoglycerate at 150K and Tris(cyclohexylammonium) <small>D</small>-3-Phosphoglycerate Ethanol Solvate at 85K","Acta Crystallographica Section C","1998","54","12","2015","2019","10.1107/S0108270198007732","","","0.71073","MoKα","","0.0427","0.0313","","0.0887","0.082","","","","1.128","1.117","1.117","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007964","11.501","0.009","9.122","0.007","13.859","0.012","90","","99.22","0.06","90","","1435","2","85","2","85","2","","","","","","","","5","P 1 21 1","P 2yb","4","","tris(cyclohexylammonium) D-3-phosphoglycerate ethanol","","- C23 H52 N3 O8 P -","- C23 H52 N3 O8 P -","- C46 H104 N6 O16 P2 -","2","1","KA1281","Jerzykiewicz, Lucjan B.; Lis, Tadeusz","Tris{[tris(2-hydroxymethyl)methyl]ammonium} <small>D</small>-3-Phosphoglycerate at 150K and Tris(cyclohexylammonium) <small>D</small>-3-Phosphoglycerate Ethanol Solvate at 85K","Acta Crystallographica Section C","1998","54","12","2015","2019","10.1107/S0108270198007732","","","0.71073","MoKα","","0.1003","0.0514","","0.1432","0.1253","","","","1.052","1.065","1.065","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007965","8.599","0.002","11.992","0.002","14.844","0.004","90","","90","","90","","1530.7","0.6","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Dimethylammonium Pentachloroantimonate (III)","","- C4 H16 Cl5 N2 Sb -","- C4 H16 Cl5 N2 Sb -","- C16 H64 Cl20 N8 Sb4 -","4","0.5","KA1283","Bujak, Maciej; Zaleski, Jacek","Bis(dimethylammonium) Pentachloroantimonate(III), on the Deformation of the Octahedral Coordination of Sb^III^","Acta Crystallographica Section C","1998","54","12","1773","1777","10.1107/S0108270198008865","","","0.71073","MoKα","","0.0427","0.0231","","","","0.062","","","","","","0.973","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007966","8.541","0.002","11.873","0.002","14.83","0.003","90","","90","","90","","1503.9","0.5","85","2","300","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Dimethylammonium Pentachloroantimonate (III)","","- C4 H16 Cl5 N2 Sb -","- C4 H16 Cl5 N2 Sb -","- C16 H64 Cl20 N8 Sb4 -","4","0.5","KA1283","Bujak, Maciej; Zaleski, Jacek","Bis(dimethylammonium) Pentachloroantimonate(III), on the Deformation of the Octahedral Coordination of Sb^III^","Acta Crystallographica Section C","1998","54","12","1773","1777","10.1107/S0108270198008865","","","0.71073","MoKα","","0.0357","0.0278","","","","0.055","","","","","","1.069","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007967","20.118","0.004","8.358","0.002","23.444","0.005","90","","114.02","0.03","90","","3600.7","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","{Methyl[2-cyano-2-(hydroxyimino)]ethanimidate}-bipyridine- nitrosodicyanomethanidecopper(II)","","- C17 H12 Cu N8 O3 -","- C17 H12 Cu N8 O3 -","- C136 H96 Cu8 N64 O24 -","8","1","KA1284","Dunaj-Jurčo, Michal; Mikloš, Dušan; Potočňák, Ivan; Jäger, Lothar","Dicyanonitrosomethanide as a Subject of Nucleophilic Addition of Methanol and as an End-<i>O</i>-Coordinated Ligand in the Same Copper(II) Complex. II. (Bipyridine)(dicyanonitrosomethanido)[methyl(2-cyano-2-hydroxyimino)ethanimidato]copper(II)","Acta Crystallographica Section C","1998","54","12","1763","1765","10.1107/S0108270198007975","","","0.71073","MoKα","","0.178","0.037","","0.081","","0.065","","","0.693","","","0.957","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007968","8.162","0.002","9.919","0.002","22.021","0.004","90","","90","","90","","1782.8","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","17-Ethylenedioxyandrost-4-ene-3,6-dione","17-Ethylenedioxyandrost-4-ene-3,6-dione","","- C21 H28 O4 -","- C21 H28 O4 -","- C84 H112 O16 -","4","1","KA1285","Addlagatta Anthony; Mariusz Jaskolski; Ashwini Nangia; Gautam R. Desiraju","17,17-Ethylenedioxyandrost-4-ene-3,6-dione and 17,17-Ethylenedioxyandrosta-1,4-diene-3,6-dione","Acta Crystallographica Section C","1998","54","12","1894","1898","10.1107/S0108270198008385","","","0.71073","MoKα","","0.066","0.0331","","0.0981","0.0829","","","","1.064","1.083","1.083","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007969","9.854","0.002","10.86","0.002","16.524","0.003","90","","90","","90","","1768.3","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","17-Ethylenedioxyandrosta-1,4-diene-3,6-dione","17-Ethylenedioxyandrosta-1,4-diene-3,6-dione","","- C21 H26 O4 -","- C21 H26 O4 -","- C84 H104 O16 -","4","1","KA1285","Addlagatta Anthony; Mariusz Jaskolski; Ashwini Nangia; Gautam R. Desiraju","17,17-Ethylenedioxyandrost-4-ene-3,6-dione and 17,17-Ethylenedioxyandrosta-1,4-diene-3,6-dione","Acta Crystallographica Section C","1998","54","12","1894","1898","10.1107/S0108270198008385","","","0.71073","MoKα","","0.1084","0.0375","","0.1158","0.0888","","","","1.035","1.094","1.094","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007970","7.9475","0.0005","8.3767","0.0007","25.019","0.002","90","","90","","90","","1665.6","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","5β-androstan-3,17-dione","5β-androstan-3,17-dione","","- C19 H28 O2 -","- C19 H28 O2 -","- C76 H112 O8 -","4","1","KA1287","Addlagatta Anthony; Mariusz Jaskolski; Ashwini Nangia; Gautam R. Desiraju","5β-Androstan-3,17-dione","Acta Crystallographica Section C","1998","54","12","1898","1900","10.1107/S010827019800804X","","","1.54178","CuKα","","0.04","0.032","","0.093","0.084","","","","1.049","1.043","1.043","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007971","9.299","0.001","7.279","0.003","12.404","0.001","90","","90.05","0.01","90","","839.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","6-phenyl-5-azauracil","6-phenyl-1,3,5-triazin-2,4[1H,3H]-dione","","- C9 H7 N3 O2 -","- C9 H7 N3 O2 -","- C36 H28 N12 O8 -","4","1","KA1294","Lowe, Philip R.; Schwalbe, Carl H.","Classical Packing and Stacking in 6-Phenyl-5-azauracil","Acta Crystallographica Section C","1998","54","12","1936","1938","10.1107/S010827019800969X","","","0.71073","MoKα","","0.049","0.034","","0.096","0.093","","","","1.042","1.168","1.168","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007972","9.727","0.002","10.335","0.002","24.177","0.005","90","","90","","90","","2430.5","0.9","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3β-acetoxy-17β-picolyl-5-androsten-16-one.","","- C27 H35 N O3 -","- C27 H35 N O3 -","- C108 H140 N4 O12 -","4","1","LN1052","Lazar, Dušan; Stanković, Slobodanka; Sakač, Marija; Penov-Gašić, Katarina; Kovačević, Radmila; Medić-Mijačević, Ljubica; Pilati, Tullio","Structure‒Activity Relationships in 16- and 17-Substituted 5-Androstenes: 3β-Acetoxy-17β-picolyl-5-androsten-16-one","Acta Crystallographica Section C","1998","54","12","1965","1968","10.1107/S0108270198009342","","","0.71073","MoKα","","0.13","0.057","","0.19","0.133","","","","0.893","0.926","0.926","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007973","9.5664","0.0012","7.0768","0.0009","14.2175","0.001","90","","108.137","0.007","90","","914.69","0.18","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","t-butyl 3-[4-(2-bromoethoxy)-3-chlorophenyl]-5-methylisoxasole-4- carboxylate","","- C17 H19 Br Cl N O4 -","- C17 H19 Br Cl N O4 -","- C34 H38 Br2 Cl2 N2 O8 -","2","1","LN1061","Dupont, Léon; Kohl, Michel; Lejeune, Robert","<i>tert</i>-Butyl 3-[4-(2-Bromoethoxy)-3-chlorophenyl]-5-methylisoxazole-4-carboxylate","Acta Crystallographica Section C","1998","54","12","1957","1959","10.1107/S0108270198009482","","","1.5418","CuKα","","0.0391","0.0317","","","","0.0895","","","","","","0.942","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007974","15.316","0.005","19.798","0.005","14.484","0.002","90","","90","","90","","4391.9","1.9","292","","292","","","","","","","","","6","P c c n","-P 2ab 2ac","56","","Magnesium Sulfate Hexaurea Hemihydrate","","- C6 H25 Mg N12 O10.5 S -","- C6 H25 Mg N12 O10.5 S -","- C48 H200 Mg8 N96 O84 S8 -","8","1","NA1345","Todor Todorov; Rosica Petrova; Krasimir Kossev; Josef Macíček; Olyana Angelova","Magnesium Sulfate Hexaurea Hemihydrate","Acta Crystallographica Section C","1998","54","12","1758","1760","10.1107/S0108270198007070","","","0.71073","MoKα","","","0.05","","","","0.063","","","","","","1.057","","","","has coordinates","191097","2020-10-21","18:00:00",""
"2007975","11.095","0.004","8.28","0.006","16.445","0.004","90","","94.02","0.02","90","","1507","1.3","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Mercuric chloride-2,2^'^:6^'^2^''^-terpyridine","","- C15 H11 Cl2 Hg N3 -","- C15 H11 Cl2 Hg N3 -","- C60 H44 Cl8 Hg4 N12 -","4","1","NA1361","Matković-Čalogović, Dubravka; Davidović, Naka; Popović, Zora; Žugaj, Željka","Dichloro(2,2':6',2''-terpyridyl-<i>N</i>,<i>N</i>',<i>N</i>'')mercury(II)","Acta Crystallographica Section C","1998","54","12","1766","1768","10.1107/S0108270198009494","","","0.71073","MoKα","","0.091","0.0408","","","","0.1048","","","","","","0.992","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007976","18.4255","0.0016","7.2396","0.0006","7.6466","0.0005","90","","101.126","0.006","90","","1000.83","0.14","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Tetracyano-p-xylene","","- C12 H6 N4 -","- C12 H6 N4 -","- C48 H24 N16 -","4","0.5","NA1363","Arena, Antonella; Bruno, Giuseppe; Panzalorto, Manuela; Patané, Salvatore; Saitta, Gaetano; Scopelliti, Rosario","Tetracyano-<i>p</i>-xylene","Acta Crystallographica Section C","1998","54","12","2003","2005","10.1107/S0108270198009500","","","0.71073","MoKα","","0.0489","0.0371","","0.1069","0.1032","","","","","","","0.966","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007977","13.38","0.002","15.14","0.003","13.634","0.001","90","","109.46","0.01","90","","2604.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","dichloro bis(3,5-diphenylpyrazole)copper(II)","","- C30 H24 Cl2 Cu N4 -","- C30 H24 Cl2 Cu N4 -","- C120 H96 Cl8 Cu4 N16 -","4","1","NA1369","Małecka, Magdalena; Grabowski, Mieczysław J.; Olszak, Tomasz A.; Kostka, K.; Strawiak, M.","Investigations of Complexes of Copper(II) Chloride with Phenylpyrazoles","Acta Crystallographica Section C","1998","54","12","1770","1773","10.1107/S0108270198008786","","","1.5418","CuKα","","0.065","0.044","","","","0.119","","","","","","0.896","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2007978","8.041","0.002","15.768","0.003","14.549","0.002","90","","91.73","0.02","90","","1843.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","dichlorobis(5-phenylpyrazole)copper(II)","","- C18 H16 Cl2 Cu N4 -","- C18 H16 Cl2 Cu N4 -","- C72 H64 Cl8 Cu4 N16 -","4","1","NA1369","Małecka, Magdalena; Grabowski, Mieczysław J.; Olszak, Tomasz A.; Kostka, K.; Strawiak, M.","Investigations of Complexes of Copper(II) Chloride with Phenylpyrazoles","Acta Crystallographica Section C","1998","54","12","1770","1773","10.1107/S0108270198008786","","","1.5418","CuKα","","0.086","0.045","","","","0.11","","","","","","0.824","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007979","14.795","0.001","14.795","0.001","16.634","0.002","90","","90","","90","","3641","0.6","293","2","293","2","","","","","","","","5","I 41 c d","I 4bw -2c","110","","dichloro bis (1-phenylpyrazole) copper (II)","","- C18 H16 Cl2 Cu N4 -","- C18 H16 Cl2 Cu N4 -","- C144 H128 Cl16 Cu8 N32 -","8","0.5","NA1369","Małecka, Magdalena; Grabowski, Mieczysław J.; Olszak, Tomasz A.; Kostka, K.; Strawiak, M.","Investigations of Complexes of Copper(II) Chloride with Phenylpyrazoles","Acta Crystallographica Section C","1998","54","12","1770","1773","10.1107/S0108270198008786","","","1.5418","CuKα","","0.034","0.027","","","","0.063","","","","","","0.923","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007980","9.7898","0.0009","7.3974","0.0006","17.292","0.002","90","","99.368","0.006","90","","1235.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(1-naphthylmethyl)-1,7-dioxa-4,10-diazacyclododecano","","- C30 H34 N2 O2 -","- C30 H34 N2 O2 -","- C60 H68 N4 O4 -","2","0.5","NA1370","Alessandra Forni","Two Macrocyclic Azacrown Ethers","Acta Crystallographica Section C","1998","54","12","1921","1923","10.1107/S0108270198007550","","","0.71073","MoKα","","0.0652","0.0323","","0.0789","0.0707","","","","0.855","1.038","1.038","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007981","11.369","0.003","12.175","0.003","12.268","0.003","64.42","0.02","72.89","0.02","73.37","0.02","1438.7","0.7","245","2","245","2","","","","","","","","5","P -1","-P 1","2","","4,10,16,22-tetra(1-naphthylmethyl)-1,7,13,19-tetraoxa-4,10,16,22- tetraazacyclotetracosano","","- C62 H72 Cl4 N4 O4 -","- C62 H72 Cl4 N4 O4 -","- C62 H72 Cl4 N4 O4 -","1","0.5","NA1370","Alessandra Forni","Two Macrocyclic Azacrown Ethers","Acta Crystallographica Section C","1998","54","12","1921","1923","10.1107/S0108270198007550","","","0.71073","MoKα","","0.0571","0.0355","","0.0952","0.084","","","","0.948","1.073","1.073","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007982","8.103","0.004","5.686","0.003","14.27","0.008","90","","95.94","0.04","90","","653.9","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","trans-2,2'-dichloro-4,4'-dimethylazobenzene","","- C14 H12 Cl2 N2 -","- C14 H12 Cl2 N2 -","- C28 H24 Cl4 N4 -","2","0.5","NA1372","Crispini, Alessandra; Ghedini, Mauro; Pucci, Daniela","<i>trans</i>-2,2'-Dichloro-4,4'-dimethylazobenzene","Acta Crystallographica Section C","1998","54","12","1869","1871","10.1107/S0108270198008798","","","0.71073","MoKα","","0.0491","0.0417","","0.1174","0.1119","","","","1.062","1.124","1.124","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007983","6.8417","0.0004","10.2086","0.0005","14.6099","0.0008","90","","101.574","0.005","90","","999.67","0.1","293","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","(+) (2R)-1-[(3,4-dichlorophenyl)acetyl]-2-[(1-pyrrolidinylium)methyl]piperidine chloride monohydrate","","- C18 H27 Cl3 N2 O2 -","- C18 H27 Cl3 N2 O2 -","- C36 H54 Cl6 N4 O4 -","2","1","NA1373","Peeters, Oswald M.; Jamroz, Dorota; Norbert M. Blaton; De Ranter, Camiel J.","Two 1-(Arylacetyl)-2-(aminomethyl)piperidine Derivatives, a Novel Class of Highly Selective κ-Opioid Analgesics","Acta Crystallographica Section C","1998","54","12","1968","1970","10.1107/S0108270198008191","","","1.54184","CuKα","","0.038","0.036","","0.103","","0.103","","","1.041","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2007984","7.0585","0.0006","7.0673","0.0004","40.53","0.002","90","","90","","90","","2021.8","0.2","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-) (2S)-1-[(3,4-dichlorophenyl)acetyl]-2-[(1-piperidinylium)methyl]piperidine chloride","","- C19 H27 Cl3 N2 O -","- C19 H27 Cl3 N2 O -","- C76 H108 Cl12 N8 O4 -","4","1","NA1373","Peeters, Oswald M.; Jamroz, Dorota; Norbert M. Blaton; De Ranter, Camiel J.","Two 1-(Arylacetyl)-2-(aminomethyl)piperidine Derivatives, a Novel Class of Highly Selective κ-Opioid Analgesics","Acta Crystallographica Section C","1998","54","12","1968","1970","10.1107/S0108270198008191","","","1.54184","CuKα","","0.034","0.032","","0.097","","0.097","","","1.059","","","1.059","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007985","13.971","0.002","14.308","0.003","18.205","0.004","93.241","0.014","98.32","0.015","92.942","0.012","3588.5","1.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","bis(6,6'-dibromo-2,2'-bipyridyl)copper(I) perchlorate","","- C20 H12 Br4 Cl Cu N4 O4 -","- C20 H12 Br4 Cl Cu N4 O4 -","- C120 H72 Br24 Cl6 Cu6 N24 O24 -","6","3","NA1374","Ward, Michael D.; Couchman, Samantha M.; Jeffery, John C.","[Cu<i>L</i>~2~][ClO~4~] and [Ag<i>L</i>~2~][BF~4~], where <i>L</i> = 6,6'-Dibromo-2,2'-bipyridine","Acta Crystallographica Section C","1998","54","12","1820","1823","10.1107/S0108270198009159","","","0.71073","MoKα","","0.143","0.05","","0.092","0.07","","","","0.89","1.021","1.021","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007986","12.726","0.002","22.233","0.003","8.6069","0.0008","90","","97.437","0.012","90","","2414.7","0.6","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","bis(6,6'-dibromo-2,2'-bipyridyl)copper(I) tetrafluoroborate","","- C20 H12 Ag B Br4 F4 N4 -","- C20 H12 Ag B Br4 F4 N4 -","- C80 H48 Ag4 B4 Br16 F16 N16 -","4","1","NA1374","Ward, Michael D.; Couchman, Samantha M.; Jeffery, John C.","[Cu<i>L</i>~2~][ClO~4~] and [Ag<i>L</i>~2~][BF~4~], where <i>L</i> = 6,6'-Dibromo-2,2'-bipyridine","Acta Crystallographica Section C","1998","54","12","1820","1823","10.1107/S0108270198009159","","","0.71073","MoKα","","0.048","0.031","","0.066","0.062","","","","0.93","1.022","1.022","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007987","7.446","0.002","12.179","0.003","12.279","0.003","90","","102.6","0.05","90","","1086.7","0.5","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-Diiodo(N-methylpiperazine-N,N')Platinum(II)","","- C5 H12 I2 N2 Pt -","- C5 H12 I2 N2 Pt -","- C20 H48 I8 N8 Pt4 -","4","1","NA1376","Ciccarese, Antonella; Clemente, Dore Augusto; Fanizzi, Francesco P.; Marzotto, Armando; Valle, Giovanni","Platinum(II) Complexes of Piperazine (and Derivatives): <i>cis</i>-Diiodo(<i>N</i>-methylpiperazine-<i>N</i>,<i>N</i>')platinum(II)","Acta Crystallographica Section C","1998","54","12","1779","1781","10.1107/S0108270198009755","","","0.7107","MoKα","","0.1155","0.0568","","0.2052","0.1582","","","","1.06","1.052","1.052","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007988","7.204","0.0013","7.6076","0.0011","35.187","0.009","90","","90","","90","","1928.4","0.7","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,5-Cyclohexadiene-1,4-dione,3-(methylamino)-5-[(1,2,3,4,4a,7,8, 8a-octahydro-1,2,4a,5-tetramethyl-1-naphthalenyl)methyl] 4'-METHYLAMINO AVARONE","","- C22 H31 N O2 -","- C22 H31 N O2 -","- C88 H124 N4 O8 -","4","1","NA1378","Puliti, Raffaella; De Rosa, Salvatore; Mattia, Carlo Andrea","4'-Methylaminoavarone from <i>Dysidea avara</i>","Acta Crystallographica Section C","1998","54","12","1954","1957","10.1107/S010827019800924X","","","1.54056","CuKα","","0.0509","0.0447","","","0.0443","","","","","0.927","0.927","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007989","9.069","0.005","9.595","0.003","21.624","0.007","90","","90","","90","","1881.7","1.3","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-(1'-hydroxy-4'-isopropyl-2',2'-dimethyl-1',2' -dihydrobenzocyclobuten-1'-yl)-3-mrthyl-2 -butanone ethylene acetal","","- C20 H30 O3 -","- C20 H30 O3 -","- C80 H120 O12 -","4","1","OA1055","Iida, Katsumi; Kawata, Etsuya; Komada, Kaori; Saito, Masaichi; Kumakura, Shigekazu; Yoshioka, Michikazu","Highly Strained C—C Bonds: 3-(1'-Hydroxy-4'-isopropyl-2',2'-dimethyl-1',2'-dihydrobenzocyclobuten-1'-yl)-3-methyl-2-butanone Ethylene Acetal, (I), and (3<i>S</i>^*^,1'<i>S</i>^*^)-3-Acetoxy-2-(1'-hydroxy-1',2'-dihydrobenzocyclobuten-1'-yl)-2-methylpentane, (II)","Acta Crystallographica Section C","1998","54","12","1938","1941","10.1107/S0108270198009895","","","0.71073","MoKα","","","0.068","","","","0.071","","","","","","1.32","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007990","7.5","0.002","8.505","0.002","11.852","0.005","85.22","0.07","88.89","0.07","77.23","0.03","734.7","0.4","298","","","","","","","","","","","3","P -1","-P 1","2","","(3S^*^,1'3S^*^)-3-acetoxy-2-(1'-hydroxy-1',2' -dihydrobenzocyclobuten-1'-yl)-2-methylpentane","","- C16 H22 O3 -","- C16 H22 O3 -","- C32 H44 O6 -","2","1","OA1055","Iida, Katsumi; Kawata, Etsuya; Komada, Kaori; Saito, Masaichi; Kumakura, Shigekazu; Yoshioka, Michikazu","Highly Strained C—C Bonds: 3-(1'-Hydroxy-4'-isopropyl-2',2'-dimethyl-1',2'-dihydrobenzocyclobuten-1'-yl)-3-methyl-2-butanone Ethylene Acetal, (I), and (3<i>S</i>^*^,1'<i>S</i>^*^)-3-Acetoxy-2-(1'-hydroxy-1',2'-dihydrobenzocyclobuten-1'-yl)-2-methylpentane, (II)","Acta Crystallographica Section C","1998","54","12","1938","1941","10.1107/S0108270198009895","","","0.71073","MoKα","","","0.06","","","","0.07","","","","","","1.612","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2007991","9.2032","0.0008","14.792","0.004","7.483","0.002","101.15","0.02","96.175","0.014","88.701","0.013","993.7","0.4","293","2","293","2","","","","","","","","4","P 1","P 1","1","C-Trp","Cytosynyl-tryptophan","","- C36 H50 N10 O14 -","- C36 H46 N10 O14 -","- C36 H46 N10 O14 -","1","1","OS1006","Mitsunobu Doi; Mariko Tarui; Mihoko Ogata; Akiko Asano; Toshimasa Ishida","A Cytosine and Tryptophan Hybrid Dipeptide: Cytosinyl-<small>L</small>-tryptophan‒Water (2/6)","Acta Crystallographica Section C","1998","54","12","1941","1943","10.1107/S0108270198008051","","","1.5418","CuKα","","0.07","0.0537","","","","0.1677","","","","","","0.966","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007992","7.15","0.002","10.284","0.002","27.726","0.002","90","","90","","90","","2038.8","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H32 O5 S -","- C19 H32 O5 S -","- C76 H128 O20 S4 -","4","1","","S. Yonezawa; M. Leblanc; A. Guesdon; C. Alexandre","1-(5-Methanesulfinyl-2,2,6-trimethyl-3a,3b,4,5,6,8a-hexahydro-1, 3,8-trioxacyclopenta[a]inden-5-yl)hexan-1-ol","Acta Crystallographica Section C","1998","54","","1986","1987","","","","","","","","0.0392","","","0.108","","","","","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007993","16.46","0.003","15.717","0.003","22.023","0.004","90","","92.931","0.005","90","","5689.9","1.8","293","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H43 Cl3 Mn2 N10 O18.5 -","- C52 H43 Cl3 Mn2 N10 O18.5 -","- C208 H172 Cl12 Mn8 N40 O74 -","4","1","OS1015","Wilson, Claire; Larsen, Finn K.; Figgis, Brian N.","Di-μ-oxo-bis[bis(bipyridine-<i>N</i>,<i>N</i>')manganese(III, IV)] Triperchlorate Bis(nitrobenzene) Hemihydrate","Acta Crystallographica Section C","1998","54","12","1797","1799","10.1107/S0108270198008701","","","0.71073","MoKα","","0.132","0.074","","0.152","","","","","1.273","1.566","1.566","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2007994","6.941","0.001","6.569","0.001","11.315","0.002","90","","90.55","0.02","90","","515.89","0.14","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","FOX-7","1,1‒diamino‒2,2‒dinitroethylene","","- C2 H4 N4 O4 -","- C2 H4 N4 O4 -","- C8 H16 N16 O16 -","4","1","OS1020","Bemm, Ulf; Östmark, Henric","1,1-Diamino-2,2-dinitroethylene: a Novel Energetic Material with Infinite Layers in Two Dimensions","Acta Crystallographica Section C","1998","54","12","1997","1999","10.1107/S0108270198007987","","","0.71073","MoKα","","0.0347","0.0312","","","","0.0808","","","","","","1.655","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2007995","8.935","0.002","15.733","0.007","18.372","0.004","90","","90","","90","","2582.6","1.4","223","1","223","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H14 N2 O10 Pb -","- C6 H14 N2 O10 Pb -","- C48 H112 N16 O80 Pb8 -","8","1","OS1021","Lashgari, Koroush; Kritikos, Mikael; Lashgari, Kianosh; Westin, Gunnar","Pb(NO~3~)~2~(EO3), where EO3 is Triethylene Glycol","Acta Crystallographica Section C","1998","54","12","1794","1797","10.1107/S0108270198008312","","","0.71073","MoKα","","0.075","0.046","","0.111","0.099","","","","1.076","1.132","1.132","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007996","19.856","0.003","21.45","0.004","7.228","0.005","90","","90","","90","","3078","2","294","2","294","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","3RS,4RS-2-Methyl-3,4-diphenylhex-5-en-3-ol","","- C19 H22 O -","- C19 H22 O -","- C152 H176 O8 -","8","1","OS1022","Rainer Sjöholm; Reijo Sillanpää","(3<i>RS</i>,4<i>RS</i>)-2-Methyl-3,4-diphenyl-5-hexen-3-ol","Acta Crystallographica Section C","1998","54","12","1999","2001","10.1107/S0108270198008609","","","0.71069","MoKα","","0.1127","0.053","","","","0.1481","","","","","","1.022","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2007997","23.553","0.0005","5.3933","0.0001","22.9996","0.0003","90","","90","","90","","2921.6","0.09","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","(E)-2-Hydroxy-3,3',4'-trimethoxystilbene","","- C17 H18 O4 -","- C17 H18 O4 -","- C136 H144 O32 -","8","1","OS1025","Stomberg, Rolf; Li, Shiming; Lundquist, Knut; Albinsson, Bo","Investigation of Three Stilbene Derivatives by X-ray Crystallography and NMR Spectroscopy","Acta Crystallographica Section C","1998","54","12","1929","1934","10.1107/S0108270198008877","","","0.71073","MoKα","","0.0533","0.0435","","0.1206","0.1096","","","","1.075","1.077","1.077","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007998","12.4168","0.0007","12.9562","0.0007","12.2833","0.0007","97.641","0.007","113.547","0.007","77.483","0.007","1766.1","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","(E)-2-Acetoxy-3,3',4'-trimethoxystilbene","","- C19 H20 O5 -","- C19 H20 O5 -","- C76 H80 O20 -","4","2","OS1025","Stomberg, Rolf; Li, Shiming; Lundquist, Knut; Albinsson, Bo","Investigation of Three Stilbene Derivatives by X-ray Crystallography and NMR Spectroscopy","Acta Crystallographica Section C","1998","54","12","1929","1934","10.1107/S0108270198008877","","","1.54178","CuKα","","0.0806","0.0472","","0.1534","0.1299","","","","1.033","1.112","1.112","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2007999","12.8655","0.0002","12.0107","0.0002","12.4608","0.0001","90","","117.031","0.001","90","","1715.15","0.04","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-2-Acetoxy-3,3',4'-trimethoxystilbene","","- C19 H20 O5 -","- C19 H20 O5 -","- C76 H80 O20 -","4","1","OS1025","Stomberg, Rolf; Li, Shiming; Lundquist, Knut; Albinsson, Bo","Investigation of Three Stilbene Derivatives by X-ray Crystallography and NMR Spectroscopy","Acta Crystallographica Section C","1998","54","12","1929","1934","10.1107/S0108270198008877","","","0.71073","MoKα","","0.0736","0.0443","","0.1175","0.0956","","","","1.124","1.111","1.111","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008000","21.2854","0.0001","7.8608","0.0001","9.3555","0.0002","90","","100.229","0.001","90","","1540.48","0.04","293","2","293","2","","","","","","","","3","C 1 c 1","C -2yc","9","","(Z)-2-Hydroxy-3,3',4'-trimethoxystilbene","","- C17 H18 O4 -","- C17 H18 O4 -","- C68 H72 O16 -","4","1","OS1025","Stomberg, Rolf; Li, Shiming; Lundquist, Knut; Albinsson, Bo","Investigation of Three Stilbene Derivatives by X-ray Crystallography and NMR Spectroscopy","Acta Crystallographica Section C","1998","54","12","1929","1934","10.1107/S0108270198008877","","","0.71073","MoKα","","0.0276","0.0262","","0.0737","0.0708","","","","1.048","1.025","1.025","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008001","11.695","0.002","11.91","0.003","15.535","0.002","72.61","0.01","79.83","0.01","77.16","0.02","1999.1","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H20 F15 Ir O P2 -","- C43 H20 F15 Ir O P2 -","- C86 H40 F30 Ir2 O2 P4 -","2","1","OS1027","John Fawcett; Eric G. Hope; Lee A. Peck","<i>trans</i>-Carbonyl(pentafluorophenyl-<i>C</i>)bis[(pentafluorophenyl)diphenylphosphine-<i>P</i>]iridium(I)","Acta Crystallographica Section C","1998","54","12","1752","1753","10.1107/S0108270198008063","","","0.71073","MoKα","","0.043","0.033","","0.084","0.078","","","","0.976","0.987","0.987","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008002","7.382","0.001","7.791","0.001","11.437","0.001","94.11","0.01","101.7","0.01","93.39","0.01","640.62","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-Hydroxy-2-ethyl-1-4benzyl-pyridin-4-one","","- C14 H17 N O3 -","- C14 H17 N O3 -","- C28 H34 N2 O6 -","2","1","OS1028","Burgess, John; Fawcett, John; Russell, David R.; Waltham, Emma","Four <i>N</i>-Benzyl-Substituted 2-Ethyl-3-hydroxypyridin-4-ones","Acta Crystallographica Section C","1998","54","12","2011","2015","10.1107/S0108270198008488","","","0.71073","MoKα","","0.11","0.076","","0.228","0.196","","","","1.055","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008003","7.2766","0.0007","7.3473","0.0006","13.294","0.001","91.395","0.006","90.823","0.008","117.258","0.009","631.37","0.11","190","2","190","2","","","","","","","","4","P -1","-P 1","2","","3-Hydroxy-2-ethyl-1-4methylbenzyl-pyridin-4-one","","- C15 H17 N O2 -","- C15 H17 N O2 -","- C30 H34 N2 O4 -","2","1","OS1028","Burgess, John; Fawcett, John; Russell, David R.; Waltham, Emma","Four <i>N</i>-Benzyl-Substituted 2-Ethyl-3-hydroxypyridin-4-ones","Acta Crystallographica Section C","1998","54","12","2011","2015","10.1107/S0108270198008488","","","0.71073","MoKα","","0.044","0.039","","0.114","0.109","","","","1.031","1.054","1.054","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008004","7.266","0.001","12.408","0.002","14.681","0.002","113.05","0.01","100.2","0.01","90.74","0.01","1193.7","0.3","190","2","190","2","","","","","","","","5","P -1","-P 1","2","","3-Hydroxy-2-ethyl-1-4fluorobenzyl-pyridin-4-one","","- C14 H14 F N O2 -","- C14 H14 F N O2 -","- C56 H56 F4 N4 O8 -","4","2","OS1028","Burgess, John; Fawcett, John; Russell, David R.; Waltham, Emma","Four <i>N</i>-Benzyl-Substituted 2-Ethyl-3-hydroxypyridin-4-ones","Acta Crystallographica Section C","1998","54","12","2011","2015","10.1107/S0108270198008488","","","0.71073","MoKα","","0.053","0.038","","0.099","0.09","","","","1.043","1.076","1.076","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008005","14.645","0.001","11.634","0.001","17.832","0.003","90","","110.1","0.02","90","","2853.2","0.7","190","2","190","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","3-Hydroxy-2-ethyl-1-4trifluoromethylbenzyl-pyridin-4-one","","- C15 H15 F3 N O2.5 -","- C15 H15 F3 N O2.5 -","- C120 H120 F24 N8 O20 -","8","2","OS1028","Burgess, John; Fawcett, John; Russell, David R.; Waltham, Emma","Four <i>N</i>-Benzyl-Substituted 2-Ethyl-3-hydroxypyridin-4-ones","Acta Crystallographica Section C","1998","54","12","2011","2015","10.1107/S0108270198008488","","","0.71073","MoKα","","0.128","0.067","","0.165","0.133","","","","1.023","1.096","1.096","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008006","13.903","0.001","13.903","0.001","25.963","0.003","90","","90","","90","","5018.5","0.8","295","","295","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C12 H30 Hg I4 S2 -","- C12 Hg I4 S2 -","- C96 Hg8 I32 S16 -","8","0.5","OS1033","Bengtsson-Kloo, L.; Berglund, J.; Stegemann, H.; Svensson, C.; Svensson, Per H.","Bis(triethylsulfonium) Tetraiodomercurate(II)","Acta Crystallographica Section C","1998","54","12","1851","1853","10.1107/S0108270198008889","","","0.7107","MoKα","","","0.037","","","0.048","","","","","1.633","1.633","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2008007","7.001","0.001","10.356","0.002","8.367","0.002","90","","107.39","0.03","90","","578.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 Co K3 N6 -","- C6 Co K3 N6 -","- C12 Co2 K6 N12 -","2","0.5","QA0043","Zhou, Ping; Xue, Feng; Au-Yeung, Steve C. F.","Potassium Hexacyanocobaltate, a Redetermination","Acta Crystallographica Section C","1998","54","12","IUC9800062","","10.1107/S0108270198099193","","","0.71073","MoKα","","0.053","0.041","","","","0.1","","","","","","1.081","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008008","5.5806","0.0007","22.641","0.003","7.0249","0.0003","90","0.01","99.79","0.01","90","0.01","874.67","0.17","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H11 N O7 -","- C5 H11 N O7 -","- C20 H44 N4 O28 -","4","1","QA0059","Krishnakumar, R. V.; Subha Nandhini, M.; Natarajan, S.","Sarcosinium Oxalate Monohydrate","Acta Crystallographica Section C","1998","54","12","IUC9800063","","10.1107/S0108270198099144","","","0.71073","MoKα","","0.058","0.046","","0.187","","0.129","","","1.145","","","1.1","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008009","13.541","0.004","13.177","0.004","17.06","0.004","90","","98.49","0.02","90","","3010.7","1.5","210","2","210","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","([9]aneS3)(5-NO2-phen)Pd](PF6)2.MeNO2","[(5-Nitro-1,10-phenanthroline)(1,4,7-trithiacyclononane-S,S',S"")palladium(II)] Bis(hexafluorophosphate) Nitromethane Solvate","","- C19 H22 F12 N4 O4 P2 Pd S3 -","- C19 H19 F12 N4 O4 P2 Pd S3 -","- C76 H76 F48 N16 O16 P8 Pd4 S12 -","4","1","QA0064","Blake, Alexander J.; Champness, Neil R.; Li, Wan-Sheung; Schröder, Martin","[(5-Nitro-1,10-phenanthroline-<i>N</i>,<i>N</i>')(1,4,7-trithiacyclononane-<i>S</i>,<i>S</i>',<i>S</i>'')palladium(II)] Bis(hexafluorophosphate) Nitromethane Solvate","Acta Crystallographica Section C","1998","54","12","IUC9800071","","10.1107/S0108270198099156","","","0.71073","MoKα","","0.121","0.077","","","","0.19","","","","","","1.212","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"2008010","10.081","0.001","8.927","0.001","16.508","0.001","90","","102.29","0.01","90","","1451.6","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-[α-(N-succimidyl)benzyl]selenamorpholine","","- C15 H18 N2 O2 Se -","- C15 H18 N2 O2 Se -","- C60 H72 N8 O8 Se4 -","4","1","QA0065","Wu, Jun; Liu, Xiu-Fang; Xu, Han-Sheng; Huang, Jing-Wei; Hu, Sheng-Zhi; Ng, Seik Weng","<i>N</i>-[α-(<i>N</i>-Succimidyl)benzyl]selenamorpholine","Acta Crystallographica Section C","1998","54","12","IUC9800066","","10.1107/S0108270198099132","","","1.54184","CuKα","","0.063","0.057","","","","0.171","","","","","","1.046","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008011","6.399","0.001","13.415","0.002","7.288","0.001","90","","110.1","0.01","90","","587.52","0.15","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-dinitroso-N,N'-dimethoxy-2,3-dimethyl-2,3-butanediamine","","- C8 H18 N4 O4 -","- C8 H18 N4 O4 -","- C16 H36 N8 O8 -","2","0.5","QA0066","Irina Yu. Bagryanskaya; Tatyana V. Rybalova; Yuri V. Gatilov; Vadim K. Khlestkin; Dmitrii G. Mazhukin","The First X-ray Study of Alkoxynitrosoamines","Acta Crystallographica Section C","1998","54","12","IUC9800073","","10.1107/S0108270198099120","","","1.54178","CuKα","","0.0431","0.0403","","0.1269","0.111","","","","1.111","1.13","1.13","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008012","6.424","0.001","13.611","0.002","7.231","0.001","90","","109.74","0.01","90","","595.1","0.16","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-formyl-N'-nitroso-N,N'-dimethoxy-2,3-dimethyl-2,3-butanediamine","","- C9 H19 N3 O4 -","- C9 H19 N3 O4 -","- C18 H38 N6 O8 -","2","0.5","QA0066","Irina Yu. Bagryanskaya; Tatyana V. Rybalova; Yuri V. Gatilov; Vadim K. Khlestkin; Dmitrii G. Mazhukin","The First X-ray Study of Alkoxynitrosoamines","Acta Crystallographica Section C","1998","54","12","IUC9800073","","10.1107/S0108270198099120","","","1.54178","CuKα","","0.0383","0.036","","0.102","0.1003","","","","1.085","1.122","1.122","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008013","8.13","0.003","9.425","0.001","9.748","0.007","86.13","0.02","73.38","0.03","66.463","0.019","655.3","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","N,N-diethylphenylsulfonylacetamide","","","- C12 H17 N O3 S -","- C12 H17 N O3 S -","- C24 H34 N2 O6 S2 -","2","1","QA0069","Céard, Sophie; Gaumet, Vincent; Roche, Danielle; Métin, Jacques; Madesclaire, Michel","<i>N</i>,<i>N</i>-Diethylphenylsulfonylacetamide","Acta Crystallographica Section C","1998","54","12","IUC9800067","","10.1107/S0108270198099119","","","0.71073","MoKα","","0.0609","0.0421","","","","0.1298","","","","","","1.072","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008014","7.5872","0.0001","11.1006","0.0002","19.6648","0.0001","90","","90","","90","","1656.22","0.04","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,4-Diphenyl-2,2,3,3-tetrachlorbicyclo[2.2.0]hexane","","- C18 H14 Cl4 -","- C18 H14 Cl4 -","- C72 H56 Cl16 -","4","1","QA0070","Boese, Roland; Roth, Wolfgang R.; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","2,2,3,3-Tetrachloro-1,4-diphenylbicyclo[2.2.0]hexane, a Strained Bicyclic System","Acta Crystallographica Section C","1998","54","12","IUC9800072","","10.1107/S0108270198099107","","","0.71073","MoKα","","0.039","0.036","","","","0.092","","","","","","1.094","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008015","9.848","0.005","17.539","0.009","21.95","0.009","111.06","0.03","92.19","0.04","106.2","0.04","3357","3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H56 Ag P Si3 -","- C26 H56 Ag P Si3 -","- C104 H224 Ag4 P4 Si12 -","4","2","QB0054","Stammler, Hans-Georg; Jutzi, Peter; Wieland, Wolfram; Neumann, Beate","(Tributylphosphine-<i>P</i>)[1,2,4-tris(trimethylsilyl)cyclopentadienyl]silver(I)","Acta Crystallographica Section C","1998","54","12","IUC9800064","","10.1107/S0108270198099168","","","0.71073","MoKα","","0.148","0.064","","0.125","0.082","","","","1.211","1.38","1.38","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008016","12.5629","0.0006","12.5629","0.0006","7.6587","0.0007","90","","90","","90","","1208.75","0.14","200","2","200","2","","","","","","","","6","P 4/n :2","-P 4a","85","Tetraphenylphosphonium tetrachloro[oxovanadate(V)]","Tetraphenylphosphonium tetrachloro[oxovanadate(V)]","","- C24 H20 Cl4 O P V -","- C24 H20 Cl4 O P V -","- C48 H40 Cl8 O2 P2 V2 -","2","0.25","QB0064","Wulff-Molder, Dirk; Meisel, Manfred","Tetraphenylphosphonium Tetrachlorooxovanadate(V)","Acta Crystallographica Section C","1998","54","12","IUC9800068","","10.1107/S010827019809917X","","","0.71073","MoKα","","0.066","0.036","","0.097","","0.08","","","1.155","","","1.144","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008017","8.9459","0.0002","5.4133","0.0002","13.2114","0.0003","90","","90","","90","","639.79","0.03","299","2","299","2","","","","","","","","3","P n m a","-P 2ac 2n","62","α strontium diphosphate","α distrontium diphosphate","","- O7 P2 Sr2 -","- O7 P2 Sr2 -","- O28 P8 Sr8 -","4","0.5","QB0066","Jacques Barbier; Jean-Philippe Echard","A New Refinement of α-Sr~2~P~2~O~7~","Acta Crystallographica Section C","1998","54","12","IUC9800070","","10.1107/S0108270198099181","","","0.71073","MoKα","","0.0268","0.0206","","0.0471","0.0458","","","","1.248","1.29","1.29","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008018","29.432","0.004","7.292","0.001","15.958","0.002","90","","117.12","0.01","90","","3048.3","0.8","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","p-Methoxyacetophenone-2,4-dinitrophenylhydrazone","","- C15 H14 N4 O5 -","- C15 H14 N4 O5 -","- C120 H112 N32 O40 -","8","1","QB0067","Bolte, Michael; Dill, Michele","4'-Methoxyacetophenone 2,4-Dinitrophenylhydrazone at 173K","Acta Crystallographica Section C","1998","54","12","IUC9800065","","10.1107/S0108270198099090","","","0.71073","MoKα","","0.052","0.041","","","","0.119","","","","","","1.029","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008019","8.8787","0.0016","7.9846","0.0016","12.395","0.003","90","","100.243","0.015","90","","864.7","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","cis-8-Methylbicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid","","- C10 H10 O2 -","- C10 H10 O2 -","- C40 H40 O8 -","4","1","QB0068","Boese, Roland; Roth, Wolfgang R.; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","<i>cis</i>-8-Methylbicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic Acid at 293K","Acta Crystallographica Section C","1998","54","12","IUC9800069","","10.1107/S0108270198099089","","","0.71073","MoKα","","0.114","0.0736","","","","0.2064","","","","","","1.074","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008020","7.792","0.001","10.39","0.001","18.894","0.002","90","","90","","90","","1529.6","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C8 H4 Ba O4 -","- C8 H4 Ba O4 -","- C64 H32 Ba8 O32 -","8","1","SK1168","Lo, Samuel Man Fung; Chui, Stephen Sin Yin; Williams, Ian D.","Barium Terephthalate, a Three-Dimensional Coordination Polymer with 7:7 Cation‒Anion Connectivity","Acta Crystallographica Section C","1998","54","12","1846","1848","10.1107/S0108270198009512","","","0.71073","MoKα","","0.0388","0.0248","","0.0594","0.0487","","","","1.053","1.088","1.088","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2008021","9.57","0.0003","20.2292","0.0007","22.1484","0.0005","90","","100.122","0.001","90","","4221","0.2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C34 H44 Br Cl2 Mo2 N O6 S2 -","- C34 H44 Br Cl2 Mo2 N O6 S2 -","- C136 H176 Br4 Cl8 Mo8 N4 O24 S8 -","4","1","SK1177","Pan, Guohua; Zhuang, Botao; Chen, Jiutong","A Hetero-Tribridged Dinuclear Molybdenum Compound [Bu~4~N][Mo~2~(CO)~6~(<i>p</i>-Cl-C~6~H~4~ S)~2~Br]","Acta Crystallographica Section C","1998","54","12","1815","1816","10.1107/S010827019800763X","","","0.71073","MoKα","","0.1922","0.0657","","0.2497","0.1591","","","","0.886","1.049","1.049","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008022","32.421","0.003","6.235","0.001","22.646","0.001","90","","91.333","0.007","90","","4576.5","0.9","292","2","292","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(1S^*^,3S^*^)-3-methoxy-1-methyl-3-phenyl-3-(1,1,1-trimethylsilyl)-propyl 3,5-dinitrobenzoate.","","- C21 H26 N2 O7 Si -","- C21 H26 N2 O7 Si -","- C168 H208 N16 O56 Si8 -","8","1","SK1185","Baudoux, Guy; Norberg, Bernadette; Bousbaa, Jamal; Krief, Alain; Evrard, Guy","A Dinitrobenzoate Derivative of an α-Methoxy-γ-hydroxysilane","Acta Crystallographica Section C","1998","54","12","1944","1945","10.1107/S0108270198004612","","","1.54178","CuKα","","0.0478","0.0402","","","","0.1215","","","","","","1.11","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008023","9.315","0.002","10.849","0.002","9.407","0.002","90","","90","","90","","950.7","0.3","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","tripotassium-tantalum-tetrasulfide","","","- K3 S4 Ta -","- K3 S4 Ta -","- K12 S16 Ta4 -","4","0.5","SK1197","Herzog, Sabine; Näther, Christian; Bensch, Wolfgang","K~3~Ta S~4~","Acta Crystallographica Section C","1998","54","12","1742","1744","10.1107/S0108270198007641","","","0.71073","MoKα","","0.0332","0.0304","","0.0781","0.076","","","","1.103","1.129","1.129","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008024","17.066","0.002","16.863","0.002","18.487","0.002","90","","94.65","0.011","90","","5302.8","1.1","160","2","160","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Cu(bpy)3][Ni(dmit)2]2","[Tris-(2,2'-bipyridyl)copper(II)]-bis-[bis(2-thioxo-1,3-dithiole-4,5- dithiolato)nickelate(III)]","","- C42 H24 Cu N6 Ni2 S20 -","- C42 H24 Cu N6 Ni2 S20 -","- C168 H96 Cu4 N24 Ni8 S80 -","4","0.5","SK1205","Faulmann, Christophe; Veldhuizen, Yvonne S. J.; Haasnoot, Jaap G.; Reedijk, Jan; Cassoux, Patrick","A New Ni(dmit)~2~ Salt with a Paramagnetic Cation: [Cu(bpy)~3~][Ni(C~3~S~5~)~2~]~2~","Acta Crystallographica Section C","1998","54","12","1827","1830","10.1107/S0108270198011007","","","0.71073","MoKα","","0.039","0.028","","","","0.07","","","","","","1.003","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008025","8.467","0.0007","9.7895","0.0006","11.0973","0.0006","73.717","0.006","81.592","0.006","87.474","0.009","873.44","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H18 N2 O6 -","- C18 H18 N2 O6 -","- C36 H36 N4 O12 -","2","1","SK1209","Francese, Giancarlo; Neels, Antonia; Stoeckli-Evans, Helen; Decurtins, Silvio","Diethyl <i>N</i>,<i>N</i>'-(Naphthalene-1,8-diyl)dioxamate","Acta Crystallographica Section C","1998","54","12","1858","1859","10.1107/S0108270198009652","","","0.71073","MoKα","","0.074","0.05","","","","0.199","","","","","","1.256","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008026","12.8086","0.0009","6.6542","0.0004","14.4143","0.001","90","","97.679","0.009","90","","1217.53","0.14","294","1","294","1","","","","","","","","4","P 1 21 1","P 2yb","4","","5-Deoxy-1,2-O-isopropylidene-5-C-triphenylstannyl-α-L-xylofuranose.","","- C26 H28 O4 Sn -","- C26 H28 O4 Sn -","- C52 H56 O8 Sn2 -","2","1","SK1213","Rufino, Helena; Wardell, James L.; Low, John N.; Falconer, Ruth; Ferguson, George","5-Deoxy-1,2-<i>O</i>-isopropylidene-5-<i>C</i>-triphenylstannyl-α-<small>L</small>-xylofuranose","Acta Crystallographica Section C","1998","54","12","1792","1794","10.1107/S0108270198009524","","","0.71073","MoKα","","0.022","0.017","","","","0.04","","","","","","1.025","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008027","10.1013","0.0009","11.82","0.001","14.1077","0.0011","77.388","0.007","85.339","0.007","74.803","0.006","1585.8","0.2","294","1","294","1","","","","","","","","3","P -1","-P 1","2","","(4-Methoxyphenyl)diphenylmethanol","","- C20 H18 O2 -","- C20 H18 O2 -","- C80 H72 O8 -","4","2","SK1217","Patterson, Iain L. J.; Glidewell, Christopher; Ferguson, George","(4-Methoxyphenyl)diphenylmethanol, an Unusual Tetramer Containing a <i>D</i>[<i>R</i>] Pattern of Hydrogen Bonds, and Tris(2-methoxyphenyl)methanol","Acta Crystallographica Section C","1998","54","12","1970","1974","10.1107/S0108270198009329","","","0.7107","MolybdenumKα","","0.09","0.037","","","","0.102","","","","","","1.008","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008028","11.9327","0.0008","10.5752","0.0009","14.6833","0.0011","90","","101.857","0.006","90","","1813.4","0.2","294","1","294","1","","","","","","","","3","C 1 c 1","C -2yc","9","","Tris(2-methoxyphenyl)methanol","","- C22 H22 O4 -","- C22 H22 O4 -","- C88 H88 O16 -","4","1","SK1217","Patterson, Iain L. J.; Glidewell, Christopher; Ferguson, George","(4-Methoxyphenyl)diphenylmethanol, an Unusual Tetramer Containing a <i>D</i>[<i>R</i>] Pattern of Hydrogen Bonds, and Tris(2-methoxyphenyl)methanol","Acta Crystallographica Section C","1998","54","12","1970","1974","10.1107/S0108270198009329","","","0.7107","MolybdenumKα","","0.048","0.031","","","","0.081","","","","","","1.056","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008029","17.104","0.001","6.012","0.001","8.11","0.001","90","","95.46","0.01","90","","830.16","0.18","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-Methoxynaphthalene","","- C11 H10 O -","- C11 H10 O -","- C44 H40 O4 -","4","1","SK1220","Bolte, Michael; Bauch, Christian","2-Methoxynaphthalene at 173K","Acta Crystallographica Section C","1998","54","12","1862","1863","10.1107/S0108270198009330","","","0.71073","MoKα","","0.046","0.038","","","","0.112","","","","","","1.072","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008030","4.1787","0.0005","13.245","0.002","14.856","0.003","90","","90","","90","","822.2","0.2","294","1","294","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2,4-dibromo-6-chloroaniline","","- C6 H4 Br2 Cl N -","- C6 H4 Br2 Cl N -","- C24 H16 Br8 Cl4 N4 -","4","1","SK1221","Ferguson, George; Low, John N.; Penner, Glenn H.; Wardell, James L.","2,4,6-Halogeno-Aniline Derivatives","Acta Crystallographica Section C","1998","54","12","1974","1977","10.1107/S0108270198009354","","","0.7107","MolybdenumKα","","0.153","0.063","","","","0.142","","","","","","0.937","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008031","16.7289","0.0015","4.6993","0.0005","25.928","0.003","90","","95.22","0.014","90","","2029.9","0.4","294","1","294","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","N-acetyl 4-bromo-2,6-dichloroaniline","","- C8 H6 Br Cl2 N O -","- C8 H6 Br Cl2 N O -","- C64 H48 Br8 Cl16 N8 O8 -","8","1","SK1221","Ferguson, George; Low, John N.; Penner, Glenn H.; Wardell, James L.","2,4,6-Halogeno-Aniline Derivatives","Acta Crystallographica Section C","1998","54","12","1974","1977","10.1107/S0108270198009354","","","0.7107","MolybdenumKα","","0.075","0.043","","","","0.112","","","","","","0.968","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008032","4.5575","0.0005","11.4987","0.0012","15.026","0.002","90","","90","","90","","787.44","0.16","294","1","294","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","N-formyl 4-bromo-2,6-difluoroaniline","","- C7 H4 Br F2 N O -","- C7 H4 Br F2 N O -","- C28 H16 Br4 F8 N4 O4 -","4","1","SK1221","Ferguson, George; Low, John N.; Penner, Glenn H.; Wardell, James L.","2,4,6-Halogeno-Aniline Derivatives","Acta Crystallographica Section C","1998","54","12","1974","1977","10.1107/S0108270198009354","","","0.7107","MolybdenumKα","","0.089","0.054","","","","0.137","","","","","","0.975","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008033","8.322","0.0007","12.5682","0.0011","18.6853","0.0018","94.663","0.008","96.98","0.007","95.479","0.006","1922.4","0.3","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","3-Ferrocenyl-2-phenyl-6-nitroquinoxaline","","- C24 H17 Fe N3 O2 -","- C24 H17 Fe N3 O2 -","- C96 H68 Fe4 N12 O8 -","4","2","SK1223","Ahmed, S. Zaka; Ferguson, George; Glidewell, Christopher","3-Ferrocenyl-6-nitro-2-phenylquinoxaline: Cyclic Centrosymmetric Dimers Depending on both C—H···O Hydrogen Bonds and π-π Stacking Interactions","Acta Crystallographica Section C","1998","54","12","1839","1842","10.1107/S0108270198009664","","","0.7107","MoKα","","0.067","0.041","","","","0.111","","","","","","0.951","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008034","22.322","0.005","11.801","0.003","7.425","0.001","90","","90","","90","","1955.9","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(-)-Tetrahydropalmatine Monohydrate","","","- C21 H27 N O5 -","- C21 H27 N O5 -","- C84 H108 N4 O20 -","4","1","SK1224","Luger, Peter; Weber, Manuela; Dung, Nguyen Xuan; Moi, La Dinh; Khoi, Ta Thi; Phuong, Doan Lan","({-})-Tetrahydropalmatine Monohydrate","Acta Crystallographica Section C","1998","54","12","1977","1980","10.1107/S0108270198009676","","","1.5418","CuKα","","0.064","0.039","","0.117","0.104","","","","1.166","1.236","1.236","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008035","10.677","0.002","12.374","0.002","8.946","0.002","110.41","0.02","107.9","0.02","99.5","0.02","1003.8","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","pivaloyloxymethyl 4-chloro-N-furfuryl-5-sulfamoylanthranilate","","- C18 H21 Cl N2 O7 S -","- C18 H21 Cl N2 O7 S -","- C36 H42 Cl2 N4 O14 S2 -","2","1","SX1045","Suescun, Leopoldo; Mariezcurrena, Raúl A.; Mombrú, Alvaro W.; González, Oscar A.; Manta, Eduardo; Prandi, Carolina","Three Isostructural Furosemide Prodrugs","Acta Crystallographica Section C","1998","54","12","1911","1915","10.1107/S0108270198007653","","","0.71069","MoKα","","0.093","0.058","","0.194","0.162","","","","1.041","1.099","1.099","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008036","10.494","0.002","12.679","0.002","8.606","0.002","107.08","0.02","107.39","0.02","103.77","0.02","975.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","butyryoxymethyl 4-chloro-N-furfuryl-5-sulfamoylanthranilate","","- C17 H19 Cl N2 O7 S -","- C17 H19 Cl N2 O7 S -","- C34 H38 Cl2 N4 O14 S2 -","2","1","SX1045","Suescun, Leopoldo; Mariezcurrena, Raúl A.; Mombrú, Alvaro W.; González, Oscar A.; Manta, Eduardo; Prandi, Carolina","Three Isostructural Furosemide Prodrugs","Acta Crystallographica Section C","1998","54","12","1911","1915","10.1107/S0108270198007653","","","0.71069","MoKα","","0.062","0.049","","0.157","0.144","","","","1.035","1.07","1.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008037","10.58","0.002","12.471","0.002","8.643","0.003","107.78","0.02","107.76","0.02","102.863","0.014","969.4","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","isobutyryloxymethyl 4-chloro-N-furfuryl-5-sulfamoylanthranilate","","- C17 H19 Cl N2 O7 S -","- C17 H19 Cl N2 O7 S -","- C34 H38 Cl2 N4 O14 S2 -","2","1","SX1045","Suescun, Leopoldo; Mariezcurrena, Raúl A.; Mombrú, Alvaro W.; González, Oscar A.; Manta, Eduardo; Prandi, Carolina","Three Isostructural Furosemide Prodrugs","Acta Crystallographica Section C","1998","54","12","1911","1915","10.1107/S0108270198007653","","","0.71069","MoKα","","0.069","0.058","","0.18","0.169","","","","1.089","1.137","1.137","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008038","7.8978","0.0001","9.1364","0.0002","13.7581","0.0001","90","","90","","90","","992.75","0.03","198","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C7 H14 N2 O6 -","- C7 H14 N2 O6 -","- C28 H56 N8 O24 -","4","1","SX1069","Jarred T. Blank; Slawomir Z. Janicki; Peter A. Petillo","β-1-<i>N</i>-Ureido-<small>D</small>-glucopyranose","Acta Crystallographica Section C","1998","54","12","1992","1994","10.1107/S0108270198007665","","","0.71073","MoKα","","0.041","0.038","","0.089","0.086","","","","1.086","1.083","1.083","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008039","7.486","0.0004","10.889","0.001","15.456","0.001","90","","94.916","0.006","90","","1255.26","0.16","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","O-Nitrobenzaldehyde isonicotinoylhydrazone","","- C13 H10 N4 O3 -","- C13 H10 N4 O3 -","- C52 H40 N16 O12 -","4","1","TA1206","Liu, Shu-Hua; Chen, Xiao-Feng; Xu, Yao-Hua; You, Xiao-Zeng; Chen, Wei; Arifin, Zainudin","<i>o</i>-Nitrobenzaldehyde Isonicotinoylhydrazone","Acta Crystallographica Section C","1998","54","12","1919","1921","10.1107/S0108270198008774","","","0.71073","MoKα","","0.1","0.055","","0.145","0.127","","","","0.99","1.166","1.166","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008040","6.996","0.001","8.106","0.001","13.602","0.001","85.68","0.01","88.36","0.01","74.88","0.01","742.51","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-hydroxy-2-methyl-N-(5-methyl-2-thiazole)-2H-1,2-benzothiazine-3 -carboxamide 1,1-dioxide","","- C14 H13 N3 O4 S2 -","- C14 H13 N3 O4 S2 -","- C28 H26 N6 O8 S4 -","2","1","VJ1082","Fabiola, G. Felcy; Pattabhi, Vasantha; Manjunatha, S. G.; Venkateshwar Rao, G.; Nagarajan, K.","4-Hydroxy-2-methyl-<i>N</i>-(5-methyl-1,3-thiazol-2-yl)-2<i>H</i>-1,2-benzothiazine-3-carboxamide 1,1-Dioxide","Acta Crystallographica Section C","1998","54","12","2001","2003","10.1107/S0108270198008452","","","1.5418","CuKα","","0.042","0.035","","0.1","0.089","","","","1.061","1.029","1.029","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008041","4.8509","0.0015","14.0214","0.0012","16.671","0.003","90","","97.43","0.02","90","","1124.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","thiabendazole nitrate","[4-(2-benzimidazolyl)thiazole]nitrate","","- C10 H8 N4 O3 S -","- C10 H8 N4 O3 S -","- C40 H32 N16 O12 S4 -","4","1","VJ1084","Murugesan, Somasundaram; Prabakaran, Ponraj; Thomas Muthiah, Packianathan","Thiabendazolium Nitrate, an Anthelmintic Compound","Acta Crystallographica Section C","1998","54","12","1905","1907","10.1107/S0108270198008968","","","0.7107","MoKα","","0.049","0.049","","0.122","","0.122","","","1.15","1.213","1.213","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008042","11.8769","0.0001","11.8769","0.0001","23.0394","0.0004","90","","90","","120","","2814.54","0.06","228","2","228","2","","","","","","","","6","R -3 m :H","-R 3 2""","166","","","","- Co H28 I Mo6 Na3 O38 -","- Co1.02 I Mo6 Na3 O38 -","- Co3.06 I3 Mo18 Na9 O114 -","3","0.0833333","BK1375","Rosu, Cristina; Dickman, Michael H.","Cobalt(II) trisodium hexamolybdoperiodate tetradecahydrate","Acta Crystallographica Section C","1999","55","1","11","13","10.1107/S0108270198011391","","","0.71073","MoKα","","0.0357","0.0334","","0.1024","0.0997","","","","1.167","1.181","1.181","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008043","12.852","0.002","12.852","0.002","13.037","0.003","90","","90","","90","","2153.4","0.7","293","2","293","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C12 H33 Cl4 Co N4 O3 -","- C12 H30 Cl4 Co N4 O3 -","- C48 H120 Cl16 Co4 N16 O12 -","4","0.5","BK1391","Jeong, Jong Hwa; Kim, Dong Yeub; Lee, Dong Jin; Lee, Bae Wook; Doh, Myung Ki","Oxonium Λ-{<i>N</i>,<i>N</i>'-bis[2(<i>S</i>)-pyrrolidinylmethyl]ethane-1,2-diamine}-<i>cis</i>-α-dichlorocobalt(III) dichloride dihydrate","Acta Crystallographica Section C","1999","55","1","56","58","10.1107/S0108270198009421","","","0.71073","MoKα","","0.046","0.042","","","","0.088","","","","","","1.084","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2008044","7.6544","0.0012","15.351","0.003","10.287","0.002","90","","106.544","0.008","90","","1158.7","0.4","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H14 Cl2 N8 Sn -","- C26 H14 Cl2 N8 Sn -","- C52 H28 Cl4 N16 Sn2 -","2","0.5","BK1399","Farris, Philip J.; Jacobs, Jude T.; Okonczac, Michael P.; Durfee, William S.; Noll, Bruce C.","<i>trans</i>-Dichloro(hemiporphyrazinato)tin(IV)","Acta Crystallographica Section C","1999","55","1","32","33","10.1107/S0108270198011408","","","0.71073","MoKα","","0.079","0.046","","0.12","0.1043","","","","0.999","1.042","1.042","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008045","10.273","0.002","11.077","0.002","13.803","0.003","69.43","0.01","68.45","0.01","79.33","0.01","1364.9","0.5","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","bis(tetraphenylphosphonium) bis(cis-1,2-dicarbomethoxyethylene-1,2-diseleno)- palladate(II)","","- C60 H52 O8 P2 Pd Se4 -","- C60 H52 O8 P2 Pd Se4 -","- C60 H52 O8 P2 Pd Se4 -","1","0.5","BK1405","McLauchlan, Craig C.; Ibers, James A.","[PPh~4~]~2~[Pd{Se~2~C~2~(COOCH~3~)~2~}~2~]","Acta Crystallographica Section C","1999","55","1","30","32","10.1107/S0108270198010543","","","0.71073","MoKα","","0.0789","0.0414","","","","0.0889","","","","","","0.899","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008046","15.894","0.001","13.693","0.002","8.442","0.001","90","","94.87","0.01","90","","1830.7","0.4","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","3,3',5,5'-tetramethyl-6,6'-dimethoxybiphenyl-2,2'-dimethanol","","","- C20 H26 O4 -","- C20 H26 O4 -","- C80 H104 O16 -","4","1","BK1410","Dobson, Allison J.; Gerkin, Roger E.","6,6'-Dimethoxy-3,3',5,5'-tetramethylbiphenyl-2,2'-dimethanol","Acta Crystallographica Section C","1999","55","1","82","84","10.1107/S0108270198009779","","","0.71073","MoKα","","","0.057","","","0.07","","","","","1.71","1.71","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008047","30.559","0.003","6.363","0.003","19.744","0.004","90","","105.82","0.01","90","","3693.7","1.9","296","","296","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","dineopentylprehnitene","","","- C20 H34 -","- C20 H34 -","- C160 H272 -","8","1","BK1414","Gerkin, Roger E.","Dineopentylprehnitene (1,2,3,4-tetramethyl-5,6-dineopentylbenzene) at 296 and 223K","Acta Crystallographica Section C","1999","55","1","79","82","10.1107/S010827019801141X","","","0.71073","MoKα","","","0.086","","","0.112","","","","","1.54","1.54","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008048","30.439","0.002","6.314","0.003","19.663","0.003","90","","106.06","0.01","90","","3631.6","1.8","223","","223","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","dineopentylprehnitene","","","- C20 H34 -","- C20 H34 -","- C160 H272 -","8","1","BK1414","Gerkin, Roger E.","Dineopentylprehnitene (1,2,3,4-tetramethyl-5,6-dineopentylbenzene) at 296 and 223K","Acta Crystallographica Section C","1999","55","1","79","82","10.1107/S010827019801141X","","","0.71073","MoKα","","","0.072","","","0.107","","","","","1.8","1.8","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008049","10.1867","0.001","9.759","0.002","17.7778","0.001","90","0.001","94.009","0.01","90","0.02","1763","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N-H...π (Indole) Intermolecular Interaction in 3,3'-Di Indolyl-Phenyl Methane","","- C23 H18 N2 -","- C23 H18 N2 -","- C92 H72 N8 -","4","1","BM1241","R. Krishna; D. Velmurugan; G. Babu; P.T. Perumal","N—H···π(indole) intermolecular interactions in 3,3'-benzylidenediindole","Acta Crystallographica Section C","1999","55","1","75","78","10.1107/S0108270198010695","","","1.54178","CuKα","","0.0671","0.0532","","0.1892","0.1618","","","","1.039","1.063","1.063","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008050","23.93","0.002","12.5245","0.0011","11.903","0.002","90","","90","","90","","3567.5","0.7","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","A complex of 4,4,8,8-tetrakis(1-pyrazolyl)pyrazabole and diphenyltin(IV) dichloride monohydrate","","- C30 H30 B2 Cl2 N12 O Sn -","- C30 H30 B2 Cl2 N12 O Sn -","- C120 H120 B8 Cl8 N48 O4 Sn4 -","4","1","BM1258","Dey, Dilip Kumar; Das, Mrinal Kanti; Chinnakali, Kandasamy; Fun, Hoong-Kun; Razak, Ibrahim Abdul","An adduct of aquadichlorodiphenyltin(IV) and 4,4,8,8-tetrakis(1-pyrazolyl)pyrazabole","Acta Crystallographica Section C","1999","55","1","20","22","10.1107/S0108270198009780","","","0.71073","MoKα","","0.068","0.039","","0.088","0.081","","","","0.887","1.01","1.01","","","","","has coordinates","194546","2020-10-21","18:00:00",""
"2008051","8.951","0.002","12.802","0.002","12.879","0.002","107.62","0.01","104.61","0.01","90.31","0.01","1355.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H10 Mo N2 O4 -","- C12 H10 Mo N2 O4 -","- C48 H40 Mo4 N8 O16 -","4","2","BM1268","Mentes, Ayfer; Fawcett, John; Kemmitt, Raymond D. W.; Russell, David R.","Molybdenum‒tetracarbonyl complexes with Schiff base ligands","Acta Crystallographica Section C","1999","55","1","48","50","10.1107/S0108270198011433","","","0.71073","MoKα","","0.044","0.033","","0.085","0.079","","","","1.071","1.102","1.102","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008052","11.529","0.002","11.879","0.001","12.661","0.004","90","","96.21","0.01","90","","1723.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H12 Mo N2 O4 -","- C17 H12 Mo N2 O4 -","- C68 H48 Mo4 N8 O16 -","4","1","BM1268","Mentes, Ayfer; Fawcett, John; Kemmitt, Raymond D. W.; Russell, David R.","Molybdenum‒tetracarbonyl complexes with Schiff base ligands","Acta Crystallographica Section C","1999","55","1","48","50","10.1107/S0108270198011433","","","0.71073","MoKα","","0.044","0.032","","0.083","0.077","","","","1.096","1.137","1.137","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008053","8.5887","0.001","8.6404","0.0006","9.6169","0.0006","90","","98.398","0.007","90","","706.02","0.11","294","1","294","1","","","","","","","","4","P 1 21 1","P 2yb","4","N-((R/S)-2-Hydroxy-2-Phenylacetyl)-L-leucine","(2S)-2-{[(2R)-2-hydroxy-2-phenylethanoyl]amino}-4-methylpentanoic acid","","- C14 H19 N O4 -","- C14 H19 N O4 -","- C28 H38 N2 O8 -","2","1","BM1269","Dalton, John P.; Gallagher, John F.; Kenny, Peter T. M.; O'Donohoe, Michael","Intramolecular N—H···O, intermolecular O—H···O, C—H···O and C<i>sp</i>^3^—H···π~arene~ interactions in (2<i>S</i>)-2-{[(2<i>R</i>)-2-hydroxy-2-phenylethanoyl]amino}-4-methylpentanoic acid","Acta Crystallographica Section C","1999","55","1","126","129","10.1107/S0108270198010063","","","0.7107","MolybdenumKα","","0.057","0.04","","","","0.119","","","","","","1.013","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008054","9.969","0.004","11.671","0.003","12.706","0.002","63.859","0.013","77.63","0.02","65.257","0.015","1204.5","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H27 Fe N4 O3 -","- C27 H27 Fe N4 O3 -","- C54 H54 Fe2 N8 O6 -","2","1","BM1273","Ling He; Qing-Fang Shi; Shao-Hua Gou; Ming Qian; Chun-Ying Duan","[<i>N</i>-Salicyl-<i>N</i>,<i>N</i>-bis(salicylidenenitriloethyl)amino]iron(III) acetonitrile solvate","Acta Crystallographica Section C","1999","55","1","46","47","10.1107/S0108270198010580","","","0.71073","MoKα","","0.0578","0.0447","","0.1207","0.1116","","","","1.045","1.069","1.069","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008055","7.212","0.002","5.177","0.001","11.498","0.003","90","0.02","93.11","0.02","90","0.03","428.6","0.4","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- B2 Ca2 O5 -","- B2 Ca2 O5 -","- B8 Ca8 O20 -","4","1","","Lin, Qi-Sheng; Cheng, Wen-Dan; Chen, Jiu-Tong; Huang, Jin-Shun","Calcium pyroborate, Ca~2~B~2~O~5~","Acta Crystallographica Section C","1999","55","","04","06","","","","","","","","0.0561","","","0.071","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008056","9.256","0.003","9.726","0.003","12.073","0.003","90","","90","","90","","1086.9","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Cl4 K3 N O3 Zn -","- Cl4 K3 N O3 Zn -","- Cl16 K12 N4 O12 Zn4 -","4","0.5","","Carter, Robert L.; Zompa, Leverett J.","The Double-Anion Salts M~3~[ZnCl~4~]NO~3~ (M = K^+^ and NH~4~^+^)","Acta Crystallographica Section C","1999","55","","06","08","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2008057","9.268","0.003","10.042","0.003","12.482","0.003","90","","90","","90","","1161.7","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Cl4 H12 N4 O3 Zn -","- Cl4 H12 N4 O3 Zn -","- Cl16 H48 N16 O12 Zn4 -","4","0.5","","Carter, Robert L.; Zompa, Leverett J.","The Double-Anion Salts M~3~[ZnCl~4~]NO~3~ (M = K^+^ and NH~4~^+^)","Acta Crystallographica Section C","1999","55","","06","08","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008058","19.8165","0.0002","11.4468","0.0001","9.9208","0.0001","90","","109.185","0.0005","90","","2125.41","0.04","293","","293","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ba4 O27 Ti12 -","- Ba4 O27 Ti12 -","- Ba16 O108 Ti48 -","4","0.5","","Currao, Antonio","Ba~4~Ti~12~O~27~: Rietveld refinement using x-ray powder diffraction data","Acta Crystallographica Section C","1999","55","","02","04","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008059","11.129","0.001","8.247","0.001","5.5395","0.0003","90","","100.88","0.01","90","","499.28","0.08","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Bloedite","","","- H8 Mg Na2 O12 S2 -","- H8 Mg Na2 O12 S2 -","- H16 Mg2 Na4 O24 S4 -","2","0.5","BR1219","Vizcayno, Carmen; Garcia-Gonzalez, M. Teresa","Na~2~Mg(SO~4~)~2~.4H~2~O, the Mg end-member of the bloedite-type of mineral","Acta Crystallographica Section C","1999","55","1","8","11","10.1107/S0108270198011135","","","0.7107","MoKα","","0.0294","0.0289","","0.079","0.078","","","","1.207","1.201","1.201","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008060","9.486","0.001","21.276","0.004","25.266","0.004","90","","94.92","0.01","90","","5080.5","1.4","213","1","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H38 Cl2 O11 P2 Ru3 -","- C50 H38 Cl2 O11 P2 Ru3 -","- C200 H152 Cl8 O44 P8 Ru12 -","4","1","DA1022","Liu, Jianping; Boyd, Edwin P.; Shore, Sheldon G.","The [Ru~3~(CO)~11~]^2-^ dianion","Acta Crystallographica Section C","1999","55","1","29","30","10.1107/S010827019800883X","","","0.71073","MoKα","","0.055","0.033","","0.139","","0.084","","","","","","1.049","","","","has coordinates,has Fobs","278322","2022-10-03","12:14:44",""
"2008061","7.826","0.002","17.069","0.003","11.578","0.002","90","","93.09","0.03","90","","1544.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(triethanolamine)strontium(II) bis(2,4-dinitrophenolate)","","- C24 H36 N6 O16 Sr -","- C24 H36 N6 O16 Sr -","- C48 H72 N12 O32 Sr2 -","2","0.5","DE1079","Poonia, Narinder Singh; Chhabra, Neera; Sheldrick, W. S.; Hundal, Geeta; Obrai, Sangeeta; Hundal, Maninder Singh","Bis(triethanolamine)strontium(II) bis(2,4-dinitrophenolate)","Acta Crystallographica Section C","1999","55","1","24","26","10.1107/S0108270198010075","","","0.71073","MoKα","","0.136","0.078","","0.279","0.191","","","","1.077","1.109","1.109","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008062","8.736","0.002","9.655","0.002","18.773","0.004","99.79","0.03","95.9","0.03","102.93","0.03","1504.4","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2,5,8,11,14-pentaoxapentadecanecalcium(II) (2,4,6-trinitrophenolate)","","- C22 H26 Ca N6 O19 -","- C22 H26 Ca N6 O19 -","- C44 H52 Ca2 N12 O38 -","2","1","DE1081","Poonia, Narinder Singh; Hundal,Geeta; Obrai, Sangeeta; Hundal, Maninder Singh","(2,5,8,11,14-Pentaoxapentadecane-κ^5^<i>O</i>)bis(2,4,6-trinitrophenolato-<i>O</i>^1^,<i>O</i>^2^)calcium(II)","Acta Crystallographica Section C","1999","55","1","26","28","10.1107/S0108270198005721","","","0.71073","MoKα","","0.1","0.061","","0.187","0.152","","","","1.047","1.129","1.129","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008063","11.834","0.002","12.159","0.004","12.438","0.004","90","","112.77","0.02","90","","1650.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(2,2'-biphenoxy)(cyclohexylamino)phosphate","2,2'-Biphenyl (Cyclohexylamino)phosphonate","","- C18 H20 N O3 P -","- C18 H20 N O3 P -","- C72 H80 N4 O12 P4 -","4","1","DE1092","Muthaiah, C.; Kumara Swamy, K. C.","2,2'-Biphenyl (cyclohexylamino)phosphonate: a hydrogen-bonded dimer","Acta Crystallographica Section C","1999","55","1","110","112","10.1107/S0108270198010087","","","0.71073","MoKα","","0.064","0.044","","","","0.148","","","","","","1.08","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008064","12.0436","0.0009","9.187","0.0005","18.7995","0.001","90","","93.128","0.008","90","","2077","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,1'-Diiodo-3,3'-bis(trimethylsilyl)ferrocene","","- C16 H24 Fe I2 Si2 -","- C16 H24 Fe I2 Si2 -","- C64 H96 Fe4 I8 Si8 -","4","1","FG1467","Foucher, Daniel A.; Lough, Alan J.; Park, Peter","1,1'-Diiodo-3,3'-bis(trimethylsilyl)ferrocene","Acta Crystallographica Section C","1999","55","1","33","35","10.1107/S0108270198009792","","","0.71073","MoKα","","0.056","0.038","","0.098","0.092","","","","0.922","1.021","1.021","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2008065","6.29","0.002","7.04","0.003","27.479","0.004","90","","100.83","0.03","90","","1195.1","0.7","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H26 Mn O12 S2 -","- C16 H26 Mn O12 S2 -","- C32 H52 Mn2 O24 S4 -","2","0.5","FG1487","Melvin A. Leonard; Philip J. Squattrito; Surendra N. Dubey","Hexaaquametal(II) 4-styrenesulfonates of manganese, cobalt and nickel","Acta Crystallographica Section C","1999","55","1","35","39","10.1107/S0108270198010105","","","0.7107","MoKα","","","0.083","","","0.091","","","","","","","1.48","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008066","6.298","0.002","6.987","0.003","27.309","0.004","90","","100.86","0.04","90","","1180.2","0.7","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H26 Co O12 S2 -","- C16 H26 Co O12 S2 -","- C32 H52 Co2 O24 S4 -","2","0.5","FG1487","Melvin A. Leonard; Philip J. Squattrito; Surendra N. Dubey","Hexaaquametal(II) 4-styrenesulfonates of manganese, cobalt and nickel","Acta Crystallographica Section C","1999","55","1","35","39","10.1107/S0108270198010105","","","0.7107","MoKα","","","0.068","","","0.088","","","","","","","1.93","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008067","6.292","0.002","6.934","0.005","27.315","0.005","90","","100.68","0.04","90","","1171.1","1","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H26 Ni O12 S2 -","- C16 H26 Ni O12 S2 -","- C32 H52 Ni2 O24 S4 -","2","0.5","FG1487","Melvin A. Leonard; Philip J. Squattrito; Surendra N. Dubey","Hexaaquametal(II) 4-styrenesulfonates of manganese, cobalt and nickel","Acta Crystallographica Section C","1999","55","1","35","39","10.1107/S0108270198010105","","","0.7107","MoKα","","","0.081","","","0.104","","","","","","","2.27","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008068","11.9156","0.0012","12.7033","0.0019","11.9651","0.0017","90","","100.415","0.01","90","","1781.3","0.4","293","1","293","1","","","","","","","","4","P 1 21 1","P 2yb","4","Pseudaconitine","[1α,6α,14α(E),16β]-20-Ethyl-1,6,16-trimethoxy-4-methoxymethyl-3,13- dihydroxyaconitane-8,14-diyl 8-acetate 14-(3',4'-dimethoxybenzoate)","","- C36 H51 N O12 -","- C36 H51 N O12 -","- C72 H102 N2 O24 -","2","1","FG1489","Parvez, Masood; Gul, Waseem; Atta-ur-Rahman; Choudhary, M. Iqbal; Nasreen, Amber; Fatima, Nuzhat","Pseudaconitine","Acta Crystallographica Section C","1999","55","1","72","74","10.1107/S0108270198010129","","","1.54178","CuKα","","0.069","0.057","","","","0.161","","","","","","1.044","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008069","10.8326","0.0007","14.3281","0.0015","10.976","0.003","90","","107.026","0.011","90","","1628.9","0.5","293","1","293","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Gliclazide","N-[(perhydrocyclopenta[c]pyrrol-2-yl)aminocarbonyl]-p-toluenesulfonamide","","- C15 H21 N3 O3 S -","- C15 H21 N3 O3 S -","- C60 H84 N12 O12 S4 -","4","1","FG1499","Parvez, Masood; Arayne, M. Saeed; Zaman, M. Kamran; Sultana, Najma","Gliclazide","Acta Crystallographica Section C","1999","55","1","74","75","10.1107/S0108270198009883","","","1.54178","CuKα","","0.066","0.053","","","","0.149","","","","","","1.019","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008070","15.593","0.003","15.596","0.009","20.041","0.006","90","","95.12","0.02","90","","4854","3","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","25,27-dihydroxyethoxy-26,28-dipropoxy-tert-butyl-calix[4]arene","","- C54 H76 O6 -","- C54 H76 O6 -","- C216 H304 O24 -","4","1","FG1502","Nissinen, Maija; Parzuchowski, Pawel; Böhmer, Volker; Rokicki, Gabriel; Rissanen, Kari","25,27-Dihydroxyethoxy-26,28-dipropoxy-<i>tert</i>-butylcalix[4]arene","Acta Crystallographica Section C","1999","55","1","104","106","10.1107/S0108270198010221","","","0.71073","MoKα","","0.075","0.047","","","","0.14","","","","","","1.093","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008071","32.802","0.003","9.267","0.002","11.756","0.002","90","","108.93","0.01","90","","3380.3","1","293","1","293","1","","","","","","","","4","C 1 2 1","C 2y","5","indaconitine","","","- C35 H48.5 N1.5 O10 -","- C35 H48.5 N1.5 O10 -","- C140 H194 N6 O40 -","4","1","FG1503","Parvez, Masood; Gul, Waseem; Anwar, Saeed; Miana, Ghulam A.; Atta-ur-Rahman; Choudhary, M. Iqbal","Indaconitine 0.5-acetonitrile solvate","Acta Crystallographica Section C","1999","55","1","70","72","10.1107/S0108270198010130","","","1.54178","CuKα","","0.074","0.067","","0.188","0.179","","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2008072","7.1459","0.001","7.5905","0.0009","8.8515","0.0008","82.682","0.009","77.437","0.009","68.864","0.01","436.46","0.09","296","","296","","","","","","","","","4","P -1","-P 1","2","(1R*,7aS*)-hexahydro-7-carboxymethyl-3H-pyrrolizidin-3-one","1-(5-Oxo-2,3,5,6,7,7a-hexahydro-1H-pyrrolizinyl)acetic acid","","- C9 H13 N O3 -","- C9 H13 N O3 -","- C18 H26 N2 O6 -","2","1","FG1513","Gerkin, Roger E.","Hydrogen bonding in [(1<i>R</i>*,7a<i>S</i>*)-hexahydro-5-oxo-1<i>H</i>-pyrrolizinyl-1-yl]acetic acid","Acta Crystallographica Section C","1999","55","1","84","87","10.1107/S0108270198010099","","","0.71073","MoKα","","","0.04","","","0.095","","","","","1.97","1.97","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008073","8.4254","0.0004","17.2278","0.0006","10.9291","0.0003","90","","96.164","0.002","90","","1577.2","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-benzoyl-1-ethyl-4-phenylpyrimidine-2-one","","- C19 H16 N2 O2 -","- C19 H16 N2 O2 -","- C76 H64 N8 O8 -","4","1","FR1134","Sema Öztürk; Mehmet Akkurt; İbrahim Abdul Razak; Hoong-Kun Fun; İsmail Yıldırım","5-Benzoyl-1-ethyl-4-phenyl-1<i>H</i>-pyrimidin-2-one","Acta Crystallographica Section C","1999","55","1","97","99","10.1107/S0108270198009822","","","0.71073","MoKα","","0.1788","0.0677","","0.121","0.0905","","","","1.009","1.204","1.204","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008074","7.864","0.002","6.964","0.002","24.361","0.006","90","","97.74","0.02","90","","1322","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Trans-Dicarbonyl(2,3,5,6-tetrafluorophenyl)bromo((5-cyclopentadienyl)rhenium (III)","","- C13 H6 Br F4 O2 Re -","- C13 H6 Br F4 O2 Re -","- C52 H24 Br4 F16 O8 Re4 -","4","1","FR1143","María Teresa Garland; Ricardo F. Baggio; A. Hugo Klahn; Beatriz Oëlckers","<i>trans</i>-Bromodicarbonyl(η^5^-cyclopentadienyl)(2,3,5,6-tetrafluorophenyl)rhenium(III)","Acta Crystallographica Section C","1999","55","1","61","62","10.1107/S0108270198011494","","","0.71073","MoKα","","0.049","0.034","","","","0.088","","","","","","1.011","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008075","21.479","0.004","10.569","0.002","16.807","0.003","90","","90","","90","","3815.4","1.2","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Trans-carbonylchlorobis(tri-p-tolylphosphine)rhodium(I)","","- C43 H42 Cl O P2 Rh -","- C43 H42 Cl O P2 Rh -","- C172 H168 Cl4 O4 P8 Rh4 -","4","1","GD1000","Otto, Stefanus; Mzamane, Sibusisiwe N.; Roodt, Andreas","<i>trans</i>-Carbonylchlorobis(tri-<i>p</i>-tolylphosphine)rhodium(I)","Acta Crystallographica Section C","1999","55","1","67","69","10.1107/S0108270198011603","","","0.71073","MoKα","","0.0416","0.0314","","","","0.0646","","","","","","1.163","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008076","8.2898","0.0002","9.752","0.0001","11.2391","0.0003","112.131","0.001","96.654","0.001","104.437","0.001","792.47","0.03","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","2,4,6-Triethyl-1,3,5-benzenetriacetonitrile","","- C18 H21 N3 -","- C18 H21 N3 -","- C36 H42 N6 -","2","1","GD1001","Walsdorff, Christian; Park, Ki-Min; Oh, Jinho; Kim, Kimoon","1,3,5-Tris(cyanomethyl)-2,4,6-triethylbenzene","Acta Crystallographica Section C","1999","55","1","108","110","10.1107/S0108270198011615","","","0.71073","MoKα","","0.0589","0.0505","","","","0.1464","","","","","","1.072","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008077","10.2979","0.0008","13.1101","0.0011","16.7038","0.0013","78.0476","0.0006","71.3989","0.0006","79.6493","0.0007","2075.2","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H58 N2 O4 -","- C22 H29 N O2 -","- C88 H116 N4 O8 -","4","2","GS1017","Elerman, Yalc̨in; Elmali, Ayhan; Kendi̇, Engin; Özbey, Süheyla","4-(2,5-Di-<i>tert</i>-butylphenylnitrilomethylidyne)-2-methoxyphenol","Acta Crystallographica Section C","1999","55","1","116","119","10.1107/S0108270198011573","","","0.71069","MoKα","","0.0833","0.0613","","0.162","0.133","","","","0.962","1.014","1.014","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008078","12.676","0.002","5.341","0.001","19.493","0.002","90","","107.42","0.01","90","","1259.2","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,3-bis(3-nitrophenyl)-1-triazene","1,3-bis(3-nitrophenyl)-1-triazene","","- C12 H9 N5 O4 -","- C12 H9 N5 O4 -","- C48 H36 N20 O16 -","4","1","HA1224","Zhang, De-Chun; Fei, Zheng-Hao; Zhang, Tian-Zhu; Zhang, Yan-Qiu; Yu, Kai-Bei","1,3-Bis(3-nitrophenyl)triazene","Acta Crystallographica Section C","1999","55","1","102","104","10.1107/S0108270198010415","","","0.71073","MoKα","","0.0658","0.0381","","0.1184","0.0923","","","","0.901","1.067","1.067","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008079","57.344","0.002","9.7802","0.0004","10.6263","0.0005","90","","90","","90","","5959.6","0.4","293","2","293","2","","","","","","","","3","F d d 2","F 2 -2d","43","","4-Methyl-7,7a,13a,14-tetrahydrobenzo[1,4]dioxino[2,3;6,7]naphtho[1,2-b] pyran-2-one.","","- C20 H16 O4 -","- C20 H16 O4 -","- C320 H256 O64 -","16","1","HA1226","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan; Ibrahim Abdul Razak","4-Methyl-7,7a,13a,14-tetrahydrobenzo[<i>e</i>]pyrano[2',3':5,6]naphtho[2,3-<i>b</i>][1,4]dioxin-2-one","Acta Crystallographica Section C","1999","55","1","91","92","10.1107/S0108270198010427","","","0.71073","MoKα","","0.1142","0.0653","","0.1547","0.1317","","","","1.042","1.134","1.134","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008080","8.0204","0.0003","27.1881","0.0011","8.942","0.0004","90","","106.332","0.001","90","","1871.21","0.13","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(3,5-dimethylpyrazole-N^2^)bis(thiocyanato-N)cobalt(II) monohydrate","","- C12 H18 Co N6 O S2 -","- C12 H18 Co N6 O S2 -","- C48 H72 Co4 N24 O4 S8 -","4","1","HA1228","Xiao-Feng Chen; Shu-Hua Liu; Xiao-Zeng You; Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak","Bis(3,5-dimethylpyrazole-<i>N</i>^2^)bis(thiocyanato-<i>N</i>)cobalt(II) monohydrate","Acta Crystallographica Section C","1999","55","1","22","24","10.1107/S0108270198010142","","","0.71073","MoKα","","0.064","0.059","","0.135","0.132","","","","1.264","1.304","1.304","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008081","13.0323","0.0003","23.9443","0.0001","3.7927","0.0001","90","","90","","90","","1183.51","0.04","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","2-Aminopyrimidine-Terephthalic acid (1:1) complex","","- C12 H11 N3 O4 -","- C12 H11 N3 O4 -","- C48 H44 N12 O16 -","4","0.5","HA1229","Shyamaprosad Goswami; Ajit Kumar Mahapatra; Kumaresh Ghosh; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun","2-Aminopyrimidine‒terephthalic acid (1:1) complex","Acta Crystallographica Section C","1999","55","1","87","89","10.1107/S0108270198010749","","","0.71073","MoKα","","0.0532","0.0384","","0.1055","0.0939","","","","1.073","1.098","1.098","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008082","5.3172","0.0001","15.3099","0.0003","15.3406","0.0001","90","","91.846","0.001","90","","1248.17","0.03","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-5-methyl-3-(morpholinomethyl)benzaldehyde","","- C13 H17 N O3 -","- C13 H17 N O3 -","- C52 H68 N4 O12 -","4","1","HA1231","S.Shanmuga Sundara Raj; R.Thirumurugan; G.Shanmugam; Hoong-Kun Fun; J.Manonmani; M.Kandaswamy","2-Hydroxy-5-methyl-3-(morpholinomethyl)benzaldehyde, (I), and 4,4'-dimethyl-6,6'-bis(morpholinomethyl)-2,2'-(ethylenedinitrilodimethylidyne)diphenol, (II)","Acta Crystallographica Section C","1999","55","1","94","97","10.1107/S0108270198010750","","","0.71073","MoKα","","0.0667","0.049","","0.1487","0.1355","","","","1.07","1.143","1.143","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008083","11.1356","0.0005","9.5825","0.0005","12.4721","0.0006","90","","98.828","0.002","90","","1315.09","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4'-Dimethyl-6,6'-bis(morpholinomethyl)-2,2'-ethylene dinitrilodimethylidyne)diphenol","","- C28 H38 N4 O4 -","- C28 H38 N4 O4 -","- C56 H76 N8 O8 -","2","0.5","HA1231","S.Shanmuga Sundara Raj; R.Thirumurugan; G.Shanmugam; Hoong-Kun Fun; J.Manonmani; M.Kandaswamy","2-Hydroxy-5-methyl-3-(morpholinomethyl)benzaldehyde, (I), and 4,4'-dimethyl-6,6'-bis(morpholinomethyl)-2,2'-(ethylenedinitrilodimethylidyne)diphenol, (II)","Acta Crystallographica Section C","1999","55","1","94","97","10.1107/S0108270198010750","","","0.71073","MoKα","","0.1268","0.0646","","0.1749","0.1392","","","","1.037","1.135","1.135","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008084","7.797","0.0006","9.4921","0.0007","9.7074","0.0007","89.506","0.002","74.124","0.002","79.242","0.002","678.21","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","o-Chlorobenzaldehyde Nicotinoylhydrazone Dihydrate","","- C13 H14 Cl N3 O3 -","- C13 H14 Cl N3 O3 -","- C26 H28 Cl2 N6 O6 -","2","1","HA1232","Zhong-lin Lu; Bei-sheng Kang; Hoong-Kun Fun; Ibrahim Abdul Razak; Kandasamy Chinnakali","<i>o</i>-Chlorobenzaldehyde nicotinoylhydrazone dihydrate","Acta Crystallographica Section C","1999","55","1","89","91","10.1107/S010827019801138X","","","0.71073","MoKα","","0.0798","0.0535","","","","0.1506","","","","","","1.043","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008085","9.3876","0.0001","12.4039","0.0002","12.755","0.0003","104.807","0.001","99.431","0.001","110.927","0.001","1286.54","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1,2-bis(4-tert-butyl-pyridine-2-carboxamido)-4,5-dichlorobenzene","","- C26 H28 Cl2 N4 O2 -","- C26 H28 Cl2 N4 O2 -","- C52 H56 Cl4 N8 O4 -","2","1","HA1233","Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak; Zhen Shen; Jing-Lin Zuo; Xiao-Zeng You","<i>N</i>,<i>N</i>'-(4,5-Dichloro-<i>o</i>-phenylene)bis(4-<i>tert</i>-butylpyridine-2-carboxamide)","Acta Crystallographica Section C","1999","55","1","99","100","10.1107/S0108270198011445","","","0.71073","MoKα","","0.129","0.075","","","","0.176","","","","","","1.074","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008086","13.3256","0.0005","6.9775","0.0003","13.9402","0.0006","90","","113.881","0.002","90","","1185.19","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Methyl-4-amino-5-mercapto-1,2,4-triazole derivative of p-nitro phenylaldehyde","","- C10 H9 N5 O2 S -","- C10 H9 N5 O2 S -","- C40 H36 N20 O8 S4 -","4","1","HA1234","Yuan-Fang Liu; Suchada Chantrapromma; S. Shanmuga Sundara Raj; Hoong-Kun Fun; Yin-Han Zhang; Fu-Xin Xie; Yu-Peng Tian; Shi-Sheng Ni","4-Amino-3-methyl-1,2,4-triazole-5-thione derivative of <i>p</i>-nitrophenylaldehyde","Acta Crystallographica Section C","1999","55","1","93","94","10.1107/S0108270198010762","","","0.71073","MoKα","","0.1853","0.0773","","0.1687","0.1301","","","","1.036","1.23","1.23","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008087","17.174","0.003","8.9483","0.0016","22.132","0.004","90","","99.313","0.013","90","","3356.4","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","octacarbonyl-1κ^3^C,2κ^3^C,3κ^2^C-bis(μ~3~-3,3-diphenylallenylidene -1:2κ^2^C^1^:3(1,2-η^2^))-triangulo-triiron(0)(3 Fe‒Fe)","","- C38 H20 Fe3 O8 -","- C38 H20 Fe3 O8 -","- C152 H80 Fe12 O32 -","4","1","JZ1302","Zachara, Janusz; Zimniak, Andrzej","A new polymorph of a carbonyliron complex from tetraphenylhexapentaene: bis(μ~3~,η^2^,σ^2^-diphenylallenylidene)octacarbonyltriiron","Acta Crystallographica Section C","1999","55","1","58","60","10.1107/S010827019801107X","","","0.71073","MoKα","","0.037","0.029","","0.074","0.071","0.074","","","1.033","","","1.033","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008088","10.2987","0.0008","10.1307","0.0006","11.1151","0.0008","90","","115.338","0.007","90","","1048.11","0.14","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,3,-Diamino-5-ammonio-1,3,5-trideoxy-cis-inositol iodide","","- C6 H16 I N3 O3 -","- C6 H16 I N3 O3 -","- C24 H64 I4 N12 O12 -","4","1","JZ1311","Guido J. Reiß; Kaspar Hegetschweiler; Jürgen Sander","1,3-Diamino-5-ammonio-1,3,5-trideoxy-<i>cis</i>-inositol iodide","Acta Crystallographica Section C","1999","55","1","123","126","10.1107/S0108270198009974","","","0.71073","MoKα","","0.027","0.025","","","","0.058","","","","","","1.079","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2008089","15.0798","0.0016","7.5653","0.0005","12.6522","0.0014","90","","114.212","0.011","90","","1316.4","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Polymeric aqua(N-ethylurea-O)(N-pyruvidene-β-alaninato-O,N,O')copper(II)","","- C9 H17 Cu N3 O6 -","- C9 H17 Cu N3 O6 -","- C36 H68 Cu4 N12 O24 -","4","1","JZ1313","Warda, Salam A.","Polymeric aqua(<i>N</i>-ethylurea-<i>O</i>)(<i>N</i>-pyruvidene-β-alaninato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1999","55","1","52","54","10.1107/S0108270198010166","","","0.71073","MoKα","","","0.029","","","","0.059","","","","","","0.903","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008090","8.0916","0.0009","8.0916","0.0009","30.078","0.004","90","","90","","90","","1969.3","0.4","293","2","","","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","2-(2-Pyrrolyl)-benzothiazole","","- C11 H8 N2 S -","- C11 H8 N2 S -","- C88 H64 N16 S8 -","8","1","KA1289","Davidović, Naka; Matković-Čalogović, Dubravka; Popović, Zora; Fišer-Jakić, Lelja","2-(2-Pyrrolyl)-1,3-benzothiazole","Acta Crystallographica Section C","1999","55","1","119","120","10.1107/S0108270198011731","","","0.71073","MoKα","","0.2326","0.0552","","","","0.0865","","","","","","0.899","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008091","21.331","0.004","12.203","0.002","20.881","0.004","90","","92.26","0.03","90","","5431.1","1.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","(FN2O4)2","35,44-difluoro-6,9,23,26,38,41,47,50-octaoxa-3,12,20,29-tetraaza- pentacyclo[29.8(3,12)8(20,29)3(1,31)1(1,31)1(14,18)]dopentaconta -14,16,18(44),31,33,1(35)-hexene","","- C42 H62 Cs2 F8 N4 O14 S2 -","- C42 H62 Cs2 F8 N4 O14 S2 -","- C168 H248 Cs8 F32 N16 O56 S8 -","4","0.5","KA1299","Plenio, Herbert; Hermann, Jorg","A cylindrical macrocycle with two caesium cations sandwiched between two diaza-18-crown-6 macrocycles","Acta Crystallographica Section C","1999","55","1","62","64","10.1107/S0108270198011755","","","0.71069","MoKα","","0.0588","0.0365","","","","0.107","","","","","","1.046","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008092","7.3502","0.0013","12.0783","0.0015","12.476","0.007","80.28","0.03","79.53","0.03","72.713","0.013","1032.1","0.6","293","","","","","","","","","","","6","P -1","-P 1","2","","Chloro-(N,N'-bis(2-methylpyridyl)-1,5-diazacyclooctane) nickel(II) perchlorate","","- C18 H24 Cl2 N4 Ni O4 -","- C18 H24 Cl2 N4 Ni O4 -","- C36 H48 Cl4 N8 Ni2 O8 -","2","1","LN1060","Bu, Xian-He; Fang, Ya-Yin; Shang, Zhi-Liang; Zhang, Ruo-Hua; Zhu, Hong-Ping; Liu, Qiu-Tian","[1,5-Bis(2-pyridylmethyl-<i>N</i>)-1,5-diazacyclooctane-<i>N</i>,<i>N</i>']chloronickel(II) perchlorate","Acta Crystallographica Section C","1999","55","1","39","41","10.1107/S0108270198010841","","","0.71073","MoKα","","","0.0481","","","0.0609","","","","","","","1.21","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008093","7.532","0.005","13.278","0.002","23.7103","0.001","90","","90","","90","","2371.3","1.6","122","0.5","122","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-(2-nitrophenyl)-4-phenylbutadiyne","","- C16 H9 N O2 -","- C16 H9 N O2 -","- C128 H72 N8 O16 -","8","1","LN1068","Hanne Skov Bengaard; Sine Larsen; Henning Osholm Sørensen; Kathryn J. Robinson; John D. Wallis","Interaction between an oxygen and an alkynyl-carbon atom in 1-(2-nitrophenyl)-4-phenylbutadiyne","Acta Crystallographica Section C","1999","55","1","106","108","10.1107/S0108270198010853","","","1.5418","CuKα","","0.0385","0.0364","","0.0888","0.0885","","","","3.456","3.572","3.572","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008094","8.956","0.002","11.76","0.003","8.781","0.002","103.2","0.03","108.6","0.04","91.4","0.03","848.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-Methylpiperazinium Trichloro(N-methylpiperazine-N^1^)cobaltate(II)","","- C10 H25 Cl3 Co N4 -","- C10 H25 Cl3 Co N4 -","- C20 H50 Cl6 Co2 N8 -","2","1","NA1379","Marzotto, Armando; Clemente, Dore Augusto; Valle, Giovanni","Cobalt(II) complexes of piperazine and derivatives: 1-methylpiperazin-4-ium trichloro(1-methylpiperazine-<i>N</i>^4^)cobaltate(II)","Acta Crystallographica Section C","1999","55","1","43","46","10.1107/S0108270198009603","","","0.7107","MoKα","","0.055","0.033","","0.097","0.086","","","","1.073","1.097","1.097","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008095","12.406","0.002","14.313","0.002","15.299","0.002","90","","90","","90","","2716.6","0.7","300","","","","","","","","","","","4","C 2 2 21","C 2c 2","20","(R)-1,1'-binaphthyl-2,2'-diol-(R,R)-1,2-cyclohexanediamine-toluene (1/1/1)","","","- C33 H36 N2 O2 -","- C33 H44 N2 O2 -","- C132 H176 N8 O8 -","4","0.5","OA1035","Fukushima, Shigeru; Hosomi, Hiroyuki; Ohba, Shigeru; Kawashima, Masatoshi","Diastereomeric complexes of 1,1'-binaphthyl-2,2'-diol and (<i>R</i>,<i>R</i>)-1,2-cyclohexanediamine","Acta Crystallographica Section C","1999","55","1","120","123","10.1107/S010827019800105X","","","0.71073","MoKα","","","0.076","","","","0.086","","","","","","1.41","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008096","8.056","0.001","13.552","0.001","10.822","0.001","90","","111.53","0.01","90","","1099.1","0.2","300","","","","","","","","","","","4","P 1 21 1","P 2yb","4","(S)-2,2'-dihydroxy-1,1'-binaphthyl (R,R)-1,2-cyclohexanediamine","","","- C26 H28 N2 O2 -","- C26 H28 N2 O2 -","- C52 H56 N4 O4 -","2","1","OA1035","Fukushima, Shigeru; Hosomi, Hiroyuki; Ohba, Shigeru; Kawashima, Masatoshi","Diastereomeric complexes of 1,1'-binaphthyl-2,2'-diol and (<i>R</i>,<i>R</i>)-1,2-cyclohexanediamine","Acta Crystallographica Section C","1999","55","1","120","123","10.1107/S010827019800105X","","","0.71073","MoKα","","","0.056","","","","0.065","","","","","","1","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008097","12.146","0.003","12.682","0.006","10.842","0.008","115.26","0.04","93.17","0.04","86.49","0.03","1506.7","1.5","295","","295","","","","","","","","","6","P 1","P 1","1","","","","- C27 H37 N3 O4 S3 Zn -","- C27 H37 N3 O4 S3 Zn -","- C54 H74 N6 O8 S6 Zn2 -","2","2","OA1049","Nakai, Hiroshi; Kobayashi, Shinobu; Ozaki, Mamoru; Hayase, Yoshio; Takeda, Reiji","Micacocidin A","Acta Crystallographica Section C","1999","55","1","54","56","10.1107/S0108270198010920","","","0.7107","MoKα","","0.055","0.055","","","","0.065","","","","","","1","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008098","15.146","0.006","10.936","0.004","4.328","0.001","90","","97.5","0.02","90","","710.7","0.4","296","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C7 H6 N4 -","- C7 H6 N4 -","- C28 H24 N16 -","4","1","OA1063","Takehiro Matsunaga; Yoshio Ohno; Yoshiaki Akutsu; Mitsuru Arai; Masamitsu Tamura; Mitsuaki Iida","1-Phenyltetrazole","Acta Crystallographica Section C","1999","55","1","129","131","10.1107/S0108270198009718","","","0.71073","MoKα","","","0.053","","","","0.041","","","","","","1.406","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008099","19.87","0.007","4.731","0.007","14.813","0.007","90","","121.98","0.04","90","","1181","2","296.2","","296.2","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","β phthalocyanine","","- C32 H18 N8 -","- C32 H18 N8 -","- C64 H36 N16 -","2","0.5","OA1066","Shinya Matsumoto; Keiji Matsuhama; Jin Mizuguchi","β Metal-free phthalocyanine","Acta Crystallographica Section C","1999","55","1","131","133","10.1107/S0108270198011020","","","0.7107","MoKα","","0.1018","0.0552","","0.0688","0.0592","","","","1.124","1.182","1.182","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008100","4.1662","0.0003","4.1662","0.0003","8.2085","0.0007","90","","90","","90","","142.477","0.019","293","2","293","2","","","","","","","","4","P 4/m m m","-P 4 2","123","","","","- Ba Nb3.47 O6 Ti0.53 -","- Ba Nb3.466 O6 Ti0.534 -","- Ba Nb3.466 O6 Ti0.534 -","1","0.0625","OS1024","Svensson, Gunnar; Eriksson, Lars","BaNb~4-<i>x~</i>Ti~<i>x~</i>O~6~ (<i>x</i> = 0.53)","Acta Crystallographica Section C","1999","55","1","17","19","10.1107/S0108270198010932","","","0.71073","MoKα","","0.021","0.016","","0.028","","0.027","","","1.128","","","1.185","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008101","8.2535","0.0001","9.2084","0.0001","5.161","0.0001","90","","90","","90","","392.244","0.01","293","","293","","","","","","","","","4","I m m 2","I 2 -2","44","","","","- Ba Ca Ga4 O8 -","- Ba Ca Ga4 O8 -","- Ba2 Ca2 Ga8 O16 -","2","0.25","OS1030","Shun-ich Kubota; Hisanori Yamane; Masahiko Shimada","A powder diffraction study of BaCaGa~4~O~8~","Acta Crystallographica Section C","1999","55","1","14","17","10.1107/S0108270198010178","","","1.54056","CuKα","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008102","27.447","0.009","20.311","0.006","18.718","0.005","90","","90","","90","","10435","5","193","2","193","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","aquatetrakis[(4-chlorobenzoato)-μ~3~-(2-dimethylaminoethanolato)- copper(II)] hydrate","","- C44 H60 Cl4 Cu4 N4 O14 -","- C44 H60 Cl4 Cu4 N4 O14 -","- C352 H480 Cl32 Cu32 N32 O112 -","8","1","OS1032","Turpeinen, Urho; Hämälänen, Reijo; Mutikainen, Ilpo","Aquatetrakis[(4-chlorobenzoato)(μ~3~-2-dimethylaminoethanolato)copper(II)] hydrate","Acta Crystallographica Section C","1999","55","1","50","52","10.1107/S0108270198011457","","","0.71073","MoKα","","0.114","0.075","","","0.133","0.147","","","","","","1.031","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008103","12.3698","0.0005","12.3698","0.0005","49.306","0.003","90","","90","","90","","7544.4","0.6","100","2","100","2","","","","","","","","6","P 41","P 4w","76","Ru-bis(terpyridine)(PF~6~)~2~","Bis(2,2',6':2''-terpyridine)Ru(II)(PF~6~)~2~ acetonitrile solvate","","- C34 H28 F12 N8 P2 Ru -","- C34 H28 F12 N8 P2 Ru -","- C272 H224 F96 N64 P16 Ru8 -","8","2","OS1037","Kianosh Lashgari; Mikael Kritikos; Rolf Norrestam; Thomas Norrby","Bis(terpyridine)ruthenium(II) bis(hexafluorophosphate) diacetonitrile solvate","Acta Crystallographica Section C","1999","55","1","64","67","10.1107/S0108270198011378","","","0.71073","MoKα","","0.0579","0.0543","","","","0.1481","","","","","","1.064","","","","has coordinates,has disorder","191016","2020-10-21","18:00:00",""
"2008104","10.794","0.003","5.054","0.002","27.143","0.01","90","","90.26","0.05","90","","1480.7","0.9","193","2","193","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(2SR,5RR,6RR,9SR)-1,2,5,6,9,10-hexachlorodecane","","- C10 H16 Cl6 -","- C10 H16 Cl6 -","- C40 H64 Cl24 -","4","0.5","QA0048","Frenzen, Gerlinde; Sippel, Heike; Coelhan, Mehmet","The relative configuration of a stereoisomer of 1,2,5,6,9,10-hexachlorodecane","Acta Crystallographica Section C","1999","55","1","IUC9800079","","10.1107/S0108270199099965","","","0.71073","MoKα","","0.068","0.051","","","","0.146","","","","","","1.062","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008105","7.0459","0.0014","9.3399","0.0014","12.913","0.003","90","","92.72","0.02","90","","848.8","0.3","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","m-Azidobenzensulfonyl chloride","","- C6 H4 Cl N3 O2 S -","- C6 H4 Cl N3 O2 S -","- C24 H16 Cl4 N12 O8 S4 -","4","1","QA0068","Ziemer, Burkhard; Sauer, Erika","<i>m</i>-Azidobenzenesulfonyl chloride","Acta Crystallographica Section C","1999","55","1","IUC9800074","","10.1107/S0108270199099953","","","0.71073","MoKα","","0.037","0.032","","0.094","0.086","","","","1.037","1.079","1.079","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008106","11.329","0.003","6.6648","0.0016","12.995","0.003","90","","112.821","0.016","90","","904.4","0.4","120","2","120","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","6,7-Dimethyltricyclo[3.2.2.0]non-6-ene","","- C11 H16 -","- C11 H16 -","- C44 H64 -","4","1","QA0072","Boese, Roland; Roth, Wolfgang R.; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","6,7-Dimethyltricyclo[3.2.2.0]non-6-ene at 120 K, a [3.2.2]propellane derivative","Acta Crystallographica Section C","1999","55","1","IUC9800075","","10.1107/S0108270199099941","","","0.71073","MoKα","","0.0546","0.0467","","","","0.1347","","","","","","1.056","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008107","13.455","0.005","30.61","0.01","6.694","0.005","90","","90","","90","","2757","2","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R,2R,5S,7R,8R)-2,6,6,8-tetramethyl-8-hydroxy tricyclo[5.3.1^1,7^.0^1,5^]undecan-9-one","","- C30 H48 O4 -","- C30 H48 O4 -","- C120 H192 O16 -","4","1","QA0073","Ai, Hui; Song, Yi-Lin; Tao, Feng-Gang","8-Hydroxycedran-9-one","Acta Crystallographica Section C","1999","55","1","IUC9800080","","10.1107/S010827019909993X","","","0.7107","MoKα","","","0.056","","","0.057","","","","","1.73","1.73","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008108","8.649","0.002","9.679","0.002","15.721","0.002","90","","94.82","0.01","90","","1311.4","0.4","293.2","","293.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H4 O2 S5 -","- C12 H4 O2 S5 -","- C48 H16 O8 S20 -","4","1","QA0074","Ueda, Kazumasa; Iwamatsu, Masaki; Sugimoto, Toyonari","1,3,4,6-Tetrathiapentalene-5-spiro-2'-indan-2,1',3'-trione and its 2-thione analogue","Acta Crystallographica Section C","1999","55","1","IUC9800077","","10.1107/S0108270199099928","","","1.5418","CuKα","","0.041","0.041","","","","0.061","","","","","","1.272","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008109","7.946","0.004","10.2","0.003","15.638","0.003","90","","104.3","0.02","90","","1228.2","0.8","293.2","","293.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H4 O3 S4 -","- C12 H4 O3 S4 -","- C48 H16 O12 S16 -","4","1","QA0074","Ueda, Kazumasa; Iwamatsu, Masaki; Sugimoto, Toyonari","1,3,4,6-Tetrathiapentalene-5-spiro-2'-indan-2,1',3'-trione and its 2-thione analogue","Acta Crystallographica Section C","1999","55","1","IUC9800077","","10.1107/S0108270199099928","","","1.5418","CuKα","","0.039","0.039","","","","0.06","","","","","","1.312","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008110","11.15","0.002","9.028","0.002","25.637","0.005","90","","91.37","0.03","90","","2579.9","0.9","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","(ClN2O4)2 - 2AgCF3SO3","μ-[35,44-dichloro-6,9,23,26,38,41,47,50-octaoxa-3,12,20,29-tetraaza- pentacyclo[29.8^3,12^.8^20,29^.3^1,31^.1^1,31^.1^14,18^]dopentaconta -14,16,18(44),31,33,1(35)-hexene]disilver(I) bis(triflate)","","- C42 H62 Ag2 Cl2 F6 N4 O14 S2 -","- C42 H62 Ag2 Cl2 F6 N4 O14 S2 -","- C84 H124 Ag4 Cl4 F12 N8 O28 S4 -","2","0.5","QA0077","Plenio, Herbert; Diodone, Ralph","A cylindrical macrocycle with two diaza-18-crown-6 macrocycles encapsulating two silver cations","Acta Crystallographica Section C","1999","55","1","IUC9800081","","10.1107/S0108270199099990","","","0.71069","MoKα","","0.038","0.028","","","","0.072","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008111","12.2502","0.0016","6.5155","0.0011","12.415","0.002","90","","108.866","0.011","90","","937.7","0.3","120","2","120","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","Tricarbonyl(2,3,6,7-η)-(2,3-diylidenfurane)-iron(0)","","- C9 H6 Fe O4 -","- C9 H6 Fe O4 -","- C36 H24 Fe4 O16 -","4","1","QA0078","Boese, Roland; Roth, Wolfgang R.; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","Tricarbonyl[(2,3,6,7-η)-2,3-dimethylene-2,3-dihydrofuran]iron(0) at 120K","Acta Crystallographica Section C","1999","55","1","IUC9800082","","10.1107/S0108270199099989","","","0.71073","MoKα","","0.031","0.03","","","","0.081","","","","","","1.154","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008112","8.146","0.001","8.927","0.001","9.29","0.001","101.14","0.01","100.95","0.01","102.78","0.01","627.01","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-phenoxymethanesulfonanilide","","- C13 H13 N O3 S -","- C13 H13 N O3 S -","- C26 H26 N2 O6 S2 -","2","1","QB0069","Chandramohan, Kattamuri; Ravikumar, Krishnan","A nimesulide intermediate","Acta Crystallographica Section C","1999","55","1","IUC9800078","","10.1107/S0108270199099916","","","0.71073","MoKα","","0.051","0.04","","0.116","0.108","","","","1.036","1.06","1.06","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008113","15.193","0.002","15.193","0.002","17.273","0.003","90","","90","","90","","3987.1","1","100","","100","","","","","","","","","5","I -4 c 2","I -4 -2c","120","","Bis(μ-hydroxo)tris(trimethyltin) iodide","","- C9 H29 I O2 Sn3 -","- C9 H29 I O2 Sn3 -","- C72 H232 I8 O16 Sn24 -","8","0.5","QB0070","Saurage, Andrea S.; Billodeaux, Damon R.; Hammer, Robert P.; Fronczek, Frank R.","Di-μ-hydroxo-tris(trimethyltin) iodide at 100K","Acta Crystallographica Section C","1999","55","1","IUC9800076","","10.1107/S0108270199099977","","","0.71073","MoKα","","0.061","0.034","","","","0.072","","","","","","1.004","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008114","9.0306","0.001","6.6484","0.001","12.8","0.002","90","","96.88","0.01","90","","762.97","0.19","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Potassium bromoaurate","Potassium tetrabromoaurate III","","- Au Br4 K -","- Au Br4 K -","- Au4 Br16 K4 -","4","1","SK1203","Omrani, Hedi; Welter, Richard; Vangelisti, Rene","Potassium tetrabromoaurate(III)","Acta Crystallographica Section C","1999","55","1","13","14","10.1107/S010827019801110X","","","0.5608","AgKα","","0.09","0.042","","","","0.101","","","","","","1.032","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008115","14.936","0.001","14.936","0.001","9.913","0.001","90","","90","","120","","1915.2","0.3","293","","293","","","","","","","","","5","P -3","-P 3","147","","(1,4,7-Tris(3-tert-butyl-5-methyl-2-hydroxybenzyl)-1,4, 7-triazacyclononanato-N,N',N'',O,O',O'')chromium(III)","","- C42 H60 Cr N3 O3 -","- C42 H60 Cr N3 O3 -","- C84 H120 Cr2 N6 O6 -","2","0.333333","SK1214","Martin, Lisandra L.; Taylor, Max R.; Bei Wu","[1,4,7-Tris(3-<i>tert</i>-butyl-5-methyl-2-hydroxybenzyl)-1,4,7-triazacyclononanato-<i>N</i>,<i>N</i>',<i>N</i>'',<i>O</i>,<i>O</i>',<i>O</i>'']chromium(III)","Acta Crystallographica Section C","1999","55","1","41","43","10.1107/S0108270198010956","","","0.71073","MoKα","","0.074","0.062","","0.095","0.091","","","","1.237","1.247","1.247","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008116","9.202","0.001","18.87","0.003","19.138","0.002","90","","90","","90","","3323.2","0.7","298","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H19 N O2 S2 -","- C18 H19 N O2 S2 -","- C144 H152 N8 O16 S16 -","8","1","SK1227","Hökelek, Tuncer; Patır, Süleyman; Uludağ, Nesi̇mi̇","9-Acetonyl-3-ethylidene-1,2,3,4-tetrahydrospiro[carbazole-1,2'-[1,3]dithiolan]-4-one","Acta Crystallographica Section C","1999","55","1","114","116","10.1107/S0108270198011019","","","0.71073","MoKα","","","0.038","","","0.048","","","","","1.22","1.22","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008117","13.7343","0.0002","6.1274","0.0002","25.2459","0.0007","90","","92.277","0.001","90","","2122.91","0.1","203","2","203","2","","","","","","","","3","C 1 2 1","C 2y","5","Scalarolide","12β-hydroxyscalar-17-en-20,19-olide","","- C25 H38 O3 -","- C25 H38 O3 -","- C100 H152 O12 -","4","1","SX1072","Cambie, Richard C.; Rickard, Clifton E. F.; Rutledge, P. Stewart; Yang, Xiao-Shuang","Scalarolide and scalarin, sesterterpenes from Cacospongia and Ircinia sponges","Acta Crystallographica Section C","1999","55","1","112","114","10.1107/S0108270198011305","","","0.71073","MoKα","","0.1057","0.085","","","0.226","0.2453","","","","","","1.072","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008118","6.3833","0.0003","10.9108","0.0006","37.2967","0.0019","90","","90","","90","","2597.6","0.2","203","2","203","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Scalarin","12α-acetoxy-19α-hydroxyscalar-19,20-olide methanol solvate","","- C28 H44 O6 -","- C28 H44 O6 -","- C112 H176 O24 -","4","1","SX1072","Cambie, Richard C.; Rickard, Clifton E. F.; Rutledge, P. Stewart; Yang, Xiao-Shuang","Scalarolide and scalarin, sesterterpenes from Cacospongia and Ircinia sponges","Acta Crystallographica Section C","1999","55","1","112","114","10.1107/S0108270198011305","","","0.71073","MoKα","","0.0934","0.0565","","","","0.1346","","","","","","1.076","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008119","9.233","0.005","12.952","0.003","13.943","0.005","90","0.3","105.93","0.01","90","","1603.4","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-isobutyl-2,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-3-indoleacetic acid","","- C17 H25 N O3 -","- C17 H25 N O3 -","- C68 H100 N4 O12 -","4","1","VJ1085","S. Deepthi; Vasantha Pattabhi; K.Nagarajan","1-Isobutyl-2,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-3-indoleacetic acid","Acta Crystallographica Section C","1999","55","1","100","102","10.1107/S0108270198010373","","","1.5418","CuKα","","0.0421","0.0361","","0.108","0.1031","","","","1.102","1.142","1.142","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008120","7.713","0.002","8.674","0.001","28.325","0.006","90","","90","","90","","1895","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Ter-butoxy carbonyl L-Leucyl-L-Threonyl amide","","- C15 H29 N3 O5 -","- C15 H28 N3 O5 -","- C60 H112 N12 O20 -","4","1","VJ1089","S. Banumathi; D. Velmurugan; E. Subramanian; N. Ashish; R. Kishore","<i>tert</i>-Butoxycarbonyl-<small>L</small>-leucyl-<small>L</small>-threoninamide","Acta Crystallographica Section C","1999","55","1","78","79","10.1107/S0108270198010385","","","1.5418","CuKα","","0.0619","0.059","","","","0.1759","","","","","","1.008","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008121","6.462","0.001","33.014","0.007","10.457","0.002","90","","93.3","0.03","90","","2227.2","0.7","183","2","183","2","","","","","","","","3","P 1 21 1","P 2yb","4","isoavarol diacetate","2-(perhydro-1,2,4a-trimethyl-5-methylene-1-naphthylmethyl)-p-phenylene diacetate","","- C25 H34 O4 -","- C25 H34 O4 -","- C100 H136 O16 -","4","2","AV1024","Ilyin, Sergey G.; Shubina, Larisa K.; Stonik, Valentine A.; Antipin, Michael Yu.","Isoavarol diacetate","Acta Crystallographica Section C","1999","55","2","266","268","10.1107/S0108270198010993","","","0.71069","MoKα","","0.084","0.05","","0.076","","0.066","","","3.555","","","3.385","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008122","5.621","0.001","8.766","0.001","4.797","0.001","90","","90","","90","","236.37","0.07","293","2","293","2","","","","","","","","5","P m n 21","P 2ac -2","31","","cobalt ammonium hydrate phosphate","","- Co H6 N O5 P -","- Co H6 N O5 P -","- Co2 H12 N2 O10 P2 -","2","0.5","AV1025","Yakubovich, Olga V.; Karimova, Oksana V.; Dimitrova, Olga V.; Massa, Werner","Layer structure of (NH~4~)CoPO~4~","Acta Crystallographica Section C","1999","55","2","151","153","10.1107/S0108270198011639","","","0.71073","MoKα","","0.0152","0.0145","","","","0.0368","","","","","","1.145","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2008123","14.348","0.006","11.493","0.006","13.936","0.006","90","","95.43","0.04","90","","2287.8","1.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(4,4'-bipyridine)bis(1,3-diaminopropane)nickel(II) perchlorate","","- C16 H28 Cl2 N6 Ni O8 -","- C16 H28 Cl2 N6 Ni O8 -","- C64 H112 Cl8 N24 Ni4 O32 -","4","0.5","BK1408","Tong, Ye-Xiang; Tong, Ming-Liang; Yu, Xiao-Lan; Chen, Xiao-Ming","<i>catena</i>-Poly[[[bis(1,3-diaminopropane-<i>N</i>,<i>N</i>')nickel(II)]-μ-(4,4'-bipyridine-<i>N</i>:<i>N</i>')] diperchlorate]","Acta Crystallographica Section C","1999","55","2","180","182","10.1107/S0108270198011482","","","0.71073","MoKα","","0.046","0.035","","0.091","0.084","","","","1.07","1.106","1.106","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008124","9.2836","0.0012","11.4842","0.0013","13.7777","0.0012","106.896","0.002","90.436","0.003","93.93","0.002","1401.6","0.3","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H28 N12 O41 Sm2 -","- C42 H30 N12 O42 Sm2 -","- C42 H30 N12 O42 Sm2 -","1","0.5","BM1246","Arici, Cengiz; Ülkü, Dinçer; Tahir, M. Nawaz; Ünaleroḡlu, Canan","Samarium 3,5-dinitrobenzoate dihydrate","Acta Crystallographica Section C","1999","55","2","198","200","10.1107/S0108270198012323","","","0.71073","MoKα","","","0.035","","","0.038","","","","","1.12","1.12","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008125","9.088","0.002","8.108","0.002","10.505","0.002","90","","102.14","0.01","90","","756.8","0.3","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H10 N2 O3 S -","- C5 H10 N2 O3 S -","- C20 H40 N8 O12 S4 -","4","1","BM1255","Kennedy, Alan R.; Skellern, Graham G.; Pfirrmann, Rolf W.; Smail, Gordon A.; Shankland, Norman; Florence, Alastair J.","Two new compounds by reaction of taurolidine with methylene glycol","Acta Crystallographica Section C","1999","55","2","232","234","10.1107/S0108270198008415","","","0.71069","MoKα","","0.111","0.048","","0.058","0.051","","","","","1.578","1.578","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008126","14.53","0.001","8.0567","0.0008","15.928","0.002","90","","101.642","0.008","90","","1826.2","0.3","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 N6 O6 S3 -","- C12 H24 N6 O6 S3 -","- C48 H96 N24 O24 S12 -","4","1","BM1255","Kennedy, Alan R.; Skellern, Graham G.; Pfirrmann, Rolf W.; Smail, Gordon A.; Shankland, Norman; Florence, Alastair J.","Two new compounds by reaction of taurolidine with methylene glycol","Acta Crystallographica Section C","1999","55","2","232","234","10.1107/S0108270198008415","","","0.71069","MoKα","","0.067","0.038","","0.058","0.054","","","","","1.972","1.972","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008127","10.6849","0.0002","15.7703","0.0004","17.7065","0.0004","89.543","0.001","72.857","0.001","71.607","0.001","2693.49","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Trichloro(1,1'-bis(diphenylphosphine oxide)methane-p',p'')antimony(III)","","- C25 H22 Cl3 O2 P2 Sb -","- C25 H22 Cl3 O2 P2 Sb -","- C100 H88 Cl12 O8 P8 Sb4 -","4","2","BM1263","Ibrahim Abdul Razak; Hoong-Kun Fun; Bohari M. Yamin; Kandasamy Chinnakali; Hasbullah Zakaria; Norismaliza Binti Ismail","Trichloro[methylenebis(diphenylphosphine oxide-<i>O</i>)]antimony(III)","Acta Crystallographica Section C","1999","55","2","172","174","10.1107/S0108270198012335","","","0.71073","MoKα","","0.045","0.035","","","","0.081","","","","","","1.095","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008128","12.316","0.002","9.606","0.002","18.296","0.003","90","","103.77","0.02","90","","2102.3","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Flemiculosin","6-cinnamoyl-5-hydroxy-2,2,8,8-tetramethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran","","- C25 H24 O4 -","- C25 H24 O4 -","- C100 H96 O16 -","4","1","BM1267","Bhattacharyya, Kinkini; Mazumdar, Sunil Kumar; Bocelli, Gabriele; Cantoni, Andrea; Ray, Anil B; Neogi, Partha; Mazumdar, Gauri","Flemiculosin, a novel chalcone","Acta Crystallographica Section C","1999","55","2","215","217","10.1107/S0108270198011421","","","1.54178","CuKα","","0.0814","0.0583","","0.2302","0.1838","","","","1.003","1.103","1.103","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008129","7.2264","0.0009","8.025","0.0018","16.5902","0.0012","90","","92.052","0.008","90","","961.5","0.3","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H11 N O3 -","- C10 H11 N O3 -","- C40 H44 N4 O12 -","4","1","BM1270","Finnie, Stuart; Kennedy, Alan R.; Prasad, Korlakunte V. R.; Ristic, Radoljub I.; Sheen, David B.; Sherwood, John N.","<i>para</i>-Acetoxyacetanilide","Acta Crystallographica Section C","1999","55","2","234","236","10.1107/S0108270198012852","","","0.71069","MoKα","","0.1146","0.0436","","","","0.1467","","","","","","0.997","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008130","7.3402","0.0013","8.7066","0.0013","11.179","0.002","70.591","0.016","81.513","0.018","71.158","0.017","637.1","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H14 Cu O12 -","- C7 H14 Cu O12 -","- C14 H28 Cu2 O24 -","2","1","BM1282","Manojlović-Muir, Ljubica; Muir, Kenneth W.; Campbell, Robert A.; McKendrick, John E.; Robins, David J.","Pentaaqua(chelidonato-<i>O</i>^4^)copper(II) monohydrate","Acta Crystallographica Section C","1999","55","2","178","180","10.1107/S0108270198011895","","","0.71073","MoKα","","0.034","0.032","","","","0.088","","","","","","1.089","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008131","10.857","0.003","11.2892","0.0009","18.5162","0.0009","90","","90","","90","","2269.5","0.7","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2-benzyl-2-hydroxycyclohexanone","","- C13 H16 O2 -","- C13 H16 O2 -","- C104 H128 O16 -","8","1","BM1297","McCullough, Kevin J.; Perner, Iris; Rosair, Georgina M.","2-Benzyl-2-hydroxycyclohexanone","Acta Crystallographica Section C","1999","55","2","268","270","10.1107/S0108270198013869","","","0.71073","MoKα","","0.0882","0.0493","","","","0.135","","","","","","1.015","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008132","5.710728","0.000016","5.710728","0.000016","21.44383","0.0001","90","","90","","120","","605.642","0.004","295","","295","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- Ba3 Mn2 O8 -","- Ba3 Mn2 O8 -","- Ba9 Mn6 O24 -","3","0.0833333","BR1210","Weller, Mark T.; Skinner, Stephen J.","Ba~3~Mn~2~O~8~ determined from neutron powder diffraction","Acta Crystallographica Section C","1999","55","2","154","156","10.1107/S0108270198011871","","neutron","","neutron","","","0.064","","","0.07","","","","","1.7","1.7","","","","","has coordinates","188601","2020-10-21","18:00:00",""
"2008133","6.777","0.001","4.915","0.001","8.455","0.002","90","","91.11","0.03","90","","281.57","0.1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","ammonium oxovanadium(IV) phosphate ammonia","ammonium oxovanadium(IV) phosphate ammonia","","- H7 N2 O5 P V -","- H7 N2 O5 P V -","- H14 N4 O10 P2 V2 -","2","1","BR1216","Fratzky, Dietmar; Worzala, Horst; Goetze, Thomas; Meisel, Manfred","NH~4~VO(NH~3~)PO~4~","Acta Crystallographica Section C","1999","55","2","156","157","10.1107/S0108270198011123","","","0.71073","MoKα","","0.05","0.034","","","","0.07","","","","","","1.035","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008134","7.756","0.006","17.107","0.002","6.09","0.002","90","","90","","90","","808","0.7","296","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C6 H10 N2 O4 -","- C6 H10 N2 O4 -","- C24 H40 N8 O16 -","4","1","CF1254","Okabe, Nobuo; Adachi, Yukari","(<i>S</i>)-2-Hydroxy-3-(1<i>H</i>-imidazol-5-yl)propanoic acid hydrate","Acta Crystallographica Section C","1999","55","2","217","218","10.1107/S0108270198012542","","","0.71069","MoKα","","","0.06","","","0.107","","","","","1.44","1.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008135","20.745","0.002","9.921","0.001","9.232","0.001","90","","101.15","0.01","90","","1864.2","0.3","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 N8 O2 -","- C20 H18 N8 O2 -","- C80 H72 N32 O8 -","4","1","CF1258","Nieuwenhuyzen, M.; Keirse, R.; Shaw, B.; Vos, J. G.","A 2:1 co-crystal of 5-(2-pyridyl)-1<i>H</i>-1,2,4-triazole and 1,4-dihydroxybenzene","Acta Crystallographica Section C","1999","55","2","264","266","10.1107/S0108270198012359","","","0.71073","MoKα","","0.053","0.038","","0.095","0.085","","","","1.04","1.062","1.062","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008136","7.442","0.001","18.29","0.001","10.284","0.001","90","","104.74","0.01","90","","1353.7","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","trans-diaquabis(nicotinamide-N)bis(salicylato-O)copper(II)","","- C26 H26 Cu N4 O10 -","- C26 H26 Cu N4 O10 -","- C52 H52 Cu2 N8 O20 -","2","1","CF1276","Petrovčič, Nina; Kozlevčar, Bojan; Golič, Ljubo; Leban, Ivan; Šegedin, Primož","<i>trans</i>-Diaquabis(nicotinamide-<i>N</i>)bis(salicylato-<i>O</i>)copper(II)","Acta Crystallographica Section C","1999","55","2","176","178","10.1107/S0108270198011640","","","0.71073","MoKα","","0.0555","0.034","","","","0.0972","","","","","","1.034","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2008137","24.1291","0.0003","8.4281","0.0001","20.6083","0.0003","90","","90","","90","","4190.95","0.09","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Tetra(acetonitrile-N)lithium perchlorate","","- C8 H12 Cl Li N4 O4 -","- C8 H12 Cl Li N4 O4 -","- C96 H144 Cl12 Li12 N48 O48 -","12","3","DA1013","Yokota, Yasuno; Young Jr, Victor G.; Verkade, John G.","The homoleptic lithium complex [Li(CH~3~CN)~4~]ClO~4~","Acta Crystallographica Section C","1999","55","2","196","198","10.1107/S0108270198011834","","","0.71073","MoKα","","0.083","0.057","","","","0.116","","","","1.113","1.113","1.053","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008138","21.1645","0.0001","21.1645","0.0001","28.9378","0.0001","90","","90","","120","","11225.7","0.08","298","2","298","2","","","","","","","","6","R -3 :H","-R 3","148","cuprous bromide triphenylphosphite cubane tetramer","tetra-μ~3~-bromo-tetrakis[(triphenyl phosphite-P)copper(I)]","","- C72 H60 Br4 Cu4 O12 P4 -","- C72 H60 Br4 Cu4 O12 P4 -","- C432 H360 Br24 Cu24 O72 P24 -","6","0.333333","DA1019","Pike, Robert D.; Starnes, William H. Jr; Carpenter, Gene B.","Cubane tetrameric complexes of copper(I) chloride and bromide with triphenyl phosphite","Acta Crystallographica Section C","1999","55","2","162","165","10.1107/S0108270198012451","","","0.71073","MoKα","","0.08","0.048","","0.147","","0.147","","","","","","1.131","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008139","14.6643","0.0002","22.6409","0.0003","22.6645","0.0001","90","","107.434","0.001","90","","7179.23","0.15","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","cuprous chloride triphenylphosphite cubane tetramer","tetra-μ~3~-chloro-tetrakis[(triphenyl phosphite-P)copper(I)]","","- C72 H60 Cl4 Cu4 O12 P4 -","- C72 H60 Cl4 Cu4 O12 P4 -","- C288 H240 Cl16 Cu16 O48 P16 -","4","1","DA1019","Pike, Robert D.; Starnes, William H. Jr; Carpenter, Gene B.","Cubane tetrameric complexes of copper(I) chloride and bromide with triphenyl phosphite","Acta Crystallographica Section C","1999","55","2","162","165","10.1107/S0108270198012451","","","0.71073","MoKα","","0.1","0.049","","","","0.111","","","","","","1.013","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008140","9.31","0.002","11.341","0.004","11.887","0.003","102.01","0.02","97.05","0.02","104.81","0.02","1166.1","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","μ-[1,1'-(1,2-Ethanediyl)bis(1,2,4-1H-triazole)]-N^4^:N^4^'-bis{[1,1,1- trifluoro-3-(2-thenoyl)acetonato-O,O']copper(II)}","","- C38 H24 Cu2 F12 N6 O8 S4 -","- C38 H24 Cu2 F12 N6 O8 S4 -","- C38 H24 Cu2 F12 N6 O8 S4 -","1","0.5","DA1029","Baolong Li; Jianzhong Zou; Chunying Duan; Yongjiang Liu; Xianwen Wei; Zheng Xu","μ-[1,1'-(1,2-Ethanediyl)bis(1<i>H</i>-1,2,4-triazole)]-<i>N</i>^4^:<i>N</i>^4'^-bis{bis[1,1,1-trifluoro-3-(2-thenoyl)acetonato-<i>O</i>,<i>O</i>']copper(II)}","Acta Crystallographica Section C","1999","55","2","165","167","10.1107/S0108270198011846","","","0.71073","MoKα","","0.051","0.038","","0.123","0.109","","","","1.013","1.022","1.022","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008141","8.038","0.002","20.482","0.004","13.677","0.003","90","","91.76","0.02","90","","2250.6","0.9","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C28 H18 Cr O4 -","- C28 H18 Cr O4 -","- C112 H72 Cr4 O16 -","4","1","DA1035","Hannesschlager, Patrick; Brun, Pierre; Pèpe, Gérard","Tricarbonyl[(6a,7,8,9,10,10a-η)-3,3-diphenyl-3<i>H</i>-benzo[<i>f</i>]chromene]chromium","Acta Crystallographica Section C","1999","55","2","200","202","10.1107/S0108270198012104","","","0.71073","MoKα","","0.0441","0.0397","","0.0789","0.0773","","","","0.808","0.987","0.987","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008142","6.866","0.003","9.101","0.004","9.927","0.004","100.62","0.02","90.85","0.03","109.34","0.02","573.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[Ni(Me6trans[14]teteneN4)](ClO4)2","[Nickel(II)(5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca- -1,4,8,11-tetraene)]diperchlorate","","- C16 H28 Cl2 N4 Ni O8 -","- C16 H28 Cl2 N4 Ni O8 -","- C16 H28 Cl2 N4 Ni O8 -","1","0.5","DA1042","Gómez-Lara, Jacobo; Basiuk, Elena V.; Basiuk, Vladimir A.; Hernández-Ortega, Simon","(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradeca-1,4,8,11-tetraene-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')nickel(II) diperchlorate","Acta Crystallographica Section C","1999","55","2","160","162","10.1107/S0108270198012116","","","0.71073","MoKα","","0.0747","0.0562","","","","0.1564","","","","","","0.943","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008143","6.229","0.002","7.3544","0.0007","15.137","0.003","90.8","0.01","97.34","0.02","113.63","0.01","628.5","0.3","293","1","293","1","","","","","","","","3","P 1","P 1","1","Taraxerone","Taraxerone","","- C30 H48 O -","- C30 H48 O -","- C30 H48 O -","1","1","DA1044","Parvez, Masood; Gul, Waseem; Yousaf, Mohammad; Choudhary, M. Iqbal; Atta-ur-Rahman; Khan, M. Riaz","Taraxerone","Acta Crystallographica Section C","1999","55","2","213","215","10.1107/S0108270198012463","","","1.54178","CuKα","","0.059","0.055","","","","0.148","","","","","","1.06","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008144","6.685","0.002","13.2357","0.0011","14.8763","0.0019","93.677","0.009","98.114","0.016","90.359","0.014","1300.2","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","4-Heptamethyleneimino-7-nitrobenzo-2-oxa-1,3-diazole","4-Heptamethyleneimino-7-nitrobenzo-2-oxa-1,3-diazole","","- C13 H16 N4 O3 -","- C13 H16 N4 O3 -","- C52 H64 N16 O12 -","4","2","DE1090","Satyen Saha; Anunay Samanta","4-Heptamethyleneimino-7-nitrobenzo-2-oxa-1,3-diazole","Acta Crystallographica Section C","1999","55","2","252","254","10.1107/S0108270198012128","","","0.71073","MoKα","","0.083","0.05","","","","0.148","","","","","","0.998","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008145","24.772","0.005","10.165","0.002","15.362","0.003","90","","120.68","0.03","90","","3326.8","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(MALONATE)(AQUA)(5,6-DIMETHYL-1,10'PHENANTHROLINE) COPPER (II) HYDRATE","","- C34 H36 Cu2 N4 O12 -","- C17 H18 Cu N2 O6 -","- C136 H144 Cu8 N16 O48 -","8","1","FR1113","Gasque, Laura; Moreno-Esparza, Rafael; Mollins, Elies; Briansó-Penalva, José Luis; Ruiz-Ramírez, Lena; Medina-Dickinson, Gerardo","Aqua(5,6-dimethyl-1,10-phenanthroline-<i>N</i>,<i>N</i>')(malonato-<i>O</i>,<i>O</i>')copper(II) hydrate","Acta Crystallographica Section C","1999","55","2","158","160","10.1107/S0108270198009937","","","0.71073","MoKα","","0.056","0.032","","","","0.096","","","","","","1.057","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008146","6.5453","0.0006","7.5995","0.0008","24.855","0.003","90","","95.46","0.02","90","","1230.7","0.2","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 N2 O6 -","- C12 H10 N2 O6 -","- C48 H40 N8 O24 -","4","1","FR1126","Moreno-Fuquen, Rodolfo; Valderrama-Naranjo, Jaime; Montaño, Angela Marcela","A 1:1 complex of 4-nitropyridine <i>N</i>-oxide and 3-hydroxybenzoic acid","Acta Crystallographica Section C","1999","55","2","218","220","10.1107/S0108270198009949","","","0.71073","MoKα","","0.083","0.038","","0.117","0.084","","","","1.114","1.028","1.028","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008147","10.253","0.001","11.2035","0.0009","8.008","0.001","90","","90","","90","","919.87","0.16","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4-aminohippuric acid","","","- C9 H10 N2 O3 -","- C9 H10 N2 O3 -","- C36 H40 N8 O12 -","4","1","FR1150","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding in 4-aminohippuric acid","Acta Crystallographica Section C","1999","55","2","206","208","10.1107/S0108270198011767","","","0.71073","MoKα","","","0.036","","","0.059","","","","","1.76","1.76","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008148","7.0863","0.0005","4.3394","0.0006","13.2126","0.0006","90","","90.147","0.005","90","","406.29","0.07","296","","296","","","","","","","","","3","I 1 2 1","I 2y","5","(+)-tartaric acid dimethyl ether","(2R,3R)-(+)-2,3-dimethoxybutanedioic acid","","- C6 H10 O6 -","- C6 H10 O6 -","- C12 H20 O12 -","2","0.5","FR1158","Gerkin, Roger E.","Hydrogen bonding in (2<i>R</i>,3<i>R</i>)-(+)-2,3-dimethoxybutanedioic acid [(+)-tartaric acid dimethyl ether]","Acta Crystallographica Section C","1999","55","2","209","211","10.1107/S0108270198012694","","","0.71073","MoKα","","","0.031","","","0.056","","","","","1.9","1.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008149","14.4077","0.0011","8.0758","0.0007","19.0278","0.0008","90","","92.95","0.005","90","","2211","0.3","293","","298","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","dibenzobarrelene","[2,3:5,6]Dibenzo[2.2.2]octa-2,5,7-triene","","- C16 H12 -","- C16 H12 -","- C128 H96 -","8","1","FR1160","Burrows, Lary; Masnovi, John; Baker, Ronald J.","[2,3:5,6]Dibenzo[2.2.2]octa-2,5,7-triene (<i>C</i>2/<i>c</i>) and [2,3:5,6]dibenzo[2.2.2]octa-2,5-diene","Acta Crystallographica Section C","1999","55","2","236","239","10.1107/S010827019801275X","","","0.7093","MoKα","","0.038","0.038","","0.042","0.042","","","","","","","2.06","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008150","10.688","0.001","6.3449","0.0006","16.978","0.003","90","","104.62","0.01","90","","1114.1","0.3","293","","298","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","9,10-ethano-9,10-dihydroanthracene","[2,3:5,6]Dibenzo[2.2.2]octa-2,5-diene","","- C16 H14 -","- C16 H14 -","- C64 H56 -","4","1","FR1160","Burrows, Lary; Masnovi, John; Baker, Ronald J.","[2,3:5,6]Dibenzo[2.2.2]octa-2,5,7-triene (<i>C</i>2/<i>c</i>) and [2,3:5,6]dibenzo[2.2.2]octa-2,5-diene","Acta Crystallographica Section C","1999","55","2","236","239","10.1107/S010827019801275X","","","0.7093","MoKα","","0.035","0.035","","0.042","0.042","","","","","","","2.03","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008151","9.5974","0.0013","18.9323","0.0011","7.2881","0.001","90","","94.229","0.012","90","","1320.6","0.3","293","","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","tetrabenzo-24-crown-8","","","- C32 H32 O8 -","- C32 H32 O8 -","- C64 H64 O16 -","2","0.5","FR1161","Bryan, Jeffrey C.; Bunick, Gerard J.; Sachleben, Richard A.","Tetrabenzo-24-crown-8","Acta Crystallographica Section C","1999","55","2","250","252","10.1107/S0108270198012700","","","1.5418","CuKα","","0.046","0.038","","","","0.111","","","1.02","1.04","1.04","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008152","13.658","0.001","11.388","0.001","22.178","0.002","90","","106.951","0.008","90","","3299.6","0.5","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4,4',6,6'-tetramethylbiphenyl-2,2'-dicarboxylic acid","","","- C18 H18 O4 -","- C18 H18 O4 -","- C144 H144 O32 -","8","2","FR1167","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding in 4,4',6,6'-tetramethylbiphenyl-2,2'-dicarboxylic acid","Acta Crystallographica Section C","1999","55","2","203","206","10.1107/S0108270198012761","","","0.71073","MoKα","","","0.074","","","","0.097","","","","","","1.21","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008153","11.777","0.0011","9.3742","0.0005","17.0675","0.0015","90","","106.623","0.007","90","","1805.5","0.3","296","2","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-chloro-2-(N,N-dimethylaminomethyleneamino)-1-(2,2-pivaloyloxymethyl) pteridin-4-one","","- C15 H19 Cl N6 O3 -","- C15 H19 Cl N6 O3 -","- C60 H76 Cl4 N24 O12 -","4","1","GD1002","Helliwell, Madeleine; Dinsmore, Andrew; Garner, C. David; Joule, John A.","A 1-alkylated pteridine, C~15~H~19~ClN~6~O~3~","Acta Crystallographica Section C","1999","55","2","254","256","10.1107/S0108270198011883","","","1.5418","CuKα","","0.114","0.055","","","","0.167","","","","","","1.073","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008154","8.792","0.002","12.481","0.002","18.44","0.004","90","","90","","90","","2023.5","0.7","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H30 O7 S -","- C18 H30 O7 S -","- C72 H120 O28 S4 -","4","1","GS1019","Alayrac, Carole; Saint-Clair, Jean-François; Lemarié, Margareth; Metzner, Patrick; Averbuch-Pouchot, Marie-Thérèse","1,2:5,6-Di-<i>O</i>-isopropylidene-α-<small>D</small>-glucofuranosyl (<i>S</i>)-cyclohexanesulfinate","Acta Crystallographica Section C","1999","55","2","262","264","10.1107/S0108270198012384","","","0.7107","MoKα","","0.04","0.04","","0.045","0.045","","","","1.854","1.854","1.854","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008155","13.13","0.009","5.149","0.002","18.166","0.003","90","","90.92","0.03","90","","1228","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(Z)-3-(p-methoxy)benzylideneisoindolin-1-one","(Z)-3-(p-methoxy)benzylideneisoindolin-1-one","","- C16 H13 N O2 -","- C16 H13 N O2 -","- C64 H52 N4 O8 -","4","1","HA1225","Kundu, Nitya G.; Khan, M. Wahab; Guha, Subhadra; Mukherjee, Alok K.","Two (<i>Z</i>)-3-aryl(alkyl)ideneisoindolin-1-ones","Acta Crystallographica Section C","1999","55","2","239","241","10.1107/S0108270198009962","","","1.5418","CuKα","","0.057","0.049","","0.128","0.121","","","","1.068","1.108","1.108","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008156","9.426","0.002","9.795","0.002","9.909","0.002","68.7","0.02","81.17","0.02","70","0.02","800.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","(Z)-3-(2'-hydroxy-2'-methyl)propylidene-N-p-tolyl isoindolin-1-one","(Z)-3-(2'-hydroxy-2'-methyl)propylidene-N-p-tolyl isoindolin-1-one","","- C19 H19 N O2 -","- C19 H19 N O2 -","- C38 H38 N2 O4 -","2","1","HA1225","Kundu, Nitya G.; Khan, M. Wahab; Guha, Subhadra; Mukherjee, Alok K.","Two (<i>Z</i>)-3-aryl(alkyl)ideneisoindolin-1-ones","Acta Crystallographica Section C","1999","55","2","239","241","10.1107/S0108270198009962","","","0.71073","MoKα","","0.24","0.055","","0.125","0.104","","","","0.771","1.272","1.272","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008157","13.322","0.001","5.167","0.001","20.938","0.001","90","","90","","90","","1441.3","0.3","173","2","173","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","3a,4,7,7a-Tetrahydro-isobenzofuran-1,3-dione","","- C8 H8 O3 -","- C8 H8 O3 -","- C64 H64 O24 -","8","2","HA1235","Bolte, Michael; Bauch, Christian","<i>cis</i>-1,2,3,6-Tetrahydrophthalic anhydride at 173K","Acta Crystallographica Section C","1999","55","2","226","228","10.1107/S0108270198012402","","","0.71073","MoKα","","0.0397","0.0323","","","","0.0853","","","","","","1.056","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008158","6.1925","0.0001","10.2272","0.0003","24.8189","0.0006","90","","90","","90","","1571.83","0.06","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-(3-furyl)-1,4,6,6a,7,10,10a,10b-octahydro-6a,10b-dimethyl-2H-naptho [2,1-c]pyran-7,4-dione","","- C19 H20 O4 -","- C19 H20 O4 -","- C76 H80 O16 -","4","1","HA1236","Nor Aziyah Bakhari; Sam Teng Wah; Kandasamy Chinnakali; Hoong-Kun Fun; Ibrahim Abdul Razak","Δ^8,9^-Decarboxyfibleucin from <i>Fibraurea chloroleuca</i> Miers","Acta Crystallographica Section C","1999","55","2","228","230","10.1107/S0108270198011962","","","0.71073","MoKα","","0.086","0.054","","","","0.113","","","","","","1.086","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008159","9.327","0.005","17.472","0.008","7.296","0.004","90","","115.51","0.04","90","","1073.1","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Ethyl mustard oil sulphide Hydrochloride","4-Ethyl-5-ethyliminium-1,2,4-dithiazolidine-3-thione chloride","","- C6 H11 Cl N2 S3 -","- C6 H11 Cl N2 S3 -","- C24 H44 Cl4 N8 S12 -","4","1","JZ1288","Beck, Johannes; Walter, Jörg","Ethyl mustard oil sulfide hydrochloride","Acta Crystallographica Section C","1999","55","2","260","262","10.1107/S0108270198011184","","","0.71073","MoKα","","0.0426","0.037","","","0.1034","0.1101","","","","1.068","1.068","1.063","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008160","26.174","0.007","5.5429","0.0007","15.727","0.004","90","","116.6","0.02","90","","2040.2","0.9","150","1","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Cu~2(DAB)~2","Bis(μ-diazoaminobenzene)dicooper(I)","","- C24 H20 Cu2 N6 -","- C24 H20 Cu2 N6 -","- C96 H80 Cu8 N24 -","4","0.5","JZ1296","Falvello, Larry R.; Urriolabeitia, Esteban P.; Mukhopadhyay, U.; Ray, D.","Redetermination of (diazoaminobenzene)copper(I) at 150K","Acta Crystallographica Section C","1999","55","2","170","172","10.1107/S0108270198011706","","","0.71073","MoKα","","0.0453","0.0308","","","","0.0812","","","","","","1.056","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008161","11.495","0.001","11.495","0.001","19.134","0.003","90","","90","","90","","2528.3","0.5","150","","150","","","","","","","","","5","I -4 2 m","I -4 2","121","","Bis(tetramethylammonium)tetra-μ~3~-sulfido-tetrakis [(2,2-dimethylpropanethiolato-S)iron(III)]","","- C28 H68 Fe4 N2 S8 -","- C28 H84 Fe4 N2 S8 -","- C56 H168 Fe8 N4 S16 -","2","0.125","JZ1305","Ralf Hauptmann; Jörg Schneider; Martin Köckerling; Gerald Henkel","Bis(tetramethylammonium) tetra-μ~3~-sulfido-tetrakis[(2,2-dimethylpropanethiolato-<i>S</i>)iron]: a heterocubane complex anion with crystallographically imposed øverline{4}2<i>m</i> symmetry","Acta Crystallographica Section C","1999","55","2","190","192","10.1107/S0108270198011718","","","0.71073","MoKα","","","0.055","","","","0.151","","","","1.167","1.167","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008162","10.696","0.005","11.305","0.005","13.301","0.005","90","0.005","110.06","0.005","90","0.005","1510.8","1.1","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tert-butyl N-(1-aminocarbonyl-1-isopropylbut-3-enyl)carbamate","","- C13 H24 N2 O3 -","- C13 H24 N2 O3 -","- C52 H96 N8 O12 -","4","1","JZ1318","Badorrey, Ramón; Cativiela, Carlos; Díaz-de-Villegas, María D.; Gálvez, José A.; Lapeña, Yolanda","2-<i>tert</i>-Butoxycarbonylamino-2-isopropyl-4-pentenamide, a new conformationally restricted α,α-dialkylglycine derivative","Acta Crystallographica Section C","1999","55","2","241","243","10.1107/S010827019801172X","","","0.71069","MoKα","","","0.054","","","","0.154","","","","","","1.006","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008163","8.111","0.001","13.449","0.002","24.09","0.005","90","","90","","90","","2627.9","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[2S,2(1R),2(2R),4R]-2-ethyl-2-(2-hydroxy-1-methyl-2-phenylpropyl- 3-tosyl-4-phenyl-1,3-oxazolidine","","- C28 H33 N O4 S -","- C28 H33 N O4 S -","- C112 H132 N4 O16 S4 -","4","1","JZ1328","Bolte, Michael; Monz, Sabine; Wagner, Kerstin","Three 3-arylsulfonyl-1,3-oxazolidines","Acta Crystallographica Section C","1999","55","2","222","226","10.1107/S010827019801258X","","","1.5418","CuKα","","0.032","0.031","","","","0.085","","","","","","1.051","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008164","8.901","0.001","11.935","0.002","25.898","0.002","90","","90","","90","","2751.2","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[2S,2(1R),4R]-2-[1-(3-ethoxy-3-oxo)-1-hydroxy-1-phenylpropyl]-2-ethyl- 3-tosyl-4-phenyl-1,3-oxazolidine","","- C29 H33 N O6 S -","- C29 H33 N O6 S -","- C116 H132 N4 O24 S4 -","4","1","JZ1328","Bolte, Michael; Monz, Sabine; Wagner, Kerstin","Three 3-arylsulfonyl-1,3-oxazolidines","Acta Crystallographica Section C","1999","55","2","222","226","10.1107/S010827019801258X","","","1.5418","CuKα","","0.046","0.042","","","","0.109","","","","","","1.048","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008165","11.054","0.001","14.824","0.003","15.25","0.003","90","","90","","90","","2498.9","0.7","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-(2,3,4,5)-tetrahydro-3-methylen-2-oxo-5-phenyl-furan-5-yl)- 1,3-oxazolidine","","- C28 H27 N O5 S -","- C28 H27 N O5 S -","- C112 H108 N4 O20 S4 -","4","1","JZ1328","Bolte, Michael; Monz, Sabine; Wagner, Kerstin","Three 3-arylsulfonyl-1,3-oxazolidines","Acta Crystallographica Section C","1999","55","2","222","226","10.1107/S010827019801258X","","","1.5418","CuKα","","0.03","0.029","","0.084","0.081","","","","1.06","1.06","1.06","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008166","10.236","0.001","22.433","0.003","12.188","0.002","90","","104.89","0.01","90","","2704.7","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-Methyl-(p-chorophenacyl)aniline","","- C15 H14 Cl N O -","- C15 H14 Cl N O -","- C120 H112 Cl8 N8 O8 -","8","2","KA1278","M. Paz Martínez-Alcázar; Isabel Fonseca; Felix H. Cano; J. Gonzalo Rodríguez","<i>N</i>-(<i>p</i>-Chlorobenzoyl)-<i>N</i>-methylaniline","Acta Crystallographica Section C","1999","55","2","256","258","10.1107/S0108270198010774","","","1.5418","CuKα","","0.077","0.0535","","","","0.1415","","","","","","0.932","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008167","18.3481","0.0016","8.3075","0.0007","13.2995","0.0009","90","","113.96","0.006","90","","1852.5","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","cis-Bis(2-aminobenzothiazole-N)-bis(formato-O,O')copper(II)","","- C16 H14 Cu N4 O4 S2 -","- C16 H14 Cu N4 O4 S2 -","- C64 H56 Cu4 N16 O16 S8 -","4","0.5","KA1298","Sieroń, Lesław; Bukowska-Strzyżewska, Maria","<i>cis</i>-Bis(2-amino-1,3-benzothiazole-<i>N</i>^3^)bis(formato-<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1999","55","2","167","169","10.1107/S0108270198011743","","","0.71073","MoKα","","0.0387","0.0325","","","","0.0801","","","","","","1.142","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008168","24.49","0.005","39.314","0.008","11.808","0.002","90","","90","","90","","11369","4","150","","150","","","","","","","","","6","F d d 2","F 2 -2d","43","","Tris(tetraethylammonium)tetrakis(thiophenolato-μ~3~- selenido-iron)","","- C48 H80 Fe4 N3 S4 Se4 -","- C48 H80 Fe4 N3 S4 Se4 -","- C384 H640 Fe32 N24 S32 Se32 -","8","0.5","LN1065","Hauptmann, Ralf; Schneider, Jörg; Chen, Changneng; Henkel, Gerald","Tris(tetraethylammonium) tetra-μ~3~-selenido-tetrakis[(thiophenolato-<i>S</i>)iron]","Acta Crystallographica Section C","1999","55","2","192","194","10.1107/S0108270198012190","","","0.71073","MoKα","","","0.0366","","","","0.0824","","","","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008169","8.744","0.004","14.219","0.007","19.552","0.009","90","","98.63","0.04","90","","2403","2","293","1","293","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aquabis(2,2'-bipyridine-N,N')(perchlorato-O)-manganese(II) perchlorate","","- C20 H18 Cl2 Mn N4 O9 -","- C20 H16 Cl2 Mn N4 O9 -","- C80 H64 Cl8 Mn4 N16 O36 -","4","1","LN1066","Rodríguez-Martín, Yolanda; González-Platas, Javier; Ruiz-Pérez, Catalina","Aquabis(2,2'-bipyridine-<i>N</i>,<i>N</i>')(perchlorato-<i>O</i>)manganese(II) perchlorate","Acta Crystallographica Section C","1999","55","2","186","188","10.1107/S0108270198012049","","","1.54179","CuKα","","0.121","0.068","","","","0.211","","","","","","1.079","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008170","9.024","0.003","11.442","0.002","17.506","0.003","86.12","0.01","79.1","0.02","68.33","0.02","1649.5","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H12 N2 O4 -","- C20 H12 N2 O4 -","- C80 H48 N8 O16 -","4","2","LN1070","Elmali, Ayhan; Kabak, Mehmet; Elerman, Yalc̨in","2-Salicylideneamino-4,5-bis(2-furyl)furan-3-carbonitrile","Acta Crystallographica Section C","1999","55","2","258","260","10.1107/S0108270198012268","","","0.71069","MoKα","","0.0773","0.0467","","0.1618","0.1162","","","","1.092","0.987","0.987","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008171","10.118","0.002","9.705","0.003","11.919","0.003","90","","97.32","0.01","90","","1160.8","0.5","292","","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(tert-Butyl)-3-(2-pyridyl)thiourea","","- C10 H15 N3 S -","- C10 H15 N3 S -","- C40 H60 N12 S4 -","4","1","NA1341","Angelova, Olyana; Kossev, Krasimir; Atanasov, Vladimir","1-(<i>tert</i>-Butyl)-3-(2-pyridyl)thiourea","Acta Crystallographica Section C","1999","55","2","220","222","10.1107/S0108270198009615","","","0.71073","MoKα","","0.063","0.043","","","","0.128","","","","","","1.02","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008172","6.5118","0.0004","8.1702","0.0006","13.9142","0.0008","72.501","0.005","75.962","0.005","71.093","0.006","659.22","0.08","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H9 Cl3 N2 -","- C14 H9 Cl3 N2 -","- C28 H18 Cl6 N4 -","2","1","NA1364","Kendi̇, Engi̇n; Özbey, Süheyla; Göker, Hakan","2,5-Dichloro-1-(<i>p</i>-chlorobenzyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section C","1999","55","2","243","245","10.1107/S0108270198011196","","","0.71073","MoKα","","","0.03","","","0.031","","","","","1.37","1.37","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008173","15.684","0.003","16.17","0.003","17.222","0.003","90","","116.75","0.01","90","","3900.2","1.3","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]chromium(0)","","- C14 H27 Cr O3 P3 -","- C14 H27 Cr O3 P3 -","- C112 H216 Cr8 O24 P24 -","8","2","OA1069","Suzuki, Takayoshi; Imamura, Takeshi; Kaizaki, Sumio","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]chromium(0), -molybdenum(0) and -tungsten(0) complexes","Acta Crystallographica Section C","1999","55","2","182","186","10.1107/S0108270198012414","","","0.7107","MoKα","","","0.0572","","","","0.0595","","","","","","1.53","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2008174","8.601","0.002","16.324","0.004","14.422","0.002","90","","96.59","0.02","90","","2011.5","0.7","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]molybdenum(0)","","- C14 H27 Mo O3 P3 -","- C14 H27 Mo O3 P3 -","- C56 H108 Mo4 O12 P12 -","4","1","OA1069","Suzuki, Takayoshi; Imamura, Takeshi; Kaizaki, Sumio","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]chromium(0), -molybdenum(0) and -tungsten(0) complexes","Acta Crystallographica Section C","1999","55","2","182","186","10.1107/S0108270198012414","","","0.7107","MoKα","","","0.0408","","","","0.0502","","","","","","1.746","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2008175","8.566","0.001","16.281","0.002","14.41","0.002","90","","96.77","0.01","90","","1995.6","0.4","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]tungsten(0)","","- C14 H27 O3 P3 W -","- C14 H27 O3 P3 W -","- C56 H108 O12 P12 W4 -","4","1","OA1069","Suzuki, Takayoshi; Imamura, Takeshi; Kaizaki, Sumio","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]chromium(0), -molybdenum(0) and -tungsten(0) complexes","Acta Crystallographica Section C","1999","55","2","182","186","10.1107/S0108270198012414","","","0.7107","MoKα","","","0.0268","","","","0.0347","","","","","","1.382","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2008176","7.2454","0.0003","9.1927","0.0004","15.6539","0.0007","92.418","0.001","99.687","0.001","112.666","0.001","941.79","0.07","203","2","203","2","","","","","","","","5","P -1","-P 1","2","SN 18071.Ts","1,4-bis[4-(1-pyridinium)styryl)]benzene ditosylate","","- C46 H40 N2 O6 S2 -","- C46 H40 N2 O6 S2 -","- C46 H40 N2 O6 S2 -","1","0.5","OS1035","Clark, George R.; Denny, William A.; Squire, Christopher J.","1,4-Bis[4-(1-pyridinium)styryl]benzene ditosylate","Acta Crystallographica Section C","1999","55","2","230","232","10.1107/S0108270198012396","","","0.71073","MoKα","","0.049","0.04","","","","0.107","","","","","","1.021","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008177","11.36","0.003","12.237","0.002","11.717","0.002","90","","93.63","0.03","90","","1625.5","0.6","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichloro[1-(thiomethyl)-2-(diphenylphosphino)ethane]palladium(II)","","- C15 H17 Cl2 P Pd S -","- C15 H17 Cl2 P Pd S -","- C60 H68 Cl8 P4 Pd4 S4 -","4","1","OS1039","Adnan S. Abu-Surrah; Kristian Lappalainen; Martti Klinga; Markku Leskelä; Hamdallah A. Hodali; Bernhard Rieger","A dichloropalladium(II) complex with a mixed-donor bidentate ligand: dichloro[2-(diphenylphosphino)-1-(methylthio)ethane-<i>P</i>,<i>S</i>]palladium(II)","Acta Crystallographica Section C","1999","55","2","188","190","10.1107/S0108270198012773","","","0.71073","MoKα","","0.05","0.037","","0.077","0.073","","","","1.03","1.07","1.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008178","14.901","0.002","15.785","0.001","8.012","0.002","90","","98.67","0.02","90","","1863","0.6","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H24 N2 O3 -","- C10.5 H12 N O1.5 -","- C84 H96 N8 O12 -","8","1","OS1040","Hökelek, Tuncer; Kılıç, Zeynel; Bilge, Selen","2,5,8-Trioxa-16,20-diazatricyclo[20.4.0.0^9,14^]hexacosa-9,11,13,15,20,22,24,26-octaene","Acta Crystallographica Section C","1999","55","2","248","250","10.1107/S0108270198012281","","","0.71069","MoKα","","","0.0691","","","0.075","","","","","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008179","9.557","0.001","16.14","0.001","13.688","0.001","90","0.001","100.978","0.001","90","0.001","2072.7","0.3","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 N4 O3 -","- C23 H24 N4 O3 -","- C92 H96 N16 O12 -","4","1","QA0067","Aatif, A.; Baouid, A.; Hasnaoui, A.; Benharref, A.; Alilou, E. H.; Pierrot, M.","Ethyl 7-oxo-3-(4-tolyl)-4,5,6,6a,7,8-hexahydro-3<i>H</i>-cyclopenta[<i>b</i>][1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazepine-1-carboxylate and ethyl 3-(4-chlorophenyl)-8-methyl-7-oxo-4,5,6,6a,7,8-hexahydro-3<i>H</i>-cyclopenta[<i>b</i>][1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazepine-1-carboxylate","Acta Crystallographica Section C","1999","55","2","IUC9900010","","10.1107/S0108270199099849","","","0.71073","MoKα","","","0.061","","","0.087","","","","","1.506","1.506","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008180","9.942","0.001","16.184","0.001","13.787","0.001","90","0.001","107.64","0.001","90","0.001","2114","0.3","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 Cl N4 O3 -","- C23 H23 Cl N4 O3 -","- C92 H92 Cl4 N16 O12 -","4","1","QA0067","Aatif, A.; Baouid, A.; Hasnaoui, A.; Benharref, A.; Alilou, E. H.; Pierrot, M.","Ethyl 7-oxo-3-(4-tolyl)-4,5,6,6a,7,8-hexahydro-3<i>H</i>-cyclopenta[<i>b</i>][1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazepine-1-carboxylate and ethyl 3-(4-chlorophenyl)-8-methyl-7-oxo-4,5,6,6a,7,8-hexahydro-3<i>H</i>-cyclopenta[<i>b</i>][1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazepine-1-carboxylate","Acta Crystallographica Section C","1999","55","2","IUC9900010","","10.1107/S0108270199099849","","","0.71073","MoKα","","","0.069","","","0.093","","","","","1.56","1.56","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008181","14.84","0.001","7.0447","0.0007","4.2585","0.0004","81.292","0.008","84.988","0.008","84.837","0.008","437.05","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Potassium 2,4-dichloro-6-nitrophenolate","potassium 2,4-dichloro-6-nitrophenolate","","- C6 H2 Cl2 K N O3 -","- C6 H2 Cl2 K N O3 -","- C12 H4 Cl4 K2 N2 O6 -","2","1","QA0075","Vasiliev, Alexander D.; Solovyov, Leonid A.","Potassium 2,4-dichloro-6-nitrophenolate","Acta Crystallographica Section C","1999","55","2","IUC9900004","","10.1107/S0108270199099904","","","1.54051","CuKα","","0.053","0.051","","","","0.13","","","","","","1.099","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008182","7.242","0.007","10.01","0.007","10.962","0.006","115.96","0.05","90.89","0.03","107.84","0.07","669.6","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","phenanthridine hydrogenselenate monohydrate","9-azaphenathrenium(1+) hydrogenselenate(1-) monohydrate","","- C13 H13 N O5 Se -","- C13 H13 N O5 Se -","- C26 H26 N2 O10 Se2 -","2","1","QA0076","Slouf, Miroslav; Cisarova, Ivana","Phenathridinium hydrogenselenate monohydrate","Acta Crystallographica Section C","1999","55","2","IUC9900003","","10.1107/S0108270199099874","","","0.71073","MoKα","","0.065","0.055","","","","0.148","","","","","","1.077","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008183","5.2326","0.0003","16.766","0.002","6.613","0.0005","90","","106.983","0.005","90","","554.86","0.09","298","","298","","","","","","","","","5","P 1 21 1","P 2yb","4","","3-(3-bromopropyl)-5-nitro-1H-indole","","- C11 H11 Br N2 O2 -","- C11 H11 Br N2 O2 -","- C22 H22 Br2 N4 O4 -","2","1","QA0079","Garcia, J. Gabriel; Billodeaux, Damon R.; Fronczek, Frank R.","Two 3-substituted 5-nitroindoles","Acta Crystallographica Section C","1999","55","2","IUC9900007","","10.1107/S0108270199099783","","","1.54184","CuKα","","","0.025","","","0.036","","","","","1.978","1.978","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008184","10.3272","0.0007","13.962","0.001","7.4435","0.0006","90","","99.489","0.006","90","","1058.58","0.14","299","","299","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(3-hydroxypropyl)-5-nitro-1H-indole","","- C11 H12 N2 O3 -","- C11 H12 N2 O3 -","- C44 H48 N8 O12 -","4","1","QA0079","Garcia, J. Gabriel; Billodeaux, Damon R.; Fronczek, Frank R.","Two 3-substituted 5-nitroindoles","Acta Crystallographica Section C","1999","55","2","IUC9900007","","10.1107/S0108270199099783","","","1.54184","CuKα","","0.052","0.047","","0.056","0.056","","","","1.851","1.848","1.848","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008185","9.952","0.002","11.767","0.002","6.206","0.002","90","","90","","90","","726.8","0.3","125","2","125","2","","","","","","","","3","I b a m","-I 2 2c","72","","2-Propenoic Acid","","- C3 H4 O2 -","- C3 H4 O2 -","- C24 H32 O16 -","8","0.5","","Boese, R.; Bläser, D.; Steller, I.; Latz, R.; Bäumen, A.","Redetermination of 2-propenoic acid at 125K","Acta Crystallographica Section C","1999","55","2","IUC9900006","","10.1107/S0108270199099850","","","0.71073","MoKα","","0.05","0.04","","","","0.118","","","","","","1.074","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008186","13.129","0.003","19.201","0.004","27.672","0.006","90","","90","","90","","6976","3","133","2","133","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(+)-(1R,5S,6R)-1-[3-(9,9-Dimethyl-4,4-dioxo-4λ^6^-thiatricyclo[6.1.1.0^2,6^]- dec-2-en-5-yl)-2-tert-butyldimethylsilyloxy-4,6-dimethoxy-phenyl]-3-methyl- butan-1-one","","- C32.5 H52 O6.5 S Si -","- C32.5 H52 O6.5 S Si -","- C260 H416 O52 S8 Si8 -","8","2","QA0081","Bats, Jan W.; Berger, Bernd; Gerlach, Matthias; Reggelin, Michael","(+)-(1<i>R</i>,5<i>S</i>,6<i>R</i>)-1-[3-(9,9-Dimethyl-4,4-dioxo-4λ^6^-thiatricyclo[6.1.1.0^2,6^]dec-2-en-5-yl)-2-<i>tert</i>-butyldimethylsilyloxy-4,6-dimethoxyphenyl]-3-methylbutan-1-one methyl <i>tert</i>-butyl ethersolvate at 133K","Acta Crystallographica Section C","1999","55","2","IUC9900002","","10.1107/S0108270199099837","","","0.71073","MoKα","","0.103","0.061","","","","0.114","","","","","","1.096","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008187","13.151","0.003","3.923","0.001","5.762","0.001","90","","90","","90","","297.27","0.11","40","2","40","2","","","","","","","","3","P n a 21","P 2c -2n","33","Acetic acid","Ethanoic acid","","- C2 H4 O2 -","- C2 H4 O2 -","- C8 H16 O8 -","4","1","QA0082","Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","Acetic acid at 40K","Acta Crystallographica Section C","1999","55","2","IUC9900001","","10.1107/S0108270199099862","","","0.71073","MoKα","","0.0413","0.0397","","","","0.0986","","","","","","1.131","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008188","7.0377","0.0001","25.6325","0.0002","8.7769","0.0001","90","","108.731","0.001","90","","1499.44","0.03","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,5-Di(2-chlorophenyl)-1,2,4-triazole-3-thione.","","- C14 H9 Cl2 N3 S -","- C14 H9 Cl2 N3 S -","- C56 H36 Cl8 N12 S4 -","4","1","QA0084","Kandasamy Chinnakali; Hoong-Kun Fun; Annamalai Senthilvelan; Vayalakkavoor T. Ramakrishnan","3,4-Bis(2-chlorophenyl)-1,2,4-1<i>H</i>-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section C","1999","55","2","IUC9900005","","10.1107/S0108270199099813","","","0.71073","MoKα","","0.114","0.07","","","","0.207","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008189","14.436","0.003","28.732","0.003","8.592","0.002","90","","106.34","0.02","90","","3419.8","1.2","297","","297","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(N,N'-disalicylideneethylenediamine)(isothiocyanato)oxovanadium(V)","","","- C17 H14 N3 O3 S V -","- C17 H14 N3 O3 S V -","- C136 H112 N24 O24 S8 V8 -","8","2","QA0085","Tsuchimoto, Masanobu; Ohba, Shigeru","[<i>N</i>,<i>N</i>'-Bis(salicylidene)ethylenediamine](isothiocyanato)oxovanadium(V)","Acta Crystallographica Section C","1999","55","2","IUC9900008","","10.1107/S0108270199099898","","","0.71073","MoKα","","0.123","0.051","","","","0.081","","","","","","1.095","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008190","8.0436","0.0002","8.7719","0.0003","8.9585","0.0003","73.188","0.001","63.829","0.001","73.398","0.002","533.76","0.03","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","9-hydroxy-4-methyl-9,10-dihydro-7,8-benzocoumarin","","- C14 H12 O3 -","- C14 H12 O3 -","- C28 H24 O6 -","2","1","QA0086","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan","9-Hydroxy-4-methyl-9,10-dihydrobenzo[<i>h</i>]coumarin","Acta Crystallographica Section C","1999","55","2","IUC9900011","","10.1107/S0108270199099825","","","0.71073","MoKα","","0.095","0.072","","","","0.231","","","","","","1.059","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008191","4.1458","0.0002","12.5203","0.0004","11.1023","0.0004","90","","100.06","0.002","90","","567.42","0.04","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","E-1,2-(Di-2'-chlorocyclopentenyl)ethylene","","- C12 H14 Cl2 -","- C12 H14 Cl2 -","- C24 H28 Cl4 -","2","0.5","QA0087","Susmita Gupta; Jayanta Kumar Ray; Kandasamy Chinnakali; Hoong-Kun Fun","(<i>E</i>)-1,2-Bis(2-chlorocyclopentenyl)ethene","Acta Crystallographica Section C","1999","55","2","IUC9900012","","10.1107/S0108270199099801","","","0.71073","MoKα","","0.088","0.064","","","","0.172","","","","","","0.923","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008192","12.8316","0.0002","13.5924","0.0002","23.8128","0.0004","79.5365","0.0009","88.225","0.0008","63.4592","0.0008","3647.83","0.1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","1,3,5-tri-tertbutyldimethylsilyloxymethyl-2,4,6-triiodbenzene","","- C27 H51 I3 O3 Si3 -","- C27 H51 I3 O3 Si3 -","- C108 H204 I12 O12 Si12 -","4","2","QA0088","Løiten, Marianne Sveaas; Gløgård, Christian; Dalhus, Bjørn; Fjartoft, Berit; Klaveness, Jo","2,4,6-Triiodo-1,3,5-tris(<i>tert</i>-butyldimethylsilyloxymethyl)benzene","Acta Crystallographica Section C","1999","55","2","IUC9900009","","10.1107/S0108270199099795","","","0.71073","MoKα","","0.068","0.057","","0.151","0.136","","","","1.997","2.074","2.074","","","","","has coordinates,has disorder","201955","2020-10-21","18:00:00",""
"2008193","8.486","0.001","9.571","0.001","19.68","0.002","90","","101.54","0.01","90","","1566.1","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Dimethoxyl-6,7,9,10,11-pentahydro-2-hydroxyl-2-methyl-1H-cyclopenta[jk] pyrrolo[2,1-b][3]benzazepine-1-one","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C72 H84 N4 O16 -","4","1","QA0092","Zhong, Sanbao; Deng, Yijian; Yu, Kaibei; Zhu, Jin; Mi, Aiqiao; Jiang, Yaozhong; Zhang, Guoling","2-Hydroxy-3,4-dimethoxy-2-methyl-1,2,6,7,10,11-hexahydro-9<i>H</i>-cyclopenta[<i>jk</i>]pyrrolo[2,1-<i>b</i>][3]benzazepin-1-one","Acta Crystallographica Section C","1999","55","2","IUC9900013","","10.1107/S0108270199099886","","","0.71073","MoKα","","0.049","0.034","","0.142","0.083","","","","0.952","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008194","13.524","0.002","11.221","0.001","18.41","0.002","90","","96.06","0.01","90","","2778.2","0.6","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C9 H15 Cu Na O12 -","- C9 H15 Cu Na O12 -","- C72 H120 Cu8 Na8 O96 -","8","1","SK1164","Chui, Stephen Sin Yin; Siu, Alvin; Williams, Ian D.","Sodium copper(II) trimesate, [NaCu{C~6~H~3~(COO)~3~}(H~2~O)~4~].2H~2~O, a double-sheet coordination polymer with bridging aqua ligands","Acta Crystallographica Section C","1999","55","2","194","196","10.1107/S0108270198010944","","","0.71073","MoKα","","0.0391","0.0317","","0.0848","0.0788","","","","1.064","1.084","1.084","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008195","11.6017","0.001","11.2268","0.0011","16.752","0.0015","90","","108.936","0.008","90","","2063.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","A Binuclear Cadmium(II) complex: Bis(diisopropyldithiocarbamate) Cadmium(II)","","- C28 H56 Cd2 N4 S8 -","- C28 H56 Cd2 N4 S8 -","- C56 H112 Cd4 N8 S16 -","2","0.5","SK1201","Fang-fang Jian; Zuo-xiang Wang; Hoong-Kun Fun; Zhi-ping Bai; Xiao-zeng You","A binuclear cadmium(II) complex: bis[bis(<i>N,N</i>-diisopropyldithiocarbamato)cadmium(II)]","Acta Crystallographica Section C","1999","55","2","174","176","10.1107/S0108270198012062","","","0.71073","MoKα","","0.0586","0.0411","","0.1056","0.0989","","","","0.95","1.045","1.045","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008196","21.935","0.001","11.4354","0.0007","9.9743","0.0006","90","","90","","90","","2501.9","0.2","295","","295","","","","","","","","","5","P b c n","-P 2n 2ab","60","","2-[2-(dimethylamino)ethylaminomethyl]-4-chlorophenol","","- C11 H17 Cl N2 O -","- C11 H17 Cl N2 O -","- C88 H136 Cl8 N16 O8 -","8","1","SK1230","Lian Ee Khoo; Hong Juan Hu; Alan Hazell","4-Chloro-2-[2-(dimethylamino)ethylaminomethyl]phenol and 2-[2-(dimethylamino)ethylaminomethyl]-6-methoxyphenol","Acta Crystallographica Section C","1999","55","2","245","248","10.1107/S0108270198012050","","","0.71073","MoKα","","","0.041","","","0.046","","","","","","","1.295","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008197","15.9034","0.0008","10.5054","0.0005","16.1559","0.0008","90","","90","","90","","2699.2","0.2","298","","298","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-[2-dimethylamino)ethylaminomethyl]-6-methoxyphenol","","- C12 H20 N2 O2 -","- C12 H20 N2 O2 -","- C96 H160 N16 O16 -","8","1","SK1230","Lian Ee Khoo; Hong Juan Hu; Alan Hazell","4-Chloro-2-[2-(dimethylamino)ethylaminomethyl]phenol and 2-[2-(dimethylamino)ethylaminomethyl]-6-methoxyphenol","Acta Crystallographica Section C","1999","55","2","245","248","10.1107/S0108270198012050","","","0.71073","MoKα","","","0.048","","","0.056","","","","","","","1.569","","","","has coordinates,has Fobs","190596","2020-10-21","18:00:00",""
"2008198","14.283","0.002","17.083","0.004","7.723","0.003","90","","90","","90","","1884.4","0.9","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-(3-indolyl)acrylamide","","- C11 H10 N2 O -","- C11 H10 N2 O -","- C88 H80 N16 O8 -","8","1","SX1071","Leopoldo Suescun; Raúl A. Mariezcurrena; Alvaro W. Mombrú; Danilo Davyt; Eduardo Manta","3-(3-Indolyl)acrylamide","Acta Crystallographica Section C","1999","55","2","211","213","10.1107/S0108270198012505","","","0.71069","MoKα","","0.159","0.041","","","","0.132","","","","","","0.98","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008199","7.0518","0.0001","5.851","0.0001","10.3799","0.0002","90","","108.22","0.001","90","","406.803","0.012","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","silver(I) diammino-disulfito-palladat(II)","disilver(I) diamminedisulfitopalladium(II)","","- Ag2 H6 N2 O6 Pd S2 -","- Ag2 H6 N2 O6 Pd S2 -","- Ag4 H12 N4 O12 Pd2 S4 -","2","0.5","AV1026","Solovyov, Leonid A.; Blokhin, Alexander I.; Mulagaleev, Ruslan F.; Kirik, Sergei D.","Ag~2~[Pd(NH~3~)~2~(SO~3~)~2~] powder","Acta Crystallographica Section C","1999","55","3","293","296","10.1107/S0108270198012724","","","1.5418","CuKα","","","","","","","","","","1.66","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008200","7.72","0.006","13.72","0.001","15.161","0.003","63.3","0.01","88.1","0.05","86.56","0.05","1432","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Nickel(II) Thiocyanate complex of Bis( 3 - Aminopropyl) methylamine","Nickel(II) Thiocyanate complex of Bis( 3 - Aminopropyl) methylamine","","- C18 H38 N10 Ni2 S4 -","- C18 H38 N10 Ni2 S4 -","- C36 H76 N20 Ni4 S8 -","2","1","BK1416","Mukherjee, Alok K.; Nayak, Nirmalya P.; Mondal, Arunendu; Chaudhuri, Nirmalendu Ray","A dimeric form of the nickel(II) thiocyanate complex of bis(3-aminopropyl)methylamine","Acta Crystallographica Section C","1999","55","3","365","368","10.1107/S010827019801419X","","","0.71073","MoKα","","0.05","0.039","","0.099","0.095","","","","1.216","1.277","1.277","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008201","16.991","0.002","12.307","0.001","9.5","0.002","90","","107.5","0.02","90","","1894.6","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(dihydrogen phosphato-O)[(1RS,4RS,8SR,10SR)-1,4,8,10- tetraazacyclotetradecane-κ^4^N]nickel(II) monohydrate","","- C10 H30 N4 Ni O9 P2 -","- C10 H28 N4 Ni O9 P2 -","- C40 H112 N16 Ni4 O36 P8 -","4","0.5","BK1417","Namouchi-Cherni, Saoussen; Driss, Ahmed; Jouini, Tahar","Bis(dihydrogen phosphato-<i>O</i>)[(1<i>RS</i>,4<i>RS</i>,8<i>SR</i>,11<i>SR</i>)-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>]nickel(II) monohydrate","Acta Crystallographica Section C","1999","55","3","345","347","10.1107/S0108270198014620","","","0.71069","MoKα","","0.0301","0.025","","0.067","0.0638","","","","1.077","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008202","12.932","0.002","11.273","0.002","14.921","0.003","90","","100.16","0.014","90","","2141.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(μ~2~-Hydrydo)-(μ~2~-N-methylcarboxamido-C,O)-trimethylamine)- nonacarbonyl- tri-osmium","","- C14 H14 N2 O10 Os3 -","- C14 H14 N2 O10 Os3 -","- C56 H56 N8 O40 Os12 -","4","1","BK1418","Andrés Vega; Evgenia Spodine; Alejandro Arce; Jorge Manzur; Ana María García; María Teresa Garland","Nonacarbonyl-μ~2~-hydrido-μ~2~-(<i>N</i>-methylcarboxamido)-<i>C</i>:<i>O</i>-(<i>N</i>-trimethylamine)triosmium(3 <i>Os</i>—<i>Os</i>)","Acta Crystallographica Section C","1999","55","3","322","323","10.1107/S0108270198012839","","","0.71073","MoKα","","0.0659","0.0362","","0.0787","0.0671","","","","1.016","1.059","1.059","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008203","7.268","0.002","12.747","0.002","13.357","0.004","90","","90","","90","","1237.5","0.5","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5-(4-pyridyl)-5-phenylhydantoin","","- C14 H11 N3 O2 -","- C14 H11 N3 O2 -","- C56 H44 N12 O8 -","4","1","BK1423","Eknoian, Michael W.; Webb, Thomas R.; Worley, S. Davis; Braswell, Anthony; Hadley, Johnathan","5-(4-Pyridyl)-5-phenylhydantoin","Acta Crystallographica Section C","1999","55","3","405","407","10.1107/S0108270198014528","","","0.71073","MoKα","","0.0338","0.0306","","0.0784","0.076","","","","1.111","1.12","1.12","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008204","16.734","0.003","10.267","0.002","17.173","0.004","90","","110.34","0.02","90","","2766.5","1","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","dioxo-di-μ-dioxo-bis(difluoroacetato)-bis-(2,2 -bipyridine)-dimolybdenum(V)","","- C24 H22 F4 Mo2 N4 O10 -","- C24 H22 F4 Mo2 N4 O10 -","- C96 H88 F16 Mo8 N16 O40 -","4","0.5","BK1424","Webb, Thomas R.; Talbott, E. Shane","Di-μ-oxo-bis[(2,2'-bipyridine)(difluoroacetato)oxomolybdenum(V)] dihydrate","Acta Crystallographica Section C","1999","55","3","370","372","10.1107/S0108270198014206","","","0.71073","MoKα","","0.03","0.024","","0.06","0.056","","","","1.12","1.129","1.129","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008205","11.688","0.002","12.561","0.004","3.945","0.001","90","","90","","90","","579.2","0.3","296","","","","","","","","","","","5","C m m m","-C 2 2","65","","μ-4,4'-bipyridylium di-μ-bromide-mercury(II)","","- C10 H8 Br2 Hg N2 -","- C10 H8 Br2 Hg N2 -","- C20 H16 Br4 Hg2 N4 -","2","0.125","BM1222","Pan, Long; Zheng, Nengwu; Wu, Yonggang; Yu, Shichun; Huang, Xiaoying","Poly[mercury(II)-μ-4,4'-bipyridine-di-μ-bromo]","Acta Crystallographica Section C","1999","55","3","343","345","10.1107/S0108270198006325","","","0.71073","MoKα","","","0.031","","","","0.038","","","","","","1.25","","","","has coordinates","198516","2020-10-21","18:00:00",""
"2008206","9.257","0.001","10.947","0.003","11.911","0.001","96.86","0.01","108.997","0.007","96.59","0.01","1117.8","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{3-[(1-protonated-4-amino-2-methyl-5-pyrimidinyl)methyl]-5-(2-hydroxyethyl)-4- methylthiazolium}{3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-5- (2-hydroxyethyl)-4-methylthiazolium} heptaiododimercurate dihydrate","","- C24 H39 Hg2 I7 N8 O4 S2 -","- C24 H28 Hg2 I7 N8 O4 S2 -","- C24 H28 Hg2 I7 N8 O4 S2 -","1","0.5","BM1259","Hu, Ning-Hai; Liu, Yong-Sheng; Aoki, Katsuyuki","Interactions of thiamine with anions: (Hthiamine)(thiamine) heptaiododimercurate dihydrate and its dimethanol monohydrate","Acta Crystallographica Section C","1999","55","3","304","308","10.1107/S0108270198013407","","","0.71073","MoKα","","0.101","0.042","","0.147","0.108","","","","0.87","","","0.924","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008207","11.797","0.001","19.238","0.002","22.012","0.004","90","","98.57","0.01","90","","4939.9","1.1","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","{3-[(1-protonated-4-amino-2-methyl-5-pyrimidinyl)methyl]-5-(2-hydroxyethyl)-4- methylthiazolium}{3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-5- (2-hydroxyethyl)-4-methylthiazolium} heptaiododimercurate dimethanol-monohydrate","","- C26 H45 Hg2 I7 N8 O5 S2 -","- C26 H40 Hg2 I7 N8 O5 S2 -","- C104 H160 Hg8 I28 N32 O20 S8 -","4","0.5","BM1259","Hu, Ning-Hai; Liu, Yong-Sheng; Aoki, Katsuyuki","Interactions of thiamine with anions: (Hthiamine)(thiamine) heptaiododimercurate dihydrate and its dimethanol monohydrate","Acta Crystallographica Section C","1999","55","3","304","308","10.1107/S0108270198013407","","","0.71073","MoKα","","0.105","0.053","","0.161","0.131","","","","0.998","","","1.108","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008208","7.4875","0.0006","14.4756","0.0014","12.1879","0.0012","90","","92.702","0.007","90","","1319.5","0.2","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4,6-Trymethylpyridine benzoic acid","","- C15 H17 N O2 -","- C15 H17 N O2 -","- C60 H68 N4 O8 -","4","1","BM1262","Foces-Foces, C.; Llamas-Saiz, A.L.; Lorente, P; Golubev, N.S.; Limbach, H.-H.","Three 2,4,6-trimethylpyridine‒benzoic acid complexes at 150K","Acta Crystallographica Section C","1999","55","3","377","381","10.1107/S0108270198013766","","","1.5418","CuKα","","0.083","0.068","","0.103","0.091","","","","0.992","1","1","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2008209","25.732","0.003","7.8359","0.0004","13.954","0.001","90","","90","","90","","2813.6","0.4","150","","150","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,4,6-Trymethylpyridinium ortho-nitro-benzoate","","- C15 H16 N2 O4 -","- C15 H16 N2 O4 -","- C120 H128 N16 O32 -","8","1","BM1262","Foces-Foces, C.; Llamas-Saiz, A.L.; Lorente, P; Golubev, N.S.; Limbach, H.-H.","Three 2,4,6-trimethylpyridine‒benzoic acid complexes at 150K","Acta Crystallographica Section C","1999","55","3","377","381","10.1107/S0108270198013766","","","1.5418","CuKα","","0.068","0.059","","0.077","0.07","","","","0.944","0.947","0.947","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2008210","7.5078","0.0004","7.319","0.0004","27.632","0.008","90","","92.06","0.009","90","","1517.4","0.5","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4,6-Trymethylpyridinium 3,5-dinitro-benzoate","","- C15 H15 N3 O6 -","- C15 H15 N3 O6 -","- C60 H60 N12 O24 -","4","1","BM1262","Foces-Foces, C.; Llamas-Saiz, A.L.; Lorente, P; Golubev, N.S.; Limbach, H.-H.","Three 2,4,6-trimethylpyridine‒benzoic acid complexes at 150K","Acta Crystallographica Section C","1999","55","3","377","381","10.1107/S0108270198013766","","","1.5418","CuKα","","0.048","0.044","","0.054","0.052","","","","0.964","0.977","0.977","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2008211","6.834","0.001","9.672","0.001","11.317","0.001","91.72","0.01","96.56","0.01","97.27","0.01","736.41","0.15","293","2","293","2","","","","","","","","3","P -1","-P 1","2","1D1CC","4'-propen-1-ylbicyclohexyl-4-carbonitrile","","- C16 H25 N -","- C16 H25 N -","- C32 H50 N2 -","2","1","BM1266","Gupta, Sakuntala; Bhattacharyya, Kinkini; SenGupta, S.P.; Paul, Sukla; Alajos, Kalman; Laszlo, Parkanyi","A mesogenic alkenyl compound","Acta Crystallographica Section C","1999","55","3","403","405","10.1107/S0108270198013791","","","0.7107","MoKα","","0.0882","0.0445","","0.1511","0.1376","","","","1.03","1.307","1.307","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008212","11.8241","0.0005","11.8241","0.0005","19.8441","0.0011","90","","90","","120","","2402.7","0.2","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","Hexa(dimethylsulfoxide-O)nickel(II) tetraiodide(2-)","","- C12 H36 I4 Ni O6 S6 -","- C12 H36 I4 Ni O6 S6 -","- C36 H108 I12 Ni3 O18 S18 -","3","0.166667","BM1277","De-Liang Long; Huai-Ming Hu; Jiu-Tong Chen; Jin-Shun Huang","[Ni{(CH~3~)~2~SO}~6~]I~4~, a redetermination and reinterpretation","Acta Crystallographica Section C","1999","55","3","339","341","10.1107/S0108270198013055","","","0.71073","MoKα","","0.024","0.019","","0.041","0.039","","","","1.131","1.159","1.159","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008213","7.3648","0.0005","8.1825","0.0006","32.657","0.002","90","","90","","90","","1968","0.2","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)-(2S)-2-[(dimethylaminium)methyl]-1-[(5,6,7,8-tetrahydro-5-oxo-2-naphtyl) acetyl]piperidine chloride","","- C20 H29 Cl N2 O2 -","- C20 H29 Cl N2 O2 -","- C80 H116 Cl4 N8 O8 -","4","1","BM1280","Peeters, Oswald M.; Jamroz, Dorota; Norbert M. Blaton; Camiel J. De Ranter","Novel selective κ-opioid ligands","Acta Crystallographica Section C","1999","55","3","458","461","10.1107/S0108270198012736","","","1.54184","CuKα","","0.041","0.0375","","0.1208","","0.1208","","","1.136","","","1.136","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008214","7.2011","0.0008","7.63","0.0006","41.223","0.003","90","","90","","90","","2265","0.3","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)-(2S)-2-[(Methylethylaminium)methyl]-1-[(5,6,7,8-tetrahydro-5-oxo-2- naphthyl)acetyl]piperidine chloride dihydrate","","- C21 H35 Cl N2 O4 -","- C21 H35 Cl N2 O4 -","- C84 H140 Cl4 N8 O16 -","4","1","BM1280","Peeters, Oswald M.; Jamroz, Dorota; Norbert M. Blaton; Camiel J. De Ranter","Novel selective κ-opioid ligands","Acta Crystallographica Section C","1999","55","3","458","461","10.1107/S0108270198012736","","","1.54184","CuKα","","0.0819","0.05","","0.1302","","0.1302","","","1.062","","","1.062","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008215","12.2516","0.0008","13.2439","0.0009","10.1913","0.0007","90","","90.291","0.002","90","","1653.61","0.19","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2,3,4,6,7-hexahydro-10-methyl-naphtho[2,3-c]acridine","","- C22 H21 N -","- C22 H21 N -","- C88 H84 N4 -","4","1","BM1281","Jayanta Kumar Ray; Manas Kumar Haldar; Susmita Gupta; Kandasamy Chinnakali; Hoong-Kun Fun","7,8,10,11,12,13-Hexahydro-4-methylnaphtho[2,3-<i>c</i>]acridine","Acta Crystallographica Section C","1999","55","3","397","399","10.1107/S0108270198013225","","","0.71073","MoKα","","0.163","0.074","","","","0.241","","","","","","1.021","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008216","8.4793","0.0002","22.5318","0.001","9.7774","0.0003","90","","90","","90","","1868.01","0.11","293","","293","","","","","","","","","3","P n a 21","P 2c -2n","33","","Tris(2-aminobenzyl)amine","","- C21 H24 N4 -","- C21 H24 N4 -","- C84 H96 N16 -","4","1","BM1283","Foces-Foces, C.; Llamas-Saiz, A.L.; Alajarín, M.; López-Lázaro, A.; Molina, P.","Two <i>C</i>~3~-symmetrical tris(<i>ortho</i>-substituted) tribenzylamines","Acta Crystallographica Section C","1999","55","3","373","377","10.1107/S0108270198013857","","","1.5418","CuKα","","0.03","0.029","","0.031","0.03","","","","0.901","","","0.891","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008217","18.1459","0.0006","18.1459","0.0006","12.2532","0.0005","90","","90","","120","","3494.1","0.2","150","","150","","","","","","","","","7","R 3 :H","R 3","146","","N-Methyl-N,N,N-tris[2-(triethoxyphosphoranylideneamino)benzyl] ammonium","","- C40 H66 B F4 N4 O9 P3 -","- C40 H66 B F4 N4 O9 P3 -","- C120 H198 B3 F12 N12 O27 P9 -","3","0.333333","BM1283","Foces-Foces, C.; Llamas-Saiz, A.L.; Alajarín, M.; López-Lázaro, A.; Molina, P.; N-Methyl-N,N,N-tris[2-(triethoxyphosphoranylideneamino)benzyl] ammonium","Two <i>C</i>~3~-symmetrical tris(<i>ortho</i>-substituted) tribenzylamines","Acta Crystallographica Section C","1999","55","3","373","377","10.1107/S0108270198013857","","","1.5418","CuKα","","0.042","0.042","","0.048","0.048","","","","1.518","","","1.517","","","","has coordinates","207948","2020-10-21","18:00:00",""
"2008218","12.9598","0.0016","53.6","0.003","8.2907","0.0012","90","","90","","90","","5759.1","1.1","293","2","180","2","","","","","","","","4","F d d 2","F 2 -2d","43","","2-[5-(3-Bromophenyl)pyrazol-3-yl]-3-(pyrrol-2-yl)acrylonitrile","","- C16 H11 Br N4 -","- C16 H11 Br N4 -","- C256 H176 Br16 N64 -","16","1","BM1286","Kumar, A.; Parmar, V. S.; Errington, W.","(<i>E</i>)-2-[5-(3-Bromophenyl)pyrazol-3-yl]-3-(pyrrol-2-yl)acrylonitrile","Acta Crystallographica Section C","1999","55","3","456","457","10.1107/S0108270198013067","","","0.71073","MoKα","","0.0679","0.0457","","","","0.0986","","","","","","0.994","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008219","17.882","0.005","6.8049","0.0009","11.712","0.006","90","","90","","90","","1425.2","0.9","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C6 H13 Ca2 N O11 -","- C6 H13 Ca2 N O11 -","- C24 H52 Ca8 N4 O44 -","4","0.5","BM1288","Cooksey, Brian G.; Gibson, Lorraine T.; Kennedy, Alan R.; Littlejohn, David; Stewart, Lesley; Tennent, Norman H.","Dicalcium triacetate nitrate dihydrate","Acta Crystallographica Section C","1999","55","3","324","326","10.1107/S0108270198012864","","","0.71069","MoKα","","0.085","0.035","","","","0.106","","","","","","1.023","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008220","7.733","0.002","6.295","0.002","34.222","0.005","90","","95.32","0.03","90","","1658.7","0.7","143","2","143","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-(1'-N,N-dimethylaminophen-4'-yl)-3,4,4a,5,6,10,10a-heptahydroanthracen-2-one","","- C22 H25 N O -","- C22 H25 N O -","- C88 H100 N4 O4 -","4","1","BM1290","Lawrentz, Ulf; Grahn, Walter; Dix, Ina; Jones, Peter G.","Bond-length alternation in rigidized merocyanines","Acta Crystallographica Section C","1999","55","3","446","450","10.1107/S0108270198013778","","","0.71073","MoKα","","0.1311","0.0637","","0.1498","0.1177","","","","1.028","1.107","1.107","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008221","32.972","0.007","8.046","0.002","19.647","0.004","90","","122.371","0.015","90","","4402.2","1.8","143","2","143","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-dicyanomethylene-7-(2'-piperidinothien-5'-yl)-3,4,4a,5,6,10,10a- heptahydroanthracene","","- C26 H27 N3 S -","- C26 H27 N3 S -","- C208 H216 N24 S8 -","8","1","BM1290","Lawrentz, Ulf; Grahn, Walter; Dix, Ina; Jones, Peter G.","Bond-length alternation in rigidized merocyanines","Acta Crystallographica Section C","1999","55","3","446","450","10.1107/S0108270198013778","","","0.71073","MoKα","","0.1185","0.0632","","0.1452","0.1194","","","","1.026","1.096","1.096","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008222","8.2103","0.0001","25.6785","0.0006","11.6874","0.0002","90","","105.004","0.001","90","","2380.03","0.08","203","2","203","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(2'R,6'R)-1-Methoxy-4-(2""-methylprop-2""-enyloxy)-2-(4',4',6'-trimethyl- 1',3'-dioxan-2'-yl)anthraquinone","","- C26 H28 O6 -","- C26 H28 O6 -","- C104 H112 O24 -","4","2","BM1293","Cambie, Richard C.; Lorimer, Rachel M.; Rickard, Clifton E. F.; Rutledge, P. Stewart","Two dioxane derivatives of anthraquinone","Acta Crystallographica Section C","1999","55","3","436","439","10.1107/S0108270198014541","","","0.71073","MoKα","","0.06","0.043","","","","0.11","","","","","","1.051","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008223","6.793","0.0001","14.0076","0.0002","22.277","0.0001","90","","90","","90","","2119.74","0.04","203","2","203","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(2'R,6'R)-4-Hydroxy-3-(2""methylprop-2""-enyloxo)-2-(4',4',6'-trimethyl- 1',3'-dioxan-2'-yl)anthraquinone.","","- C25 H26 O5 -","- C25 H26 O5 -","- C100 H104 O20 -","4","1","BM1293","Cambie, Richard C.; Lorimer, Rachel M.; Rickard, Clifton E. F.; Rutledge, P. Stewart","Two dioxane derivatives of anthraquinone","Acta Crystallographica Section C","1999","55","3","436","439","10.1107/S0108270198014541","","","0.71073","MoKα","","0.044","0.034","","","","0.086","","","","","","1.035","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008224","14.984","0.008","14.437","0.005","25.361","0.009","90","0.02","107.39","0.03","90","0.03","5235","4","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquanonaphenyltristiboxane diperchlorate","","- C54 H49 Cl2 O12 Sb3 -","- C54 H49 Cl2 O12 Sb3 -","- C216 H196 Cl8 O48 Sb12 -","4","0.5","BM1295","Baker, L-J; Rickard, Clifton E. F.; Taylor, Michael J.","Diaquanonaphenyltristiboxane diperchlorate","Acta Crystallographica Section C","1999","55","3","335","337","10.1107/S0108270198014632","","","0.71069","MoKα","","0.051","0.034","","","","0.098","","","","","","1.052","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008225","10.2981","0.0008","10.8896","0.0009","12.1733","0.0007","90","","90","","90","","1365.14","0.17","294","1","294","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2S,4S,5R)-(-)-2-(1,3-thiazol-2-yl)-3,4-dimethyl-5-phenyl-1,3-oxazolidine","","- C14 H16 N2 O S -","- C14 H16 N2 O S -","- C56 H64 N8 O4 S4 -","4","1","BM1296","Fitzsimons, Lavelle M.; Gallagher, John F.","Intermolecular C—H···N and C—H···O interactions in (2<i>S</i>,4<i>S</i>,5<i>R</i>)-(‒)-3,4-dimethyl-5-phenyl-2-(1,3-thiazol-2-yl)-1,3-oxazolidine","Acta Crystallographica Section C","1999","55","3","472","474","10.1107/S0108270198014103","","","0.7107","MolybdenumKα","","0.0434","0.0347","","","","0.0905","","","","","","1.024","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008226","10.422","0.005","10.422","0.005","7.467","0.003","90","","90","","120","","702.4","0.6","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","pentalead tris(vanadate) iodide","","","- I1.7 O24 Pb9.85 V6 -","- I1.704 O24 Pb9.844 V6 -","- I1.704 O24 Pb9.844 V6 -","1","0.0833333","BR1208","Fabienne Audubert; Jean-Michel Savariault; Jean-Louis Lacout","Pentalead tris(vanadate) iodide, a defect vanadinite-type compound","Acta Crystallographica Section C","1999","55","3","271","273","10.1107/S0108270198005034","","","0.71073","MoKα","","0.0526","0.0364","","","0.0783","0.0705","","","","","","0.834","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008227","15.181","0.009","5.0319","0.0008","20.76","0.004","90","","109.07","0.03","90","","1498.8","1","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","sodium vanadate","","- Na4.5 O17.5 V7 -","- Na4.5 O17.5 V7 -","- Na18 O70 V28 -","4","1","BR1224","Millet, Patrice; Henry, Jean-Yves; Galy, Jean","The vanadium oxide bronze η-Na~<i>x~</i>V~2~O~5~ (<i>x</i> = 1.286)","Acta Crystallographica Section C","1999","55","3","276","279","10.1107/S010827019801587X","","","0.71069","MoKα","","0.106","0.045","","0.127","0.112","","","","0.963","1.176","1.176","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008228","17.38","0.003","11.6","0.002","13.418","0.003","90","","110.92","0.03","90","","2526.9","1","292","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H21 Co N7 O6 -","- C27 H21 Co N7 O6 -","- C108 H84 Co4 N28 O24 -","4","0.5","CF1249","Fu, You-Jun; Gao, Zhang-Shou; Yang, Hao; Dai, Wenning; Wang, Defen; Hu, Hongwen; Tang, Wenxia; Zhang, Zeying; Mak, Thomas C.W.","A monohelical cobalt(II) complex of a quinquepyridine ligand","Acta Crystallographica Section C","1999","55","3","349","351","10.1107/S0108270198013651","","","0.71073","MoKα","","","0.054","","","0.061","","","","","1.25","1.25","","","","","has coordinates","198476","2020-10-21","18:00:00",""
"2008229","7.7544","0.0002","31.6493","0.001","13.2174","0.0004","90","","93.004","0.001","90","","3239.37","0.16","150","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(saccharinato)aquabis(2,2'-bipyridene)manganese(II)saccharinate","","- C34 H26 Mn N6 O7 S2 -","- C34 H26 Mn N6 O7 S2 -","- C136 H104 Mn4 N24 O28 S8 -","4","1","CF1256","Dillon, Keith B.; Bilton, Clair; Howard, Judith A. K.; Hoy, Vanessa J.; Deng, Robert M. K.; Sethatho, David T.","The first manganese(II) compound with the saccharinate ligand present both in the complex cation and as the counter-ion: [Mn(bipy)~2~(sac)(H~2~O)]^+^^.^sac^{-^}","Acta Crystallographica Section C","1999","55","3","330","332","10.1107/S0108270198013663","","","0.71073","MoKα","","","0.048","","","0.079","0.105","","","","1.065","1.065","1.064","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008230","16.5433","0.0004","16.4583","0.0005","12.3847","0.0002","90.0107","0.0003","103.965","0.001","90.0089","0.0011","3272.37","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-dicyano-4-thiodiphenylaminobenzene","","- C20 H11 N3 S -","- C20 H11 N3 S -","- C160 H88 N24 S8 -","8","2","CF1257","Sema Öztürk; Şamil Işık; Hoong-Kun Fun; Engin Kendi; Erbil Ag̃ar; Selami Şaşmaz; Abdul Razak İbrahim","4-(Phenothiazin-10-yl)benzene-1,2-dicarbonitrile","Acta Crystallographica Section C","1999","55","3","395","397","10.1107/S0108270198012347","","","0.71073","MoKα","","0.0515","0.036","","0.0949","0.0856","","","","1.034","1.071","1.071","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008231","8.735","0.002","9.093","0.002","15.64","0.003","82.94","0.03","85.85","0.02","81.76","0.02","1218.2","0.5","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Sodium Aquo(1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetato)holmium(III) Tetrahydrate.","","- C16 H34 Ho N4 Na O13 -","- C16 H34 Ho N4 Na O13 -","- C32 H68 Ho2 N8 Na2 O26 -","2","1","CF1277","Benetollo, Franco; Bombieri, Gabriella; Aime, Silvio; Botta, Mauro","A holmium complex of a macrocyclic ligand (DOTA) and its isostructural europium analogue","Acta Crystallographica Section C","1999","55","3","353","356","10.1107/S0108270198014450","","","0.71073","MoKα","","0.024","0.024","","0.061","0.061","","","","1.069","1.069","1.069","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008232","8.734","0.002","9.116","0.003","15.773","0.003","82.83","0.03","85.34","0.03","81.43","0.02","1229.6","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Sodium Aquo(1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetato)europium(III) Tetrahydrate.","","- C16 H34 Eu N4 Na O13 -","- C16 H34 Eu N4 Na O13 -","- C32 H68 Eu2 N8 Na2 O26 -","2","1","CF1277","Benetollo, Franco; Bombieri, Gabriella; Aime, Silvio; Botta, Mauro","A holmium complex of a macrocyclic ligand (DOTA) and its isostructural europium analogue","Acta Crystallographica Section C","1999","55","3","353","356","10.1107/S0108270198014450","","","0.71073","MoKα","","0.019","0.019","","0.052","0.051","","","","1.109","1.109","1.109","","","","","has coordinates","199684","2020-10-21","18:00:00",""
"2008233","30.968","0.002","6.003","0.002","11.394","0.002","90","","107.26","0.01","90","","2022.8","0.8","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","Z-Proψ[CO-N(NH2)]-Ala-NH^i^Pr","","","- C19 H28 N4 O4 -","- C19 H28 N4 O4 -","- C76 H112 N16 O16 -","4","1","CF1278","Aubry, Andre; Del Duca, Valerio; Pedone, Carlo; Zerkout, Said; Marraud, Michel","Dipeptide (<i>Z</i>)-Pro-ψ[CO-N(NH~2~)]-Ala-NH^<i>i^</i>Pr","Acta Crystallographica Section C","1999","55","3","439","441","10.1107/S0108270198013675","","","1.5418","CuKα","","0.0925","0.0543","","0.1588","0.1163","","","","0.971","1.078","1.078","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008234","9.3761","0.0006","9.4407","0.0005","10.7822","0.0006","71.424","0.003","87.87","0.01","67.852","0.003","834.18","0.09","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","trans-Diiodobis(triphenylphosphine)palladium(II)","","- C36 H30 I2 P2 Pd -","- C36 H30 I2 P2 Pd -","- C36 H30 I2 P2 Pd -","1","0.5","CF1284","Cave, Gareth W. V.; Errington, William; Rourke, Jonathan P.","<i>trans</i>-Diiodobis(triphenylphosphine)palladium(II)","Acta Crystallographica Section C","1999","55","3","320","322","10.1107/S0108270198015868","","","0.71073","MoKα","","0.047","0.034","","","","0.094","","","","","","1.012","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008235","11.173","0.004","7.324","0.005","12.024","0.008","90","","97.82","0.04","90","","974.8","1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Homolycorine Hydrochloride dihydrate","(1S,5S,4aR,10bS)-8,9-diethoxy-N-methyl-(2)benzopyran(3,4-g)indolin-6-one","","- C18 H26 Cl N O6 -","- C18 H24 Cl N O6 -","- C36 H48 Cl2 N2 O12 -","2","1","CF1288","Francesc Viladomat; Jaume Bastida; Carles Codina; Xavier Solans; 'Mercè Font-Bardia","Homolycorine hydrochloride dihydrate","Acta Crystallographica Section C","1999","55","3","385","387","10.1107/S0108270198014644","","","0.71069","MoKα","","0.0439","0.0329","","","","0.0568","","","","","","0.875","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008236","15.018","0.005","18.383","0.004","14.671","0.007","98.91","0.03","117.43","0.03","97.21","0.02","3461","2","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","1-chloro-1-hydrido-2,6-di(2-hydroxyethoxy)-1,3,5-tris(triphenylphosphine)- iso-closo-1-ruthenadecaborane‒trichloromethane (1:1.2)","","- C59.2 H62.2 B9 Cl4.6 O4 P3 Ru -","- C59.2 H62.2 B9 Cl4.6 O4 P3 Ru -","- C118.4 H124.4 B18 Cl9.2 O8 P6 Ru2 -","2","1","DA1032","Hai-Jun Yao; Chun-Hua Hu; Jian-Min Dou; Jie Sun; Jing-De Wei; Ruo-Shui Jin; Zu-En Huang; Pei-Ju Zheng","A degraded glycol-substituted <i>iso</i>-<i>closo</i> ten-vertex ruthenaborane: [(PPh~3~)HClRuB~9~H~5~(OCH~2~CH~2~OH)~2~(PPh~3~)~2~]^.^1.2CHCl~3~","Acta Crystallographica Section C","1999","55","3","337","339","10.1107/S0108270198013237","","","0.71069","MoKα","","0.17","0.07","","","","0.242","","","","","","1.052","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008237","9.027","0.001","11.095","0.003","7.275","0.002","106.23","0.02","108.02","0.02","78.09","0.02","659.5","0.3","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H32 Co N2 O10 -","- C24 H32 Co N2 O10 -","- C24 H32 Co N2 O10 -","1","0.5","DA1034","Okabe, Nobuo; Makino, Tomomi","<i>trans</i>-Diaquabis(quinoline-2-carboxylato-<i>N</i>,<i>O</i>)cobalt(II)‒water‒ethanol (1/2/2)","Acta Crystallographica Section C","1999","55","3","300","302","10.1107/S0108270198013584","","","0.71069","MoKα","","","0.063","","","0.097","","","","","1.5","1.5","","","","","has coordinates","189124","2020-10-21","18:00:00",""
"2008238","10.735","0.002","13.31","0.002","5.205","0.001","90","","90","","90","","743.7","0.2","296","","","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C12 H14 Co N4 O6 -","- C12 H14 Co N4 O6 -","- C24 H28 Co2 N8 O12 -","2","0.5","DA1037","Okabe, Nobuo; Adachi, Yukari","Bis[2-hydroxy-3-(1<i>H</i>-imidazol-4-yl)propionato]cobalt(II)","Acta Crystallographica Section C","1999","55","3","302","304","10.1107/S0108270198013614","","","0.71069","MoKα","","","0.032","","","0.048","","","","","1.25","1.25","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008239","4.906","0.003","14.838","0.005","19.488","0.003","90","","90","","90","","1418.6","1","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-(4-hydroxy-5-hydroxymethyltetrahydrofuran-2-yl)-5-methoxymethyl- 4-dimethylamino-(1H)-pyrimidin-2-one","","- C13 H21 N3 O5 -","- C13 H21 N3 O5 -","- C52 H84 N12 O20 -","4","1","DA1046","Audette, Gerald F.; Zoghaib, Wajdi M.; Gupta, Sagar V.; Quail, J. Wilson; Delbaere, Louis T. J.","<i>N</i>,<i>N</i>-Dimethyl-5-methoxymethyl-2'-deoxycytidine","Acta Crystallographica Section C","1999","55","3","427","430","10.1107/S0108270198013249","","","0.7093","MoKα","","0.046","0.037","","","","0.09","","","","","","1.065","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008240","6.5429","0.0008","9.0345","0.0009","23.894","0.004","90","0.011","90","0.011","90","0.01","1412.4","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Equilin","3-Hydroxyestra-1,3,5(10),7-tetraen-17-one","","- C18 H20 O2 -","- C18 H20 O2 -","- C72 H80 O8 -","4","1","DA1048","Sawicki, Mark W.; Li, Naiyin; Ghosh, Debashis","Equilin","Acta Crystallographica Section C","1999","55","3","425","427","10.1107/S0108270198013250","","","1.54178","CuKα","","0.052","0.05","","","","0.134","","","","","","1.071","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008241","10.115","0.003","10.757","0.004","30.986","0.004","90","","96.24","0.02","90","","3351.5","1.7","297","","297","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H50 Cl8 Cu2 N2 O18 -","- C62 H50 Cl8 Cu2 N2 O18 -","- C124 H100 Cl16 Cu4 N4 O36 -","2","0.5","DA1053","Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Noguchi, Masakazu; Tokii, Tadashi","A dimeric copper(II) bis(4-chlorophenoxy)acetate adduct with dimethylformamide","Acta Crystallographica Section C","1999","55","3","316","318","10.1107/S0108270198014899","","","0.71073","MoKα","","0.065","0.059","","","","0.062","","","","","","1.795","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008242","8.045","0.002","8.937","0.002","26.773","0.003","90","0.01","90","0.01","90","0.02","1924.9","0.7","293","2","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","5'-(toluenesulfonyl)adenosine","","- C17 H19 N5 O6 S -","- C17 H19 N5 O6 S -","- C68 H76 N20 O24 S4 -","4","1","DE1093","D. Prahadeeswaran; T. Parthasarathy Seshadri","5'-<i>O</i>-(Toluenesulfonyl)adenosine","Acta Crystallographica Section C","1999","55","3","389","391","10.1107/S0108270198013262","","","1.5418","CuKα","","0.055","0.039","","0.129","0.115","","","","1.032","1.049","1.049","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008243","4.851","0.002","13.535","0.003","14.013","0.005","90","","97.28","0.01","90","","912.7","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N^4^Anisoylcytidine Dihydrate","","- C17 H23 N3 O9 -","- C17 H23 N3 O9 -","- C34 H46 N6 O18 -","2","1","DE1095","S. Kolappan; T. P. Seshadri","<i>N</i>^4^-Anisoylcytidine dihydrate","Acta Crystallographica Section C","1999","55","3","391","392","10.1107/S0108270198013274","","","1.5418","CuKα","","0.049","0.042","","0.132","0.117","","","","1.051","1.062","1.062","","","","","has coordinates,has Fobs","203508","2020-10-21","18:00:00",""
"2008244","16.239","0.003","11.717","0.003","11.627","0.004","90","","93.69","0.02","90","","2207.7","1","298.2","","298.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Troglitazone","5-{4-[(4a,5,6,7,8,8a-hexahydro-6-hydroxy-2,5,7,8-tetramethylchroman-2- yl)methyloxy]benzyl}thiazolidine-2,4-dione","","- C24 H27 N O5 S -","- C24 H27 N O5 S -","- C96 H108 N4 O20 S4 -","4","1","DE1099","K. Vyas; A. Sivalakshmidevi; C. Prabhakar; G. Om Reddy","Troglitazone, an euglycemic antidiabetic drug","Acta Crystallographica Section C","1999","55","3","411","413","10.1107/S010827019801467X","","","1.5418","CuKα","","0.092","0.062","","0.058","","0.056","","","1.828","","","2.039","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008245","29.501","0.002","8.5509","0.0014","7.963","0.003","90","","101.15","0.02","90","","1970.8","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(méta-anisidinium) Dihydrogénodiphosphate","","- C14 H22 N2 O9 P2 -","- C14 H22 N2 O9 P2 -","- C56 H88 N8 O36 P8 -","4","0.5","DU1178","Ould Abdellahi, Mohamed; Ben Amor, Fatma; Driss, Ahmed; Jouini, Tahar","Bis(<i>m</i>-anisidinium) dihydrogénodiphosphate","Acta Crystallographica Section C","1999","55","3","474","476","10.1107/S010827019801155X","","","0.71069","MoKα","","0.0899","0.0516","","0.1296","0.1107","","","","1.058","1.145","1.145","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008246","14.5297","0.0016","8.2314","0.0014","14.3684","0.0018","90","","90","","90","","1718.5","0.4","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C14 H16 Cl2 N2 Ni S2 -","- C14 H16 Cl2 N2 Ni S2 -","- C56 H64 Cl8 N8 Ni4 S8 -","4","0.5","FG1490","Thangarasu Pandiyan; Bernès, Sylvain; Durán de Bazúa, Carmen","Dichloro[2,2'-(2,5-dithiahexamethylene)dipyridine-<i>N</i>,<i>N</i>',<i>S</i>,<i>S</i>']nickel(II)","Acta Crystallographica Section C","1999","55","3","318","320","10.1107/S010827019801422X","","","0.71073","MoKα","","0.0445","0.03","","","0.0641","0.0694","","","","","","1.013","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008247","11.009","0.002","5.949","0.001","14.466","0.003","90","","105.66","0.01","90","","912.2","0.3","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H13 N O3 -","- C9 H13 N O3 -","- C36 H52 N4 O12 -","4","1","FG1506","Zukerman-Schpector, J.; Biaggio, Francisco C.; Rufino, Alessandra R.; Caracelli, I.","Two new spiro lactam-lactones","Acta Crystallographica Section C","1999","55","3","416","419","10.1107/S0108270198010403","","","0.71073","MoKα","","0.1783","0.074","","0.2297","","0.163","","","1.029","","","1.026","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008248","9.991","0.001","10.098","0.001","10.576","0.001","90","","108.98","0.01","90","","1008.99","0.18","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H15 N O3 -","- C10 H15 N O3 -","- C40 H60 N4 O12 -","4","1","FG1506","Zukerman-Schpector, J.; Biaggio, Francisco C.; Rufino, Alessandra R.; Caracelli, I.","Two new spiro lactam-lactones","Acta Crystallographica Section C","1999","55","3","416","419","10.1107/S0108270198010403","","","0.71073","MoKα","","0.1631","0.047","","0.1326","","0.104","","","0.97","","","0.97","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008249","6.9403","0.0005","9.948","0.0007","9.5931","0.0007","90","","90","","90","","662.33","0.08","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C4 H6 O6 Pb -","- C4 H6 O6 Pb -","- C16 H24 O24 Pb4 -","4","0.5","FG1511","Norberg, Stefan; Svensson, Göran; Albertsson, Jörgen","Lead(II) oxydiacetate hydrate","Acta Crystallographica Section C","1999","55","3","356","358","10.1107/S0108270198014115","","","0.71073","MoKα","","0.061","0.044","","0.129","","0.112","","","1.158","","","1.197","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"2008250","10.458","0.002","7.619","0.002","13.28","0.002","90","","91.94","0.01","90","","1057.5","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","(+)-3-Oxo-5α-cholan-24-oic Acid","(+)-3-Oxo-5α-cholan-24-oic Acid","","- C24 H38 O3 -","- C24 H38 O3 -","- C48 H76 O6 -","2","1","FG1512","Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","(+)-3-Oxo-5α-cholan-24-oic acid: catemeric hydrogen bonding in a steroidal keto acid","Acta Crystallographica Section C","1999","55","3","419","422","10.1107/S0108270198012931","","","0.71073","MoKα","","0.069","0.046","","0.122","0.101","","","","1.07","1.1","1.1","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008251","11.401","0.001","14.698","0.002","5.0903","0.0006","90","","94.53","0.009","90","","850.33","0.17","293","2","288","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-hydroxyethyl-2,2'-biimidazole","","- C8 H10 N4 O -","- C8 H10 N4 O -","- C32 H40 N16 O4 -","4","1","FG1514","Lin, Geng; Collier, Harvest; Baughman, Russell G.","1-Hydroxyethyl-2,2'-biimidazole","Acta Crystallographica Section C","1999","55","3","476","478","10.1107/S0108270198017387","","","0.71073","MoKα","","0.063","0.04","","0.113","0.095","","","","1.012","1.075","1.075","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008252","7.579","0.002","17.55","0.002","11.111","0.005","90","","90","","90","","1477.9","0.8","296","","296","","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C8 H20 N6 Ni S2 -","- C8 H20 N6 Ni S2 -","- C32 H80 N24 Ni4 S8 -","4","0.5","FR1148","Moore, Stephanie L.; Philip J. Squattrito","Bis(1,3-propanediamine-<i>N</i>,<i>N</i>')bis(thiocyanato-<i>N</i>)nickel(II)","Acta Crystallographica Section C","1999","55","3","332","334","10.1107/S0108270198013419","","","0.7107","MoKα","","","0.04","","","","0.05","","","","","","2.12","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008253","8.817","0.002","9.872","0.002","13.672","0.003","90","","90","","90","","1190","0.4","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Idazoxan hydrobromide","2-(1,4-benzodioxan-2-yl)imidazolinium bromide","","- C11 H13 Br N2 O2 -","- C11 H13 Br N2 O2 -","- C44 H52 Br4 N8 O8 -","4","1","FR1149","Brunel, Serge; Maurel, Jean Louis; Ribet, Jean Paul; Monconduit, Laure; Tillard, Monique; Belin, Claude","Absolute configuration of 2-(1,4-benzodioxan-2-yl)imidazolinium bromide","Acta Crystallographica Section C","1999","55","3","441","443","10.1107/S0108270198013286","","","0.71073","MoKα","","0.08","0.036","","","","0.089","","","","","","0.959","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008254","9.871","0.002","11.044","0.002","13.117","0.003","87.403","0.008","89.625","0.004","67.3872","0.0011","1318.6","0.5","180","","180","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H15 N3 S2 -","- C12 H15 N3 S2 -","- C48 H60 N12 S8 -","4","2","FR1159","John S. Davidson; Steven J. Rettig; James Trotter","Fromm's methylphenyldithiodimethylketuret","Acta Crystallographica Section C","1999","55","3","434","436","10.1107/S0108270198013432","","","0.71069","MoKα","","0.1182","0.04","","0.0768","0.077","","","","1.02","","","1.02","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008255","12.8953","0.0017","10.0927","0.0011","14.413","0.002","90","","106.638","0.012","90","","1797.2","0.4","153","2","153","2","","","","","","","","6","P 1 21 1","P 2yb","4","paroxetine hydrochloride hemihydrate","","","- C19 H22 Cl F N O3.5 -","- C19 H22 Cl F N O3.5 -","- C76 H88 Cl4 F4 N4 O14 -","4","2","","Ibers, James A.","Paroxetine hydrochloride hemihydrate","Acta Crystallographica Section C","1999","55","3","432","434","10.1107/S0108270198013444","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2008256","8.7931","0.0005","9.2891","0.0004","13.2423","0.0009","89.657","0.004","73.646","0.007","82.804","0.005","1029.21","0.11","291","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H21 F6 Na O7 -","- C15 H21 F6 Na O7 -","- C30 H42 F12 Na2 O14 -","2","1","GD1004","Farrugia, Louis J.; Watson, Ian M.","(1,1,1,5,5,5-Hexafluoro-2,4-pentanedionato-<i>O</i>,<i>O</i>')(1,4,7,10,13-pentaoxapentadecane-κ^5^<i>O</i>)sodium","Acta Crystallographica Section C","1999","55","3","326","328","10.1107/S0108270198013031","","","0.71073","MoKα","","","0.055","","","","0.175","","","","","","1.045","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008257","20.43","0.004","5.591","0.004","5.288","0.0006","90","","93.26","0.01","90","","603","0.5","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Nitrate d'Argent et de Césium: AgCs(NO~3~)~2~","","- Ag Cs N2 O6 -","- Ag Cs N2 O6 -","- Ag4 Cs4 N8 O24 -","4","0.5","GS1014","Ben Amor, Fatma; Hellali, Dalila; Zamali, Hmida","Nitrate d'argent et de césium: AgCs(NO~3~)~2~","Acta Crystallographica Section C","1999","55","3","281","282","10.1107/S0108270198013304","","","0.71069","MoKα","","0.045","0.043","","0.129","0.128","","","","1.265","1.29","1.29","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008258","10.9742","0.0007","14.467","0.001","6.731","0.001","90","","104.28","0.01","90","","1035.62","0.19","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Nickel potassium arsenate.","","- As6 K4 Ni7 O24 -","- As6 K4 Ni7 O24 -","- As12 K8 Ni14 O48 -","2","0.25","GS1015","Ben Smail, Ridha; Driss, Ahmed; Jouini, Tahar","K~4~Ni~7~(AsO~4~)~6~","Acta Crystallographica Section C","1999","55","3","284","286","10.1107/S0108270198012293","","","0.71069","MoKα","","0.0379","0.0339","","0.0812","0.0798","","","","1.264","1.306","1.306","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008259","11.992","0.003","15.932","0.002","7.222","0.002","90","","90","","90","","1379.8","0.5","293","","293","","","","","","","","","4","F d d 2","F 2 -2d","43","Strontium vanadium monophosphate","","","- O10 P2 Sr V2 -","- O10 P2 Sr V2 -","- O80 P16 Sr8 V16 -","8","0.5","GS1016","Berrah, Fadila; Leclaire, André; Borel, Marie-Madeleine; Guesdon, Anne; Raveau, Bernard","A new vanadium(IV) monophosphate, Sr(VO)~2~(PO~4~)~2~, isotypic with Ca(VO)~2~(PO~4~)~2~","Acta Crystallographica Section C","1999","55","3","288","291","10.1107/S0108270198012372","","","0.71073","Mo_Kα","","0.042","0.042","","0.041","0.041","","","","2.454","2.454","2.454","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008260","25.867","0.002","17.085","0.002","20.363","0.003","90","","106.328","0.002","90","","8636.2","1.8","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C51 H53 N3 O9 -","- C51 H53 N3 O9 -","- C408 H424 N24 O72 -","8","2","GS1018","Thuéry, Pierre; Nierlich, Martine; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques","A 2,2'-azobenzene-substituted calix[4]arene-crown-6","Acta Crystallographica Section C","1999","55","3","443","445","10.1107/S0108270198013882","","","0.71073","MoKα","","","0.0591","","0.1638","0.1015","","","","0.822","1.042","1.042","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008261","7.7385","0.0012","12.199","0.003","20.667","0.002","90","","99.735","0.018","90","","1922.9","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-ethyl-2,3-dihydro-4H-pyrido[3,2-e]-1,2,4-thiadiazine 1,1-dioxide","","- C8 H11 N3 O2 S -","- C8 H11 N3 O2 S -","- C64 H88 N24 O16 S8 -","8","2","GS1021","Dupont, Léon; Pirotte, Bernard; Podona, Tchao; Diouf, Ousmane; Delarge, Jacques; De Tullio, Pascal","4-Ethyl-2,3-dihydro-4<i>H</i>-pyrido[3,2-<i>e</i>]-1,2,4-thiadiazine 1,1-dioxide and 4-ethyl-2,3-dihydro-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-dioxide","Acta Crystallographica Section C","1999","55","3","461","464","10.1107/S0108270198013894","","","1.5418","CuKα","","0.0852","0.0453","","","","0.1317","","","","","","0.943","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008262","8.1628","0.0004","11.6259","0.0008","10.2405","0.0011","90","","97.841","0.007","90","","962.74","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-ethyl-2,3-dihydro-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-dioxide","","- C8 H11 N3 O2 S -","- C8 H11 N3 O2 S -","- C32 H44 N12 O8 S4 -","4","1","GS1021","Dupont, Léon; Pirotte, Bernard; Podona, Tchao; Diouf, Ousmane; Delarge, Jacques; De Tullio, Pascal","4-Ethyl-2,3-dihydro-4<i>H</i>-pyrido[3,2-<i>e</i>]-1,2,4-thiadiazine 1,1-dioxide and 4-ethyl-2,3-dihydro-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-dioxide","Acta Crystallographica Section C","1999","55","3","461","464","10.1107/S0108270198013894","","","1.5418","CuKα","","0.0463","0.0382","","","","0.1064","","","","","","1.06","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008263","10.313","0.004","11.871","0.002","12.713","0.002","90","","90","","90","","1556.4","0.7","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2(S)-7-methoxy-2-(3-(R)-4,5-dihydro-4,4-dimethyl-3H-2-oxo-3-oxicarbonyl)- 2,3-dihydro-1,4-benzodioxin","","- C16 H18 O7 -","- C16 H18 O7 -","- C64 H72 O28 -","4","1","GS1024","Mostafa Khouili; M. Dolors Pujol; Xavier Solans; Mercè Font-Bardia; Abdelaman Souizi; Gerard Coudert; Gerald Guillaumet","(3<i>R</i>)-4,4-Dimethyl-2-oxotetrahydrofuran-3-yl (<i>2S</i>)-7-methoxy-2,3-dihydro-1,4-benzodioxin-2-carboxylate","Acta Crystallographica Section C","1999","55","3","387","389","10.1107/S0108270198013900","","","0.71069","MoKα","","0.0631","0.0536","","","","0.152","","","","","","1.049","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008264","14.618","0.003","9.323","0.002","25.766","0.005","90","","99.31","0.03","90","","3465.2","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Acetato-O,O')-(acetato-O)-(2,9-dimethyl-1,10-phenanthroline) zinc(ii)","","- C18 H18 N2 O4 Zn -","- C18 H18 N2 O4 Zn -","- C144 H144 N16 O32 Zn8 -","8","1","HA1237","Harvey, Miguel; Baggio, Sergio; Baggio, Ricardo; Mombrú, Alvaro W.","(Acetato-<i>O</i>,<i>O</i>')(acetato-<i>O</i>)(2,9-dimethyl-1,10-phenanthroline-<i>N</i>,<i>N</i>')zinc(II)","Acta Crystallographica Section C","1999","55","3","308","310","10.1107/S0108270198013481","","","0.71073","MoKα","","0.083","0.037","","","","0.121","","","","","","1.015","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008265","9.034","0.002","10.155","0.001","12.368","0.002","110.35","0.01","89.9","0.02","103.02","0.01","1032.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","6-[N-(2-Hydroxyphenyl)aminomethylene]cyclohexa-2,4-dien-1-one","6-[N-(2-Hydroxyphenyl)aminomethylene]cyclohexa-2,4-dien-1-one","","- C13 H11 N O2 -","- C13 H11 N O2 -","- C52 H44 N4 O8 -","4","2","HA1241","Alok K. Mukherjee; Rajib Lal De; Indrajit Banerjee; Chitra Samanta; Nirmalya P. Nayak","6-[<i>N</i>-(2-Hydroxyphenyl)aminomethylene]cyclohexa-2,4-dien-1-one","Acta Crystallographica Section C","1999","55","3","407","410","10.1107/S0108270198013912","","","1.5418","CuKα","","0.0574","0.0499","","0.1316","0.1248","","","","1.053","1.087","1.087","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008266","4.5686","0.0001","15.7687","0.0002","20.1621","0.0004","90","","90","","90","","1452.5","0.05","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","2-Aminopyrimidine and p-phenylenediacetic acid","","- C14 H15 N3 O4 -","- C14 H15 N3 O4 -","- C56 H60 N12 O16 -","4","0.5","HA1242","Kandasamy Chinnakali; Hoong-Kun Fun; Shyamaprasad Goswami; Ajit Kumar Mahapatra; Gur Dayal Nigam","2-Aminopyrimidine and <i>p</i>-phenylenediacetic acid (1:1) co-crystal","Acta Crystallographica Section C","1999","55","3","399","401","10.1107/S0108270198013626","","","0.71073","MoKα","","0.116","0.059","","","","0.161","","","","","","1.084","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008267","12.225","0.002","13.29","0.003","12.387","0.003","90","","90","","90","","2012.5","0.7","180","2","180","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Trimethylphosphonium trichlorogermanate(II)","Trimethylphosphonium trichlorogermanate(II)","","- C3 H10 Cl3 Ge P -","- C3 H10 Cl3 Ge P -","- C24 H80 Cl24 Ge8 P8 -","8","1","JZ1290","Gabriele Kociok-Köhn; Johannes G. Winter; Alexander C. Filippou","Trimethylphosphonium trichlorogermanate(II)","Acta Crystallographica Section C","1999","55","3","351","353","10.1107/S010827019801169X","","","0.71073","MoKα","","0.0365","0.0307","","","","0.0845","","","","","","1.044","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008268","9.674","0.002","8.482","0.002","17.446","0.004","90","","104.81","0.02","90","","1384","0.6","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(3,7-diethyl-3,7-diazanonane-1,9-dithiolato-S,N,N'S')nickel(II)","","- C11 H24 N2 Ni S2 -","- C11 H24 N2 Ni S2 -","- C44 H96 N8 Ni4 S8 -","4","1","JZ1315","Jörg Schneider; Ralf Hauptmann; Frank Osterloh; Gerald Henkel","(3,7-Diethyl-3,7-diazanonane-1,9-dithiolato-<i>S</i>,<i>N</i>,<i>N</i>',<i>S</i>')nickel(II)","Acta Crystallographica Section C","1999","55","3","328","330","10.1107/S0108270198012578","","","0.71073","MoKα","","","0.024","","","","0.058","","","","1.086","1.086","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008269","9.304","0.002","10.9792","0.0013","13.685","0.003","107.896","0.01","107.812","0.014","96.383","0.011","1233.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(triphenylphosphine)-1κP,2κP-dicopper(I) Di(triphenylphosphine) Diquinoline Bis(μ-Iodine) Dicopper","","- C54 H44 Cu2 I2 N2 P2 -","- C54 H44 Cu2 I2 N2 P2 -","- C54 H44 Cu2 I2 N2 P2 -","1","0.5","JZ1317","Jin, Qiong-Hua; Wang, Yu-Xian; Xin, Xiu-Lan","Di-μ-iodo-1:2κ^4^<i>I</i>-bis(quinoline)-1κ<i>N</i>,2κ<i>N</i>-bis(triphenylphosphine)-1κ<i>P</i>,2κ<i>P</i>-dicopper(I)","Acta Crystallographica Section C","1999","55","3","341","343","10.1107/S010827019801333X","","","0.71073","MoKα","","","0.029","","","","0.065","","","","","","1.023","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008270","8.8005","0.0003","11.1","0.0005","11.628","0.0005","89.746","0.002","69.678","0.003","75.414","0.003","1026.53","0.08","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H17 Gd N6 O12 -","- C15 H17 Gd N6 O12 -","- C30 H34 Gd2 N12 O24 -","2","1","JZ1321","Leverd, Pascal C.; Charbonnel, Marie-Christine; Dognon, Jean-Pierre; Lance, Monique; Nierlich, Martine","Triaquabis(nitrato-<i>O</i>,<i>O</i>')(2,2':6',2''-terpyridine-κ^3^<i>N</i>)gadolinium(III) nitrate","Acta Crystallographica Section C","1999","55","3","368","370","10.1107/S0108270198013316","","","0.71073","MoKα","","0.033","0.027","","0.07","0.062","","","","0.963","0.972","0.972","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008271","13.59","0.002","6.581","0.0011","9.9321","0.0014","90","","90","","90","","888.3","0.2","293","2","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Guanine dihydrochloride","","- C5 H7 Cl2 N5 O -","- C5 H7 Cl2 N5 O -","- C20 H28 Cl8 N20 O4 -","4","0.5","JZ1324","Matković-Čalogović, Dubravka; Sanković, Krešimir","Guaninium dichloride","Acta Crystallographica Section C","1999","55","3","467","469","10.1107/S0108270198014607","","","0.71073","MoKα","","0.098","0.039","","","","0.108","","","","","","1.016","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008272","11.687","0.002","7.576","0.001","24.153","0.003","90","","95.91","0.01","90","","2127.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[1-(4-methylphenylazo)-2-oxo-2-phenylethyl)-(4-acetanilide) sulfone","","- C23 H21 N3 O4 S -","- C23 H21 N3 O4 S -","- C92 H84 N12 O16 S4 -","4","1","KA1293","Wojciech M. Wolf","X-ray investigations of sulfur-containing fungicides. I. 4'-{[Benzoyl(4-tolylhydrazono)methyl]sulfonyl}acetanilide","Acta Crystallographica Section C","1999","55","3","469","472","10.1107/S0108270198013559","","","0.71073","MoKα","","0.0598","0.0417","","","","0.1711","","","","","","1.02","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008273","9.7172","0.0006","10.2638","0.0005","10.5991","0.0004","89.996","0.004","102.938","0.004","110.121","0.004","963.96","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","calcium hydronium decavanadate hexadecahydrate","","- Ca2 H38 O46 V10 -","- Ca2 H38 O46 V10 -","- Ca2 H38 O46 V10 -","1","0.5","KA1295","Strukan, Neven; Cindrić, Marina; Kamenar, Boris","Ca~2~(H~3~ O)~2~[V~10~O~28~]^.^16H~2~O","Acta Crystallographica Section C","1999","55","3","291","293","10.1107/S0108270198013468","","","0.7107","MoKα","","0.048","0.03","","","","0.081","","","","","","1.006","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008274","8.001","0.001","15.639","0.001","16.405","0.001","90","","94.15","0.01","90","","2047.3","0.3","298","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C22 H26 N2 O3 -","- C22 H26 N2 O3 -","- C88 H104 N8 O12 -","4","1","KA1300","Hökelek, Tuncer; Kılıç, Zeynel; Bi̇lge, Selen","5,6,7,8,9,10,11,12,18,19,21,22-Dodecahydro-8,9:18,19-dibenzo-1,4,7-trioxa-11,16-diazacyclononadeca-10,16-diene","Acta Crystallographica Section C","1999","55","3","381","383","10.1107/S0108270198013687","","","0.71073","MoKα","","","0.064","","","0.06","","","","","1.06","1.06","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008275","7.894","0.001","13.892","0.001","9.556","0.001","90","","103.28","0.02","90","","1019.9","0.2","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H7 N3 O2 -","- C12 H7 N3 O2 -","- C48 H28 N12 O8 -","4","1","KA1302","Hökelek, Tuncer; Kılıç, Emine; Aktan, Selami","1-Nitrobenzo[<i>c</i>]cinnoline","Acta Crystallographica Section C","1999","55","3","383","385","10.1107/S0108270198013560","","","0.71073","MoKα","","","0.048","","","0.06","","","","","1.68","1.68","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008276","6.1818","0.001","13.008","0.003","13.605","0.009","105","0.03","92.46","0.03","101.74","0.02","1029.3","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H2 F28 N4 -","- C44 H2 F28 N4 -","- C44 H2 F28 N4 -","1","0.5","LN1059","Leroy, Jacques; Bondon, Arnaud; Toupet, Loic","2,3,7,8,12,13,17,18-Octafluoro-5,10,15,20-tetrakis(pentafluorophenyl)porphyrin","Acta Crystallographica Section C","1999","55","3","464","466","10.1107/S0108270198014000","","","0.71073","MoKα","","0.083","0.0421","","","","0.1267","","","","","","1.024","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"2008277","9.3138","0.0008","10.1641","0.0008","18.0633","0.0015","90","","90","","90","","1710","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H22 Cr O3 -","- C18 H22 Cr O3 -","- C72 H88 Cr4 O12 -","4","1","","Bahija Abouhamza; Larbi El Firdoussi; Smaïl Allaoud; Abdellah Karim; Alejandro F. Barrero; Miguel Quirós","(η^6^-Arylhimachalene)tricarbonylchromium(0)","Acta Crystallographica Section C","1999","55","","361","363","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2008278","17.46","0.004","14.33","0.003","10.25","0.002","90","","96.73","0.03","90","","2546.9","0.9","223","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Hexacesium-hexatellurodistannate(III)","Hexacesium-hexatellurodistannate(III)","","- Cs6 Sn2 Te6 -","- Cs6 Sn2 Te6 -","- Cs24 Sn8 Te24 -","4","0.5","LN1072","Friede, Bernd; Jansen, Martin","Cs~6~Sn~2~Te~6~, a new telluridodistannate(III)","Acta Crystallographica Section C","1999","55","3","282","284","10.1107/S0108270198014681","","","0.71073","MoKα","","0.0345","0.0265","","","","0.0613","","","","","","1.199","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008279","6.039","0.002","9.587","0.003","12.598","0.006","80.32","0.03","77.51","0.02","89.48","0.03","701.7","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","4-cyclohexyl-5-cyclohexylamine-tetrazole","","- C13 H23 N5 -","- C13 H23 N5 -","- C26 H46 N10 -","2","1","NA1380","Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Hoong-Kun Fun","1-Cyclohexyl-5-cyclohexylaminotetrazole","Acta Crystallographica Section C","1999","55","3","393","395","10.1107/S0108270198012888","","","0.71073","MoKα","","0.0693","0.0547","","0.1557","0.1447","","","","1.021","1.104","1.104","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008280","10.19","0.009","19.104","0.009","12.808","0.009","90","","110.67","0.06","90","","2333","3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 S Sn -","- C27 H24 S Sn -","- C108 H96 S4 Sn4 -","4","1","NA1382","Bruhn, Clemens; Steinborn, Dirk; Lébl, Tomáš; Holeček, Jaroslav","(<i>Z</i>)- and (<i>E</i>)-1-methylthio-1-triphenylstannyl-2-phenylethene","Acta Crystallographica Section C","1999","55","3","363","365","10.1107/S0108270198015200","","","0.71073","MoKα","","0.048","0.044","","0.098","0.094","","","","1.16","1.167","1.167","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008281","9.5512","0.0008","11.0433","0.0008","12.3793","0.001","83.38","0.008","81.737","0.008","67.018","0.007","1187.1","0.18","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H24 S Sn -","- C27 H24 S Sn -","- C54 H48 S2 Sn2 -","2","1","NA1382","Bruhn, Clemens; Steinborn, Dirk; Lébl, Tomáš; Holeček, Jaroslav","(<i>Z</i>)- and (<i>E</i>)-1-methylthio-1-triphenylstannyl-2-phenylethene","Acta Crystallographica Section C","1999","55","3","363","365","10.1107/S0108270198015200","","","0.71073","MoKα","","0.077","0.051","","0.189","0.132","","","","1.239","1.008","1.008","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008282","8.3987","0.0015","6.89","0.004","17.8585","0.0015","90","","90.868","0.011","90","","1033.3","0.6","296.2","","296.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H16 N2 O4 -","- C28 H16 N2 O4 -","- C56 H32 N4 O8 -","2","0.5","OA1075","Okuyama, Kenji; Rozhanskii, Igor; Goto, Kohei","Bilayered structure of <i>N</i>,<i>N</i>'-diphenyl-4,4'-biphthalimide","Acta Crystallographica Section C","1999","55","3","424","425","10.1107/S0108270198013080","","","0.7107","MoKα","","","0.0487","","","0.0668","","","","","1.145","1.145","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008283","5.4508","0.0012","10.2229","0.0012","8.883","0.0017","90","","91.5","0.02","90","","494.82","0.16","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","indium phosphate dihydrate","Indium phosphate dihydrate","","- H4 In O6 P -","- H4 In O6 P -","- H16 In4 O24 P4 -","4","1","OH1113","Sugiyama, Kazumasa; Yu, Jihong; Hiraga, Kenji; Terasaki, Osamu","Monoclinic InPO~4~^.^2H~2~O","Acta Crystallographica Section C","1999","55","3","279","281","10.1107/S010827019801292X","","","0.71069","MoKα","","0.04","0.028","","","","0.068","","","","","","1.071","","","","has coordinates","282548","2023-04-10","20:38:56",""
"2008284","7.118","0.001","20.894","0.001","7.768","0.002","90","","92.2","0.03","90","","1154.4","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 N3 -","- C13 H15 N3 -","- C52 H60 N12 -","4","1","OS1029","S. Selladurai; R. Chandrasekaran; L. Govindasamy; P. Murugan; V. T. Ramakrishnan","2-[3-(Pyrrolidin-1-yl)cyclohex-2-en-1-ylidene]propanedinitrile","Acta Crystallographica Section C","1999","55","3","401","403","10.1107/S0108270198009627","","","1.5418","CuKα","","0.0629","0.059","","0.1881","0.172","","","","0.994","1.013","1.013","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008285","5.776","0.008","12.599","0.005","15.288","0.005","90","","90","","90","","1112.5","1.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H15 N O2 -","- C12 H15 N O2 -","- C48 H60 N4 O8 -","4","1","QA0083","Kumar, G. Biju; Shah, Amrish C.; Cardin, Christine J.; Trenkle, Markus","A substituted isoindolin-1-one derived from (<i>R</i>)-(‒)-2-amino-1-butanol","Acta Crystallographica Section C","1999","55","3","IUC9900019","","10.1107/S0108270199099758","","","0.71073","MoKα","","0.056","0.04","","0.135","0.092","","","","1","1.018","1.018","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008286","17.836","0.004","9.805","0.002","5.813","0.001","90","","90","","90","","1016.6","0.4","103","2","103","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","2,2,5,5-tetramethyl-hex-3-yne","","- C10 H18 -","- C10 H18 -","- C40 H72 -","4","0.5","QA0089","Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","2,2,5,5-Tetramethylhex-3-yne at 281K","Acta Crystallographica Section C","1999","55","3","IUC9900016","","10.1107/S0108270199099746","","","0.71073","MoKα","","0.063","0.05","","","","0.145","","","","","","1.046","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008287","7.5623","0.0002","19.8757","0.0006","21.2828","0.0006","90","","90","","90","","3198.93","0.16","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Ethyl-1-(2-chlorophenyl)-4,6-dimethyl-1,2,3,4-tetrahydropyrimidine-2-thione- 5-carboxylate","","- C15 H17 Cl N2 O2 S -","- C15 H17 Cl N2 O2 S -","- C120 H136 Cl8 N16 O16 S8 -","8","1","QA0090","Kandasamy Chinnakali; Hoong-Kun Fun; Annamalai Senthilvelan; Kamaraj Sriraghavan; Vayalakkavoor T. Ramakrishnan","Ethyl 1-(2-chlorophenyl)-4,6-dimethyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section C","1999","55","3","IUC9900017","","10.1107/S0108270199099734","","","0.71073","MoKα","","0.071","0.06","","","","0.15","","","","","","1.211","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008288","11.078","0.001","11.078","0.001","16.231","0.001","90","","90","","90","","1991.9","0.3","173","2","173","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C8 H24 Ca Cu O14 -","- C8 H24 Ca Cu O14 -","- C32 H96 Ca4 Cu4 O56 -","4","0.25","QA0093","El-Bali, Brahim; Bolte, Michael","Redetermination of [CaCu(C~2~H~3~O~2~)~4~(H~2~ O)~2~]^.^6H~2~O at 173 K","Acta Crystallographica Section C","1999","55","3","IUC9900015","","10.1107/S0108270199099771","","","0.71073","MoKα","","0.025","0.02","","","","0.056","","","","","","1.073","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008289","9.789","0.007","12.754","0.003","24.586","0.009","90","","90","","90","","3070","3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","C14-oxygenated taxoid","Taxa-4(20),11-diene-2α,5α,10β,14β-tetrayl 2α,5α,10β-triacetate 14β-(2-methylbutyrate)","","- C31 H46 O8 -","- C31 H46 O8 -","- C124 H184 O32 -","4","1","QA0094","Chattopadhyay, Sunil K.; Sarkhel, Sanjay; Kulshrestha, Manish; Maulik, Prakas R.","A C-14 oxygenated taxoid from the heartwood of <i>Taxus wallichiana</i>","Acta Crystallographica Section C","1999","55","3","IUC9900014","","10.1107/S0108270199099722","","","0.71073","MoKα","","0.1324","0.0665","","0.2701","0.1886","","","","0.731","0.805","0.805","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008290","19.263","0.002","11.285","0.002","30.361","0.005","90","","104.96","0.01","90","","6376.3","1.7","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","μ-oxobis[(trimethylphosphine-P)(trimethylphosphine oxide-O)dichloro- oxomolybdenum(V)] diethylether semisolvate","","- C14 H41 Cl4 Mo2 O5.5 P4 -","- C14 H41 Cl4 Mo2 O5.5 P4 -","- C112 H328 Cl32 Mo16 O44 P32 -","8","2","QB0081","Cotton, F. Albert; Daniels, Lee M.; Herrero, Santiago","μ-Oxo-bis[dichlorooxo(trimethylphosphine-<i>P</i>)(trimethylphosphine oxide-<i>O</i>)molybdenum(V)] diethyl ether hemisolvate","Acta Crystallographica Section C","1999","55","3","IUC9900018","","10.1107/S010827019909976X","","","0.71073","MoKα","","0.093","0.062","","0.147","0.117","","","","1.203","1.137","1.137","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008291","9.83","0.003","23.121","0.002","15.701","0.001","90","","105.95","0.01","90","","3431.1","1.1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Chloro{rac,trans-[1-(chloro{piperidin-1-yl})phosphino-2-bis(piperidin-1-yl)- phosphino]cyclopentane}neopentylplatinum(II) Acetone Solvate","","- C28 H55 Cl2 N3 O P2 Pt -","- C28 H55 Cl2 N3 O P2 Pt -","- C112 H220 Cl8 N12 O4 P8 Pt4 -","4","1","SK1171","Dahlenburg, Lutz; Mertel, Stefan","Chiral bisphosphanes. V. Chloro{<i>rac</i>,<i>trans</i>-1-[chloro(piperidin-1-yl)phosphino]-2-[bis(piperidin-1-yl)phosphino]cyclopentane-<i>P</i>,<i>P</i>'}neopentylplatinum(II) acetone solvate","Acta Crystallographica Section C","1999","55","3","347","349","10.1107/S010827019801498X","","","0.7107","MoKα","","","0.061","","0.103","","0.1","","","1.041","","","1.015","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008292","14.91","0.002","10.299","0.001","15.184","0.001","90","0.01","92.93","0.01","90","0.01","2328.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","5-ethoxycarbonylmethyl-1-ethyl-2,3,4,6,7,12-hexahydroindolo[2,3-a] quinolizin-5-ium trifluoromethanesulfonate","","- C22 H27 F3 N2 O5 S -","- C22 H27 F3 N2 O5 S -","- C88 H108 F12 N8 O20 S4 -","4","1","SK1208","Bombicz, Petra; Kálmán, Alajos","Crystallographic evidence of the formation of an <i>N</i>-alkylated enammonium salt: 5-ethoxycarbonylmethyl-1-ethyl-2,3,6,7-tetrahydro-4<i>H</i>,12<i>H</i>-indolo[2,3-<i>a</i>]quinolizin-5-ium trifluoromethanesulfonate","Acta Crystallographica Section C","1999","55","3","454","455","10.1107/S0108270198013936","","","1.54178","CuKα","","0.0635","0.0505","","0.1609","","0.1543","","","1.083","","","1.116","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2008293","7.862","0.0008","19.526","0.002","10.469","0.001","90","0.009","105.15","0.01","90","0.009","1551.3","0.3","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N N'-bis(2-methoxyethyl)pyromellitimide","2,6-bis(3oxabutyl)pyrrolo[3,4f]isoindole-1,3,5,7 tetraone","","- C16 H16 N2 O6 -","- C16 H16 N2 O6 -","- C64 H64 N8 O24 -","4","1","SK1219","Bernadette Suchod; Jean-Pierre Curtet; David Djurado; Michel Armand","<i>N,N</i>'-Bis(2-methoxyethyl)pyromellitimide","Acta Crystallographica Section C","1999","55","3","445","446","10.1107/S0108270198013997","","","0.71073","MoKα","","0.072","0.044","","0.04","0.036","","","","1.345","","","1.526","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008294","14.465","0.001","8.3997","0.0004","9.4614","0.0004","90","","97.74","0.01","90","","1139.1","0.11","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","dicesium trimolybdate","","- Cs2 Mo3 O10 -","- Cs2 Mo3 O10 -","- Cs8 Mo12 O40 -","4","0.5","SK1225","Enjalbert, Renée; Guinneton, Frédéric; Galy, Jean","Cs~2~Mo~3~O~10~","Acta Crystallographica Section C","1999","55","3","273","276","10.1107/S0108270198012979","","","0.71069","MoKα","","0.042","0.028","","0.079","0.075","","","","1.079","1.165","1.165","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008295","10.3121","0.0004","11.3409","0.0007","12.7787","0.0008","113.224","0.005","101.056","0.004","102.401","0.004","1276.1","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis(diisopropylammonium) bis(oxalatotriphenylstannate)","","- C26 H31 N O4 Sn -","- C26 H31 N O4 Sn -","- C52 H62 N2 O8 Sn2 -","2","1","SK1232","Ng, Seik Weng; Hook, James M.","Diisopropylammonium oxalatotriphenylstannate","Acta Crystallographica Section C","1999","55","3","310","312","10.1107/S0108270198011858","","","0.71073","MoKα","","0.0377","0.0275","","","","0.0656","","","","","","0.999","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008296","9.6433","0.0006","21.545","0.002","25.366","0.002","101.73","0.006","93.312","0.005","96.534","0.006","5108.8","0.7","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Aquatriphenyl-μ-(N,N-3-oxapentamethylenethiocarbamoylthioacetato)tin- triphenyl(N,N-3-oxapentametheylenethiocarbamoylthioacetato)tin","","- C50 H52 N2 O7 S4 Sn2 -","- C50 H52 N2 O7 S4 Sn2 -","- C200 H208 N8 O28 S16 Sn8 -","4","2","SK1237","Ng, Seik Weng; Hook, James M.","Bis[(<i>N</i>,<i>N</i>-3-oxapentamethylenethiocarbamoylthioacetato)triphenyltin] hydrate and bis(dicyclohexylammonium) bis(3-oxapentamethylenethiocarbamoylthioacetate)","Acta Crystallographica Section C","1999","55","3","312","316","10.1107/S0108270198013092","","","0.71073","MoKα","","0.084","0.048","","","","0.116","","","","","","0.994","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008297","20.771","0.001","9.1734","0.0006","22.756","0.002","90","","90","","90","","4335.9","0.5","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis(dicyclohexylammonium) bis(3-oxapentamethylenethiocarbomylthioacetate)","","- C19 H34 N2 O3 S2 -","- C19 H34 N2 O3 S2 -","- C152 H272 N16 O24 S16 -","8","1","SK1237","Ng, Seik Weng; Hook, James M.","Bis[(<i>N</i>,<i>N</i>-3-oxapentamethylenethiocarbamoylthioacetato)triphenyltin] hydrate and bis(dicyclohexylammonium) bis(3-oxapentamethylenethiocarbamoylthioacetate)","Acta Crystallographica Section C","1999","55","3","312","316","10.1107/S0108270198013092","","","0.71073","MoKα","","0.107","0.052","","","","0.131","","","","","","1.012","","","","has coordinates,has Fobs","196234","2020-10-21","18:00:00",""
"2008298","7.506","0.001","29.143","0.002","9.832","0.001","90","","99.04","0.01","90","","2124","0.4","130","","130","","","","","","","","","4","I 1 a 1","I -2ya","9","","","","- C24 H16 N2 O8 -","- C24 H16 N2 O8 -","- C96 H64 N8 O32 -","4","1","SK1240","Meetsma, Auke; Keller, Erik; Feringa, Ben L.","(±)-6,6'-Dinitro-1,1'-binaphthyl 2,2'-diacetate","Acta Crystallographica Section C","1999","55","3","450","452","10.1107/S0108270198013109","","","0.71073","MoKα","","0.0371","0.0321","","","","0.0825","","","","","","1.041","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008299","10.8952","0.0017","9.9647","0.001","16.288","0.004","90","","93.982","0.012","90","","1764.1","0.5","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2'-Biphenol‒4,4'-bipyridyl (1/1)","","- C22 H18 N2 O2 -","- C22 H18 N2 O2 -","- C88 H72 N8 O8 -","4","1","SK1245","Lavender, Emma S.; Ferguson, George; Glidewell, Christopher","Self-assembled triple helices in the hydrogen-bonded structure of 2,2'-biphenol‒4,4'-bipyridyl (1/1)","Acta Crystallographica Section C","1999","55","3","430","432","10.1107/S0108270198012980","","","0.71073","MolybdenumKα","","0.1111","0.0377","","","","0.1039","","","","","","0.905","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008300","4.0188","0.0003","4.0188","0.0003","9.72","0.001","90","","90","","90","","156.99","0.02","293","2","293","2","","","","","","","","3","P 4/m m m","-P 4 2","123","Potassium tetracopper triselenide","","","- Cu4 K Se3 -","- Cu4 K Se3 -","- Cu4 K Se3 -","1","0.0625","SK1247","Stoll, Petra; Näther, Christian; Jeß, Inke; Bensch, Wolfgang","KCu~4~Se~3~","Acta Crystallographica Section C","1999","55","3","286","288","10.1107/S0108270198014358","","","0.71073","MoKα","","0.028","0.024","","0.062","0.06","","","","1.17","1.186","1.186","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008301","7.716","0.002","8.597","0.002","12.54","0.003","80.19","0.03","74.83","0.03","81.74","0.03","786.8","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H16 Ge I4 N8 -","- C32 H16 Ge I4 N8 -","- C32 H16 Ge I4 N8 -","1","0.5","SK1249","Jan Janczak; Mariola Razik; Ryszard Kubiak","Diiodo[phthalocyaninato(2‒)]germanium(IV) diiodine","Acta Crystallographica Section C","1999","55","3","359","361","10.1107/S0108270198015716","","","0.71073","MoKα","","0.091","0.037","","","","0.077","","","","","","0.925","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008302","7.941","0.003","17.481","0.002","14.511","0.003","90","","90","","90","","2014.4","0.9","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","[(3R,4S,4aR,10aS)-5,10-diacetyl-3,4,4a,5,6,7,10a,10-octahydro-8-methoxy-6-oxo -2H-pyrano[3,2g]pteridin]-3,4-diyl diacetate","","- C18 H22 N4 O9 -","- C18 H22 N4 O9 -","- C72 H88 N16 O36 -","4","1","SK1253","Low, John N.; M. Dolores López; M. Luisa Quijano; Sánchez, Adolfo; Nogueras, Manuel","(3<i>R</i>,4<i>S</i>,4a<i>R</i>,10a<i>S</i>)-5,10-Diacetyl-3,4,4a,5,6,7,10,10a-octahydro-8-methoxy-6-oxo-2<i>H</i>-pyrano[3,2-<i>g</i>]pteridin-3,4-diyl diacetate","Acta Crystallographica Section C","1999","55","3","452","454","10.1107/S0108270198014371","","","0.71073","MoKα","","0.054","0.039","","","","0.084","","","","","","0.837","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008303","36.925","0.004","36.925","0.004","8.256","0.002","90","","90","","120","","9749","3","273","2","273","2","","","","","","","","6","R -3 :H","-R 3","148","","hexanoyloxymethyl 4-chloro-N-furfuryl-5-sulfamoylanthranilate","","- C19 H23 Cl N2 O7 S -","- C19 H23 Cl N2 O7 S -","- C342 H414 Cl18 N36 O126 S18 -","18","1","SX1070","Alvaro W. Mombrú; Raúl A. Mariezcurrena; Leopoldo Suescun; Helena Pardo; Eduardo Manta; Carolina Prandi","Two absorption furosemide prodrugs","Acta Crystallographica Section C","1999","55","3","413","416","10.1107/S010827019801213X","","","0.71069","MoKα","","0.1034","0.0561","","","","0.1994","","","","","","1.039","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008304","7.836","0.002","17.605","0.01","15.4951","0.0018","90","","94.026","0.016","90","","2132.3","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","benzoyloxymethyl 4-chloro-N-furfuryl-5-sulfamoylanthranilate","","- C20 H17 Cl N2 O7 S -","- C20 H17 Cl N2 O7 S -","- C80 H68 Cl4 N8 O28 S4 -","4","1","SX1070","Alvaro W. Mombrú; Raúl A. Mariezcurrena; Leopoldo Suescun; Helena Pardo; Eduardo Manta; Carolina Prandi","Two absorption furosemide prodrugs","Acta Crystallographica Section C","1999","55","3","413","416","10.1107/S010827019801213X","","","0.7107","MoKα","","0.0931","0.0633","","","","0.2155","","","","","","1.041","","","","has coordinates","255755","2020-10-21","18:00:00",""
"2008305","16.517","0.003","23.533","0.005","5.1124","0.0006","90","","90","","90","","1987.2","0.6","293","2","290","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","d[gamma]afg","Retro-enantiomeric [gammaCONH]-achatin-I, H-D-Asp-[γCONH]-D-Ala-L-Phe-Gly-OH","","- C18 H24 N4 O7 -","- C18 H24 N4 O7 -","- C72 H96 N16 O28 -","4","1","SX1074","Doi, Mitsunobu; Asano, Akiko; Ishida, Toshimasa; Minakata, Hiroyuki; Nomoto, Kyosuke","A β-turn retro-enantiomeric analogue of achatin-I, H‒<small>D</small>-Asp-[γCONH]-<small>D</small>-Ala‒<small>L</small>-Phe‒Gly‒OH","Acta Crystallographica Section C","1999","55","3","422","424","10.1107/S0108270198012141","","","1.5418","CuKα","","0.061","0.045","","","","0.143","","","","","","1.134","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008306","9.8951","0.0004","16.243","0.0007","25.0787","0.001","90","","90.444","0.001","90","","4030.7","0.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","bis(μ-benzenethiolato-S:S)hexacarbonyl-μ-iodo-dimolybdenum(I)(Mo—Mo)","","- C34 H46 I Mo2 N O6 S2 -","- C34 H46 I Mo2 N O6 S2 -","- C136 H184 I4 Mo8 N4 O24 S8 -","4","1","TA1215","Pan, Guohua; Zhuang, Botao; Chen, Jiutong","A mixed tribridging dimolybdenum(I) compound, bis(μ-benzenethiolato-<i>S</i>:<i>S</i>)hexacarbonyl-μ-iodo-dimolybdenum(I)(<i>Mo</i>—<i>Mo</i>)","Acta Crystallographica Section C","1999","55","3","297","298","10.1107/S0108270198012025","","","0.71073","MoKα","","0.09","0.051","","0.089","0.078","","","","1.054","1.124","1.124","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008307","14.4791","0.0002","12.9825","0.0002","24.4658","0.0003","90","","104.79","0.001","90","","4446.58","0.11","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tetrabutylammonium bis(μ-benzenethiolato-S:S)hexacarbonyl-μ-pivalate-O:O'-dimolybdenum(Mo—Mo)","","- C39 H55 Mo2 N O8 S2 -","- C39 H55 Mo2 N O8 S2 -","- C156 H220 Mo8 N4 O32 S8 -","4","1","TA1216","Pan, Guohua; Zhuang, Botao; Chen, Jiutong","A dimolybdenum(I) carbonyl compound with thiolate and carboxylate bridges: tetrabutylammonium bis(μ-benzenethiolato-<i>S</i>:<i>S</i>)hexacarbonyl-μ-pivalate-<i>O</i>:<i>O</i>'-dimolybdenum(<i>Mo</i>—<i>Mo</i>)","Acta Crystallographica Section C","1999","55","3","298","300","10.1107/S0108270198012037","","","0.71073","MoKα","","0.082","0.052","","0.135","0.117","","","","1.011","1.044","1.044","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008308","12.355","0.003","11.645","0.003","12.75","0.003","90","","117.407","0.016","90","","1628.5","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N~1~,N~4~-Diformyl-t-5-methyl-r-2,t-3-diphenylpiperazine","","- C19 H20 N2 O2 -","- C19 H20 N2 O2 -","- C76 H80 N8 O8 -","4","1","VJ1091","Laavanya. P; Panchanatheswaran. K; Murugadoss. R; Jeyaraman. R","1,4-Diformyl-<i>t</i>-5-methyl-<i>r</i>-2,<i>t</i>-3-diphenylpiperazine-1,4-dicarbaldehyde","Acta Crystallographica Section C","1999","55","3","410","411","10.1107/S0108270198011779","","","1.5418","CuKα","","0.0748","0.0627","","","","0.2266","","","","","","1.09","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008309","6.698","0.001","7.171","0.001","30.604","0.005","90","","90","","90","","1470","0.4","293","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H15 N O4 S -","- C16 H15 N O4 S -","- C64 H60 N4 O16 S4 -","4","1","BK1392","Kumaradhas, P.; Kalyanam, N.; Ravikumar, K.; Chandra Mohan, K.; Sridhar, M.A.; Shashidhara Prasad, J.; Nirmala, K.A.","(+)-<i>cis</i>-3-Hydroxy-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine 1-oxide","Acta Crystallographica Section C","1999","55","4","614","615","10.1107/S0108270198012827","","","0.71073","MoKα","","","0.0438","","","0.0897","","","","","1.12","1.12","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008310","13.657","0.001","14.464","0.001","11.014","0.001","90","","112.104","0.003","90","","2015.7","0.3","293","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-N,N-dimethylamino-6-hydroxy-1,4-naphthoquinone","","- C12 H11 N O3 -","- C12 H11 N O3 -","- C96 H88 N8 O24 -","8","2","BK1411","Doriguetto, Antônio C.; Santos, Cátia A.; Raslan, Délio S.; Fernandes, Nelson G.","2-(<i>N</i>,<i>N</i>-Dimethylamino)-6-hydroxy-1,4-naphthoquinone","Acta Crystallographica Section C","1999","55","4","639","642","10.1107/S0108270198013213","","","0.71073","MoKα","","0.0949","0.054","","0.1534","","0.0958","","","0.919","1.016","1.016","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008311","22.997","0.005","8.069","0.002","20.001","0.004","90","","125","0.03","90","","3040.2","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1-chloro-2,4-dimorpholino-5-nitrobenzene","","- C14 H18 Cl N3 O4 -","- C14 H18 Cl N3 O4 -","- C112 H144 Cl8 N24 O32 -","8","1","BK1415","Zucco, César; Neves, Ademir; Vencato, Ivo; Szpoganicz, Bruno; Bertoldi, Fabiano C.","1-Chloro-2,4-dimorpholino-5-nitrobenzene","Acta Crystallographica Section C","1999","55","4","654","656","10.1107/S0108270198014516","","","0.71073","MoKα","","0.066","0.042","","","","0.124","","","","","","1.105","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008312","10.009","0.0013","15.472","0.002","16.216","0.002","90","","90","","90","","2511.2","0.6","160","3","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","2-(Diethylaminomethyl)phenol Nitrate","diethyl(2-hydroxybenzyl)ammonium nitrate","","- C11 H18 N2 O4 -","- C11 H18 N2 O4 -","- C88 H144 N16 O32 -","8","1","BK1426","Bouayad, Abdelouahed; Dartiguenave, Michèle; Lamandé, Lydia; El Ghadraoui, El Houssine; Beauchamp, André L.","Nitrate salt of protonated 2-(diethylaminomethyl)phenol","Acta Crystallographica Section C","1999","55","4","681","683","10.1107/S0108270198014218","","","0.71073","MoKα","","0.06","0.039","","0.087","","0.082","","","1.042","","","1.209","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008313","13.855","0.004","21.573","0.006","13.163","0.004","90","","90","","90","","3934","2","295","2","295","2","","","","","","","","6","C c c 2","C 2 -2c","37","","μ-Oxo-bis-[bis-(2,2'-bi(1H-imidazole-N^3^))-oxo-rhenium(V)]tetrachloride hexahydrate, [{ReO(C~6~H~4~N~2~)~2~}~2~O]Cl~4~^.^6H~2~O.","","- C24 H36 Cl4 N16 O9 Re2 -","- C24 H24 Cl4 N16 O9 Re2 -","- C96 H96 Cl16 N64 O36 Re8 -","4","0.5","BK1428","Bélanger, Suzanne; Beauchamp, André L.","μ-Oxo-bis{bis[2,2'-bi(1<i>H</i>-imidazole-<i>N</i>^3^)]oxorhenium(V)} tetrachloride hexahydrate","Acta Crystallographica Section C","1999","55","4","517","521","10.1107/S010827019801511X","","","1.54056","CuKα","","0.051","0.03","","0.086","0.075","","","","0.6","0.68","0.68","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008314","7.5766","0.0006","9.6207","0.0007","11.2537","0.0009","89.227","0.001","85.764","0.001","82.531","0.001","811.12","0.11","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","8-Hydroxy-1,2,3-trimethoxybenz[a]anthracene-7,12-dione","","- C21 H16 O6 -","- C21 H16 O6 -","- C42 H32 O12 -","2","1","BK1433","Ilia A. Guzei; Alex Melekhov; George A. Kraus","A new strained angularly fused ring system: 8-hydroxy-1,2,3-trimethoxybenz[<i>a</i>]anthracene-7,12-dione","Acta Crystallographica Section C","1999","55","4","620","622","10.1107/S0108270198012840","","","0.71073","MoKα","","0.063","0.053","","","","0.163","","","","","","1.05","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008315","8.8166","0.0006","9.9326","0.0006","9.9764","0.0006","76.875","0.002","76.582","0.001","74.331","0.001","805.52","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5,10-Dimethoxy-1,4-methano-1,4,4a,11a-tetrahydrobenzo[b]fluoren-11-one-oxime","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C40 H38 N2 O6 -","2","1","BK1435","Kandasamy Chinnakali; Hoong-Kun Fun; Dipakranjan Mal; Nirmal Kumar Hazra; Sujit Kumar Ghorai; Gur Dayal Nigam","5,10-Dimethoxy-1,4-methano-1,4,4a,11a-tetrahydrobenzo[<i>b</i>]fluoren-11-one oxime","Acta Crystallographica Section C","1999","55","4","585","586","10.1107/S0108270198015017","","","0.71073","MoKα","","0.0862","0.0576","","","","0.1714","","","","","","1.017","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008316","5.8512","0.0002","13.041","0.0006","14.8412","0.0007","90","","90","","90","","1132.47","0.08","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-imino(dimethylamino)benzenesulfonic acid","","- C9 H14 N2 O4 S -","- C9 H14 N2 O4 S -","- C36 H56 N8 O16 S4 -","4","1","BK1436","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","A Schiff base formed from sulfanilic acid and dimethylformamide","Acta Crystallographica Section C","1999","55","4","697","698","10.1107/S0108270198016060","","","0.71073","MoKα","","0.0465","0.0343","","","","0.0818","","","","","","1.129","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008317","12.014","0.006","9.8","0.002","16.068","0.003","90","","93.8","0.03","90","","1887.6","1.1","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(2-deoxy-α-L-erythro-pentopyranosyl) 1-(S),2-(S), 4-triazolidine-3,5-dione","","- C24 H24 S -","- C24 H24 S -","- C96 H96 S4 -","4","1","BK1440","Meyers, Cal Y.; Hou, Yuqing; Robinson, Paul D.","<i>ap</i>-9-(<i>o-tert</i>-Butylphenyl)-9-methylthiofluorene, the first isolated <i>ap</i> rotamer of a 9-substituted 9-(<i>o-tert</i>-butylphenyl)fluorene","Acta Crystallographica Section C","1999","55","4","626","628","10.1107/S010827019801453X","","","0.71069","MoKα","","0.069","0.036","","","","0.102","","","","","","1","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008318","10.8956","0.0009","8.2532","0.0005","20.205","0.0012","90","","98.411","0.006","90","","1797.4","0.2","295","","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,2-bis(2-pyridinooxyethoxy)benzene","","","- C20 H20 N2 O4 -","- C20 H20 N2 O4 -","- C80 H80 N8 O16 -","4","1","BK1447","Bryan, Jeffrey C.; Delmau, Laetitia H.; Sachleben, Richard A.; Moyer, Bruce A.","1,2-Bis[2-(pyridin-2-yloxy)ethoxy]benzene","Acta Crystallographica Section C","1999","55","4","618","620","10.1107/S0108270198016722","","","0.71073","MoKα","","0.074","0.036","","","","0.094","","","","","","1.01","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008319","10.203","0.002","13.047","0.004","15.99","0.005","68.54","0.03","85.85","0.02","76.48","0.02","1925.9","1","170","2","170","2","","","","","","","","7","P -1","-P 1","2","","bis-triphenylphosphane silver 1-phenyltetrazolethiolate","","- C44 H39 Ag N4 O P2 S -","- C44 H39 Ag N4 O P2 S -","- C88 H78 Ag2 N8 O2 P4 S2 -","2","1","BM1275","Molloy, Kieran C.; Mahon, Mary F.; Barret, Marie C.","(1-Phenyl-1<i>H</i>-1,2,3,4-tetrazole-5-thiolato-<i>S</i>)bis(triphenylphosphine)silver(I) methanol solvate","Acta Crystallographica Section C","1999","55","4","555","557","10.1107/S0108270199000311","","","0.71069","MoKα","","0.049","0.029","","0.071","0.065","","","","1.015","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008320","10.0761","0.0012","10.6819","0.0013","10.9819","0.0012","63.847","0.002","72.015","0.003","79.359","0.002","1007.5","0.2","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H46 Cu3 N4 O10 -","- C42 H46 Cu3 N4 O10 -","- C42 H46 Cu3 N4 O10 -","1","0.5","BM1276","Atakol, Orhan; Arici, Cengiz; Ercan, Filiz; Ülkü, Dinçer","Bis{(μ-acetato)[μ-bis(salicylidene)-1,3-propanediaminato]copper(II)}copper(II) dioxane solvate","Acta Crystallographica Section C","1999","55","4","511","513","10.1107/S0108270198014334","","","0.71073","MoKα","","","0.044","","","0.046","","","","","0.96","0.96","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008321","6.9693","0.0002","9.5268","0.0003","11.1032","0.0004","97.595","0.001","104.295","0.0005","95.327","0.002","702.04","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-Phenyl 5-(2-chlorophenyl) 1,2,4-triazole-3-thione","","- C14 H10 Cl N3 S -","- C14 H10 Cl N3 S -","- C28 H20 Cl2 N6 S2 -","2","1","BM1285","Kumaran,D.; Ponnuswamy,M.N.; Jayanthi,G.; Ramakrishnan, V.T.; Chinnakali, K.; Fun, H.-K.","3-(2-Chlorophenyl)-4-phenyl-1,2,4-triazole-5-thione","Acta Crystallographica Section C","1999","55","4","581","582","10.1107/S0108270198013808","","","0.71073","MoKα","","0.0691","0.0478","","0.1288","0.1126","","","","1.043","1.054","1.054","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008322","8.778","0.002","8.781","0.001","10.998","0.002","85.52","0.01","85.42","0.02","78.57","0.01","826.6","0.3","203","2","203","2","","","","","","","","3","P -1","-P 1","2","4,4'‒Bipyridyl","4,4'‒Bipyridinyl","","- C20 H16 N4 -","- C10 H8 N2 -","- C40 H32 N8 -","4","2","BM1287","Boag, Neil M.; Coward, Kathleen M.; Jones, Anthony C; Pemble, Martyn E.; Thompson, J. Robin","4,4'-Bipyridyl at 203K","Acta Crystallographica Section C","1999","55","4","672","674","10.1107/S0108270198016333","","","0.71073","MoKα","","0.0921","0.0514","","0.1341","","0.1341","","","1.01","","","1.01","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008323","8.915","0.004","10.623","0.004","17.243","0.005","90","","90","","90","","1633","1.1","190","2","190","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Diosbulbin-B","","","- C19 H20 O6 -","- C19 H20 O6 -","- C76 H80 O24 -","4","1","BM1291","Singh, Amarjit; Parmar, Virinder S.; Errington, William; Howarth, Oliver W.; Lawrie, Stephen","Diosbulbin B, a constituent of <i>Dioscorea pentaphylla</i>","Acta Crystallographica Section C","1999","55","4","559","561","10.1107/S0108270198014978","","","0.71073","MoKα","","0.064","0.044","","","","0.097","","","","","","1.106","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008324","9.022","0.003","15.576","0.002","13.489","0.003","90","","103.52","0.02","90","","1843","0.8","173","1","173","1","","","","","","","","3","P 1 21 1","P 2yb","4","","ethyl-5,7,8-tri-O-acetyl-2-deoxy-α-D-erythro-L-arabino-oct-3-ulofuranosid- 1,4-lactone","","- C16 H22 O10 -","- C16 H22 O10 -","- C64 H88 O40 -","4","2","BM1305","Linden, Anthony; Lee, C. Kuan; Li, Xiaofeng","A fused furanoside-1,4-lactone at 173K","Acta Crystallographica Section C","1999","55","4","642","644","10.1107/S0108270198016692","","","0.71073","MoKα","","0.089","0.044","","","","0.114","","","","","","1.023","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008325","18.5888","0.0012","8.1378","0.001","28.964","0.002","90","","90","","90","","4381.4","0.7","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H34 N2 O11 S2 -","- C14 H34 N2 O11 S2 -","- C112 H272 N16 O88 S16 -","8","1","BM1316","Henschel, Dagmar; Wijaya, Karna; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CX. Hydroxylammonium di(methanesulfonyl)amidate 1,4,7,10,13,16-hexaoxacyclooctadecane (1/1/1) and 2-aminopyridinium di(methanesulfonyl)amidate 1,4,7,10,13,16-hexaoxacyclooctadecane (1/1/1)","Acta Crystallographica Section C","1999","55","4","664","668","10.1107/S0108270199001274","","","0.71073","MoKα","","0.058","0.033","","","","0.074","","","","","","0.883","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008326","11.67","0.003","15.623","0.005","14.528","0.004","90","","108.74","0.03","90","","2508.3","1.3","143","2","143","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Aminopyridinium Di(methanesulfonyl)amidate 1,4,7,1O,13,16-Hexaoxacyclooctadecane (1/1/1)","","- C19 H37 N3 O10 S2 -","- C19 H37 N3 O10 S2 -","- C76 H148 N12 O40 S8 -","4","1","BM1316","Henschel, Dagmar; Wijaya, Karna; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CX. Hydroxylammonium di(methanesulfonyl)amidate 1,4,7,10,13,16-hexaoxacyclooctadecane (1/1/1) and 2-aminopyridinium di(methanesulfonyl)amidate 1,4,7,10,13,16-hexaoxacyclooctadecane (1/1/1)","Acta Crystallographica Section C","1999","55","4","664","668","10.1107/S0108270199001274","","","0.71073","MoKα","","0.049","0.038","","","","0.094","","","","","","1.061","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008327","9.782","0.002","10.283","0.002","10.497","0.002","90","","90","","90","","1055.9","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H13 Mn N O7 -","- C6 H13 Mn N O7 -","- C24 H52 Mn4 N4 O28 -","4","1","BR1217","Liu, Ye-Qi; Wei, Yong-Ge; Liu, Qun; Zhang, Shi-Wei; Shao, Mei-Cheng","A one-dimensional coordination polymer of manganese(II) with <i>N</i>-(2-hydroxyethyl)iminodiacetate: {[Mn(Hheidi)(H~2~O)]^.^H~2~O}~<i>n~</i>","Acta Crystallographica Section C","1999","55","4","534","536","10.1107/S0108270198016084","","","0.71073","MoKα","","0.044","0.038","","0.106","0.094","","","","1.031","1.035","1.035","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008328","5.37","0.002","8.268","0.004","12.693","0.003","90","","90.37","0.02","90","","563.5","0.4","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Strontium iron II diphosphate","","","- Fe O7 P2 Sr -","- Fe O7 P2 Sr -","- Fe4 O28 P8 Sr4 -","4","1","BR1225","Le Meins, Jean-Marc; Courbion, Georges","SrFeP~2~O~7~, a new homologue in the <i>AM</i>P~2~O~7~ series","Acta Crystallographica Section C","1999","55","4","481","483","10.1107/S0108270198017375","","","0.71073","MoKα","","0.054","0.033","","0.09","0.084","","","","1.018","1.082","1.082","","","","","has coordinates","191888","2020-10-21","18:00:00",""
"2008329","10.2357","0.0014","10.2357","0.0014","3.5425","0.0007","90","","90","","90","","371.15","0.1","293","2","293","2","","","","","","","","2","I 4/m","-I 4","87","","","","- Sb4 Ta5 -","- Sb4 Ta5 -","- Sb8 Ta10 -","2","0.125","BR1226","Kang, Sung Kwon; Miller, Gordon J.","Ta~5~Sb~4~","Acta Crystallographica Section C","1999","55","4","483","485","10.1107/S0108270198015881","","","0.71073","MoKα","","0.071","0.029","","","","0.065","","","","","","1.062","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008330","8.9928","0.0001","11.2809","0.0002","5.48116","0.00009","90","","90","","90","","556.05","0.02","293","2","293","2","","","","","","","","3","C m c 21","C 2c -2","36","gadolinium gallium oxide","","","- Ga Gd3 O6 -","- Ga Gd3 O6 -","- Ga4 Gd12 O24 -","4","0.5","BR1230","Yamane, Hisanori; Sakamoto, Takashi; Kubota, Shun-ichi; Shimada, Masahiko","Gd~3~GaO~6~ by X-ray powder diffraction","Acta Crystallographica Section C","1999","55","4","479","481","10.1107/S0108270198016096","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008331","13.8627","0.0003","12.6533","0.0003","16.6278","0.0004","90","","111.697","0.001","90","","2710.02","0.11","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(C4 H12 N)4 Ge9 H12 O26 14(H2 O)","","- C16 H88 Ge9 N4 O40 -","- C16 H88 Ge9 N4 O40 -","- C32 H176 Ge18 N8 O80 -","2","0.5","BR1237","Tripathi, Akhilesh; Young Jr., Victor G.; Johnson, Geoffrey M.; Cahill, Christopher L.; Parise, John B.","[N(CH~3~)~4~]~4~H~12~Ge~9~O~26~^.^14H~2~O","Acta Crystallographica Section C","1999","55","4","496","499","10.1107/S0108270198014838","","","0.71073","MoKα","","0.0766","0.0483","","0.1096","","0.0998","","","","1.149","1.149","1.08","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2008332","20.5254","0.0013","15.1311","0.001","6.1276","0.0004","90","","90","","90","","1903.1","0.2","180","2","180","2","","","","","","","","5","P n a 21","P 2c -2n","33","","3-Cyano-5-(4-methoxybenzyl)-6-(4-methoxyphenyl)-4-methylthio-2H-pyran-2-one","","- C22 H19 N O4 S -","- C22 H19 N O4 S -","- C88 H76 N4 O16 S4 -","4","1","CF1285","Kumar, Rajesh; Parmar, Virinder S.; Errington, William","3-Cyano-5-(4-methoxybenzyl)-6-(4-methoxyphenyl)-4-methylthio-2<i>H</i>-pyran-2-one","Acta Crystallographica Section C","1999","55","4","561","563","10.1107/S0108270198015121","","","0.71073","MoKα","","0.067","0.047","","","","0.094","","","","","","1.049","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008333","10.48","0.002","11.949","0.002","15.005","0.003","90","","90","","90","","1879","0.6","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4‒(N‒Methylnitramino)-1‒methylpyridinium bromide","","- C7 H10 Br N3 O2 -","- C7 H10 Br N3 O2 -","- C56 H80 Br8 N24 O16 -","8","1","CF1290","Zaleski, Jacek; Daszkiewicz, Zdzisław; Kyzioł, Janusz","1-Methyl-4-(<i>N</i>-methylnitramino)pyridinium bromide","Acta Crystallographica Section C","1999","55","4","691","693","10.1107/S0108270198014656","","","0.71073","MoKα","","0.0664","0.0293","","","","0.0823","","","","","","1","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008334","13.003","0.001","8.8836","0.0006","20.196","0.002","90","","95.065","0.008","90","","2323.8","0.3","300","2","300","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(N-phenyl benzoylhydroxamate-O,O')(acetylacetone benzoylhydrazonato-O,N,O')- oxo-vanadium(V)","","- C25 H22 N3 O5 V -","- C25 H22 N3 O5 V -","- C100 H88 N12 O20 V4 -","4","1","DA1036","Chen, Wei; Gao, Shan; Liu, Shi-Xiong","Monooxovanadium(V) complexes with bidentate <i>N</i>-phenylbenzohydroxamate","Acta Crystallographica Section C","1999","55","4","531","533","10.1107/S0108270198014875","","","0.71073","MoKα","","0.104","0.056","","0.124","0.109","","","","0.976","1.158","1.158","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008335","9.72","0.001","18.274","0.002","12.542","0.001","90","","104.868","0.009","90","","2153.2","0.4","300","2","300","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(N-phenyl benzoylhydroxamate-O,O')(N-salicylidene-L-alaninato-O,N,O')- oxo-vanadium(V)","","- C23 H19 N2 O6 V -","- C23 H19 N2 O6 V -","- C92 H76 N8 O24 V4 -","4","2","DA1036","Chen, Wei; Gao, Shan; Liu, Shi-Xiong","Monooxovanadium(V) complexes with bidentate <i>N</i>-phenylbenzohydroxamate","Acta Crystallographica Section C","1999","55","4","531","533","10.1107/S0108270198014875","","","0.71073","MoKα","","0.096","0.062","","0.145","0.129","","","","0.97","1.079","1.079","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008336","9.125","0.0007","12.769","0.001","16.428","0.002","90","","98.738","0.009","90","","1891.9","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Triphenylphosphoniopropionate dihydrate","","- C21 H23 O4 P -","- C21 H23 O4 P -","- C84 H92 O16 P4 -","4","1","DA1039","Ng, Seik Weng","3-Triphenylphosphoniopropionate dihydrate","Acta Crystallographica Section C","1999","55","4","646","648","10.1107/S0108270198014887","","","0.71073","MoKα","","0.1303","0.0729","","","","0.2145","","","","","","1.019","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008337","15.64","0.004","22.765","0.006","5.681","0.001","90","","92.663","0.005","90","","2020.5","0.8","295","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N,N-Bis(p-nitrophenylsulfonyl)cyclohexylamine","","- C18 H19 N3 O8 S2 -","- C18 H19 N3 O8 S2 -","- C72 H76 N12 O32 S8 -","4","1","DA1049","Brunzelle, Joseph S.; Curtis-Palmer, Veronica A.; Pavkovic, Stephen F.","<i>N</i>,<i>N</i>-Bis(<i>p</i>-nitrophenylsulfonyl)cyclohexylamine","Acta Crystallographica Section C","1999","55","4","624","626","10.1107/S0108270198017612","","","0.7107","MoKα","","0.0639","0.039","","0.1043","0.0969","","","","1.004","1.132","1.132","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008338","8.984","0.003","11.912","0.004","9.548","0.003","90","","108.34","0.03","90","","969.9","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-(Diaqua-O,O')(C-meso-1,5,8,12-tetramethyl-1,4,8,11- tetraazacyclotetradecane-N,N',N'',N''')Nickel(II) Chloride","","- C14 H36 Cl2 N4 Ni O2 -","- C14 H36 Cl2 N4 Ni O2 -","- C28 H72 Cl4 N8 Ni2 O4 -","2","0.5","DA1051","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Liao, Fen-Ling; Chung, Chung-Sun","<i>trans</i>-Diaqua(<i>C</i>-<i>meso</i>-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)nickel(II) dichloride","Acta Crystallographica Section C","1999","55","4","543","545","10.1107/S0108270198017594","","","0.71073","MoKα","","0.0506","0.045","","","","0.1436","","","","","","1.132","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008339","11.503","0.004","4.975","0.002","13.304","0.003","90","","99.86","0.02","90","","750.1","0.4","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N-propylimidazolidinetrion","","","- C6 H8 N2 O3 -","- C6 H8 N2 O3 -","- C24 H32 N8 O12 -","4","1","DA1052","Yoshihara, Ryouko; Hosomi, Hiroyuki; Aoyama, Hiromu; Ohba, Shigeru","<i>N</i>-Propylimidazolidinetrione and <i>N</i>-methyl-<i>N</i>'-phenylethylimidazolidinetrione","Acta Crystallographica Section C","1999","55","4","594","596","10.1107/S0108270198017600","","","0.71073","MoKα","","0.106","0.047","","","","0.087","","","","","","1.07","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2008340","49.87","0.02","5.406","0.003","8.471","0.003","90","","88.66","0.03","90","","2283.1","1.8","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","N-phenylethyl-N-methylimidazolidinetrione","","","- C12 H12 N2 O3 -","- C12 H12 N2 O3 -","- C96 H96 N16 O24 -","8","1","DA1052","Yoshihara, Ryouko; Hosomi, Hiroyuki; Aoyama, Hiromu; Ohba, Shigeru","<i>N</i>-Propylimidazolidinetrione and <i>N</i>-methyl-<i>N</i>'-phenylethylimidazolidinetrione","Acta Crystallographica Section C","1999","55","4","594","596","10.1107/S0108270198017600","","","0.71073","MoKα","","0.174","0.052","","","","0.116","","","","","","1.1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2008341","26.9834","0.0006","16.8216","0.0004","28.1","0.0004","90","","90.164","0.001","90","","12754.6","0.5","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","dodecamolybodtetrakis(p‒cyanophenyl)arsonate tetrabutylammonium salt","","","- C92 H160 As4 Mo12 N8 O46 -","- C92 H160 As4 Mo12 N8 O46 -","- C368 H640 As16 Mo48 N32 O184 -","4","0.5","DA1056","Johnson, Bret J.S.; Buss, Carrie E.; Young Jr., Victor G.; Stein, Andreas","Tetrakis(tetrabutylammonium) tetrakis[(<i>p</i>-cyanophenyl)trioxoarsonato]tetratriacontaoxododecamolybdate(4 ‒)","Acta Crystallographica Section C","1999","55","4","549","551","10.1107/S0108270198017636","","","0.71073","MoKα","","0.0833","0.0463","","0.1156","0.1024","","","","0.992","1.076","1.076","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008342","18.178","0.003","9.233","0.004","30.904","0.007","90","","101.3","0.01","90","","5086","3","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","Chloro(diethyl dithiophosphato-S,S')(triphenylphosphine-P)palladium(II)","","- C22 H25 Cl O2 P2 Pd S2 -","- C22 H25 Cl O2 P2 Pd S2 -","- C176 H200 Cl8 O16 P16 Pd8 S16 -","8","2","DE1097","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Tung, Shu-Fang; Narayan, Sanjay; Jain, Vimal K.","Chloro(diethyl dithiophosphato-<i>S</i>,<i>S</i>')(triphenylphosphine-<i>P</i>)palladium(II)","Acta Crystallographica Section C","1999","55","4","541","543","10.1107/S0108270198014905","","","0.71073","MoKα","","0.081","0.053","","0.217","0.159","","","","1.07","0.902","0.902","","","","","has coordinates","198633","2020-10-21","18:00:00",""
"2008343","13.9841","0.0002","16.8118","0.0002","16.8033","0.0002","90","","93.858","0.001","90","","3941.47","0.09","203","2","203","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C28 H22 Cl9 D3 N2 O6 P2 Pd -","- C28 H25 Cl9 N2 O6 P2 Pd -","- C112 H100 Cl36 N8 O24 P8 Pd4 -","4","1","FG1483","Rath, Nigam P.; Stockland Jr, Robert A.; Anderson, Gordon K.","[Bis(diphenylphosphino)methane]dinitratopalladium(II) tris(deuteriochloroform) solvate","Acta Crystallographica Section C","1999","55","4","494","496","10.1107/S0108270198016345","","","0.71073","MoKα","","0.047","0.04","","","","0.109","","","","","","1.034","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2008344","7.791","0.001","11.198","0.001","16.986","0.002","90","","90","","90","","1481.9","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Santonic Acid","(-)-octahydro-α,3a,5-trimethyl-6,8-dioxo-1,4-methano- 1H-indene-1-acetic acid","","- C15 H20 O4 -","- C15 H20 O4 -","- C60 H80 O16 -","4","1","FG1516","Brunskill, Andrew P. J.; Thompson, Hugh W.; Lalancette, Roger A.","Santonic acid: catemeric hydrogen bonding in a γ,ε-diketo carboxylic acid","Acta Crystallographica Section C","1999","55","4","566","568","10.1107/S0108270198014231","","","0.71073","MoKα","","0.077","0.053","","0.135","0.12","","","","1.08","1.12","1.12","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008345","10.3179","0.0001","13.6397","0.0001","27.183","0.0005","90","","90","","90","","3825.55","0.08","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-Leucyl-L-leucine 2-methyl-1-propanol (1:1)","","- C16 H34 N2 O4 -","- C16 H34 N2 O4 -","- C128 H272 N16 O32 -","8","2","FG1518","Görbitz, Carl Henrik","<small>L</small>-Leucyl-<small>L</small>-leucine 2-methyl-1-propanol solvate","Acta Crystallographica Section C","1999","55","4","670","672","10.1107/S0108270198016369","","","0.71073","MoKα","","0.077","0.059","","0.145","0.135","","","","1.076","1.104","1.104","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008346","9.975","0.002","9.975","0.002","10.418","0.002","90","","90","","90","","1036.6","0.4","293","2","293","2","","","","","","","","5","P 41","P 4w","76","FF-arabino-uridine","1-(2'-fluoro-2'-deoxy-β-D-arabinofuranosyl) -5-fluoro-2,4(1H,3H)-pyrimidinedione","","- C9 H10 F2 N2 O5 -","- C9 H10 F2 N2 O5 -","- C36 H40 F8 N8 O20 -","4","1","FG1521","Hempel, Andrew; Camerman, Norman; Grierson, John; Mastropaolo, Donald; Camerman, Arthur","FF-β-<small>D</small>-Arabinofuranosyluracil","Acta Crystallographica Section C","1999","55","4","632","633","10.1107/S0108270198015455","","","1.54178","CuKα","","0.029","0.0284","","","","0.0917","","","","","","0.865","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008347","9.305","0.002","12.78","0.003","10.444","0.003","90","","101.79","0.02","90","","1215.8","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","(+/-)-10a-Carboxy-1,9,10,10a-tetrahydrophenanthren-3(2H)-one","(+/-)-10a-Carboxy-1,9,10,10a-tetrahydrophenanthren-3(2H)-one","","- C15 H14 O3 -","- C15 H14 O3 -","- C60 H56 O12 -","4","1","FG1524","Miller, Alan J.; Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","(±)-3-Oxo-1,2,3,9,10,10a-hexahydrophenanthrene-10a-carboxylic acid: catemeric hydrogen bonding in a δ-keto acid","Acta Crystallographica Section C","1999","55","4","563","566","10.1107/S0108270198017417","","","0.71073","MoKα","","0.123","0.059","","0.138","0.109","","","","1.04","1.16","1.16","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008348","8.945","0.001","10.318","0.001","10.127","0.001","90","","96.4","0.01","90","","928.84","0.17","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(±)-1-Indanone-2-acetic Acid","(+\-)-2-(carboxymethyl)-2,3-dihydro-1H-indene-1-one","","- C11 H10 O3 -","- C11 H10 O3 -","- C44 H40 O12 -","4","1","FG1525","Lalancette, Roger A.; Brunskill, Andrew P. J.; Thompson, Hugh W.","(±)-1-Indanone-2-acetic and -2-propionic acids: catemeric <i>versus</i> dimeric hydrogen bonding in homologous γ- and δ-keto acids","Acta Crystallographica Section C","1999","55","4","568","572","10.1107/S0108270198017405","","","0.71073","MoKα","","0.069","0.043","","","","0.108","","","","","","1.03","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008349","8.093","0.001","8.326","0.001","15.614","0.002","90","","96.2","0.01","90","","1046","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(±)-1-Indanone-2-propionic Acid","(+\-)-2-(2-carboxyethyl)-2,3-dihydro-1H-inden-1-one","","- C12 H12 O3 -","- C12 H12 O3 -","- C48 H48 O12 -","4","1","FG1525","Lalancette, Roger A.; Brunskill, Andrew P. J.; Thompson, Hugh W.","(±)-1-Indanone-2-acetic and -2-propionic acids: catemeric <i>versus</i> dimeric hydrogen bonding in homologous γ- and δ-keto acids","Acta Crystallographica Section C","1999","55","4","568","572","10.1107/S0108270198017405","","","0.71073","MoKα","","0.074","0.048","","","","0.134","","","","","","1.06","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008350","13.2974","0.0006","7.9474","0.0004","27.3988","0.0014","90","","90","","90","","2895.5","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3,4-Dihydro-1H-isoquinoline-2-carbamoyl-3-methylimidazolium Iodide","","- C14 H16 I N3 O -","- C14 H16 I N3 O -","- C112 H128 I8 N24 O8 -","8","1","FG1529","Batey, Robert A.; Yoshina-Ishii, Chiaki; Lough, Alan J.","3-Methyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ylcarbonyl)imidazolium iodide","Acta Crystallographica Section C","1999","55","4","615","618","10.1107/S0108270198016473","","","0.71073","MoKα","","0.086","0.041","","","","0.091","","","","","","0.981","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008351","16.38","0.003","6.536","0.002","8.514","0.002","90","","90","","90","","911.5","0.4","296.2","","296.2","","","","","","","","","5","P n m a","-P 2ac 2n","62","2,3-Dicyano-1,4-dihydroxybenzene","","","- C8 H2 Cl2 N2 O2 -","- C8 H2 Cl2 N2 O2 -","- C32 H8 Cl8 N8 O8 -","4","0.5","FG1531","Hoshina, Gakuse; Ohba, Shigeru; Tsuchimoto, Masanobu","Redetermination of 2,3-dichloro-5,6-dicyano-1,4-dihydroxybenzene","Acta Crystallographica Section C","1999","55","4","592","594","10.1107/S0108270198017399","","","0.7107","MoKα","","0.038","0.031","","","","0.058","","","","","","0.991","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008352","9.6682","0.0009","33.169","0.002","9.9711","0.0008","90","","98.82","0.01","90","","3159.8","0.4","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H48 O4 Si4 -","- C23 H48 O4 Si4 -","- C92 H192 O16 Si16 -","4","1","FR1141","Moreno-Fuquen, Rodolfo; Jaramillo-Gómez, Luz Marina; Martín-Franco, Jaime","(<i>E</i>)-Dimethyl 4-isopropyl-3-[tris(trimethylsilyl)silylmethylene]-1,1-cyclohexanedicarboxylate","Acta Crystallographica Section C","1999","55","4","630","632","10.1107/S010827019801378X","","","0.71073","MoKα","","0.1005","0.0534","","0.1799","0.135","","","","1.097","1.015","1.015","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008353","9.153","0.001","11.495","0.001","10.277","0.001","90","","93.161","0.004","90","","1079.64","0.18","183","2","183","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Spiro[1-azabicyclo[5.3.0]decane-6,2'(5'H)-furan]-2'10-dione","","- C12 H15 N O3 -","- C12 H14.76 N O3 -","- C48 H59.04 N4 O12 -","4","2","FR1145","Lynch, Vincent M.; Bur, Scott K.; Martin, Stephen F.","Spiro[1-azabicyclo[5.3.0]decane-6,2'(5'<i>H</i>)-furan]-5',10-dione: an example of kryptoracemic crystallization","Acta Crystallographica Section C","1999","55","4","622","624","10.1107/S0108270198012748","","","0.71073","MoKα","","0.0377","0.0337","","0.0824","0.0796","","","","1.006","1.015","1.015","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008354","7.736","0.006","11.69","0.004","14.704","0.005","82.58","0.04","79.28","0.04","88.56","0.04","1295.6","1.2","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","2-Ethylthio-9-methyl-1,4-dihydroacridine-1,4-dione","","- C16 H13 N O2 S -","- C16 H13 N O2 S -","- C64 H52 N4 O8 S4 -","4","2","FR1151","Baker, L.-J.; Clark, George R.; Copp, Brent R.; Hansen, Richard P.; Squire, Christopher J.","2-Ethylthio-9-methyl-1,4-dihydroacridine-1,4-dione and 9-methyl-2-(4-tolylthio)-1,4-dihydroacridine-1,4-dione","Acta Crystallographica Section C","1999","55","4","634","636","10.1107/S0108270198014929","","","0.71073","MoKα","","0.092","0.055","","","","0.154","","","","","","1.031","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008355","9.2792","0.0002","8.7627","0.0002","20.1726","0.0005","90","","98.445","0.001","90","","1622.47","0.07","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","9-methyl-2-(4-tolylthio)-1,4-dihydroacridine-1,4-dione","","- C21 H15 N O2 S -","- C21 H15 N O2 S -","- C84 H60 N4 O8 S4 -","4","1","FR1151","Baker, L.-J.; Clark, George R.; Copp, Brent R.; Hansen, Richard P.; Squire, Christopher J.","2-Ethylthio-9-methyl-1,4-dihydroacridine-1,4-dione and 9-methyl-2-(4-tolylthio)-1,4-dihydroacridine-1,4-dione","Acta Crystallographica Section C","1999","55","4","634","636","10.1107/S0108270198014929","","","0.71073","MoKα","","0.043","0.035","","","","0.094","","","","","","1.042","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008356","5.406","0.004","6.512","0.004","13.118","0.005","74.52","0.03","79.4","0.03","70.3","0.03","416.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Copper(II)diaquadi(3,6-dicarboxylatopyridazinium)dihydrate","Copper(II)diaquadi(3,6-dicarboxylatopyridazinium)dihydrate","","- C12 H14 Cu N4 O12 -","- C12 H14 Cu N4 O12 -","- C12 H14 Cu N4 O12 -","1","0.5","FR1155","Sobanska, Sophie; Lagrenee, Michel; Wignacourt, Jean-Pierre; Holt, Elizabeth M.","Diaquabis(pyridazin-1-ium-3,6-dicarboxylato-<i>N</i>^2^,<i>O</i>^3^)copper(II) dihydrate","Acta Crystallographica Section C","1999","55","4","553","555","10.1107/S0108270199000116","","","0.71069","MoKα","","0.038","0.035","","","","0.09","","","","","","1.083","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008357","27.7745","0.0012","7.327","0.0003","11.9575","0.0005","90","","91.126","0.001","90","","2432.93","0.18","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","p-Hydroxybenzaldehyde nicotinoylhydrazone monohydrate","","- C13 H13 N3 O3 -","- C13 H13 N3 O3 -","- C104 H104 N24 O24 -","8","1","FR1156","Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak; Zhong-Lin Lu; Bei-Sheng Kang","<i>p</i>-Hydroxybenzaldehyde nicotinoylhydrazone monohydrate","Acta Crystallographica Section C","1999","55","4","574","576","10.1107/S0108270198015893","","","0.71073","MoKα","","0.1211","0.0639","","","","0.146","","","","","","1.058","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008358","9.9152","0.0006","11.0521","0.0007","13.763","0.001","69.6","0.005","73.969","0.006","65.035","0.005","1266.67","0.16","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H27 N O6 -","- C28 H27 N O6 -","- C56 H54 N2 O12 -","2","1","FR1166","Özbey, Süheyla; Kendi, Engin; Kılcıgil Ayhan, Gülgün; Ertan, Rahmiye","A flavone 1,4-dihydropyridine calcium antagonist","Acta Crystallographica Section C","1999","55","4","678","680","10.1107/S0108270198014930","","","0.71069","MoKα","","","0.047","","","0.054","","","","","1.05","1.05","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008359","12.5684","0.0009","14.4723","0.001","6.1016","0.0009","90","","90","","90","","1109.8","0.2","150","2","150","2","","","","","","","","2","P n a 21","P 2c -2n","33","Acefluoranthylene","Cyclopenta[cd]fluoranthene","","- C18 H10 -","- C18 H10 -","- C72 H40 -","4","1","GD1006","Lutz, Martin; Spek, Anthony L.; Sarobe, Martin; Jenneskens, Leonardus W.","Acefluoranthylene","Acta Crystallographica Section C","1999","55","4","659","661","10.1107/S0108270198013298","","","0.71073","MoKα","","0.04","0.034","","","","0.089","","","","","","1.024","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008360","13.271","0.002","6.674","0.002","14.79","0.001","90","","97.505","0.01","90","","1298.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","t-butylammonium hydrogenphenylphosphate","","- C10 H18 N O4 P -","- C10 H18 N O4 P -","- C40 H72 N4 O16 P4 -","4","1","GD1010","Reinoso, Santiago; Vitoria, Pablo; Ugalde, Maria; Gutiérrez-Zorrilla, Juan M.; Luque, Antonio; Román, Pascual","<i>tert</i>-Butylammonium hydrogen phenyl phosphate","Acta Crystallographica Section C","1999","55","4","683","685","10.1107/S0108270198016734","","","0.71069","MoKα","","","0.037","","0.053","0.043","","","","","","","3.11","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008361","10.494","0.004","13.11","0.004","13.485","0.004","90","","90","","90","","1855.2","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Complexe de cuivre(II) diamino-1,2(cyclohexane diacétatodiacétique) trihydrate","","- C14 H26 Cu N2 O11 -","- C14 H26 Cu N2 O11 -","- C56 H104 Cu4 N8 O44 -","4","1","GS1006","Ben Amor, Fatma; Jouini, Tahar","Complexe de cuivre(II) diamino-1,2-(cyclohexane diacétatodiacétique) trihydrate","Acta Crystallographica Section C","1999","55","4","499","501","10.1107/S0108270198011561","","","0.71069","MoKα","","0.048","0.037","","0.1","0.09","","","","1.093","1.061","1.061","","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2008362","7.095","0.002","11.761","0.004","8.419","0.003","90","","98.4","0.02","90","","695","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Aqua(N,N,N',N'-tetramethylethylenediamine)diisothiocyanato-copper(II)","","- C8 H18 Cu N4 O S2 -","- C8 H18 Cu N4 O S2 -","- C16 H36 Cu2 N8 O2 S4 -","2","1","GS1023","Vrábel, Viktor; Garaj, Ján; Sivý, Július; Oktavec, Drahomír","Aquadiisothiocyanato(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section C","1999","55","4","551","553","10.1107/S0108270198014553","","","0.71069","MoKα","","0.033","0.024","","0.06","0.059","","","","0.83","0.901","0.901","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008363","8.761","0.0005","8.8907","0.0004","10.4403","0.0006","112.419","0.004","106.101","0.005","96.407","0.004","700.3","0.08","293","","","","","","","","","","","4","P -1","-P 1","2","","diclhoro (phenylethinyl)(butyl)tellurium(IV)","","- C12 H14 Cl2 Te -","- C12 H14 Cl2 Te -","- C24 H28 Cl4 Te2 -","2","1","GS1025","Zukerman-Schpector, J.; Camillo, Robinson L.; Dabdoub, Miguel J.; Begnini, Mauro L.; Caracelli, I.","Butyldichloro(phenylethynyl)tellurium(IV)","Acta Crystallographica Section C","1999","55","4","648","650","10.1107/S0108270198014565","","","0.71073","MoKα","","0.03","0.028","","0.077","","0.075","","","1.117","","","1.122","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008364","14.361","0.002","13.711","0.002","7.475","0.002","90","","90","","90","","1471.9","0.5","293","","293","","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C11 H17 N O6 P2 -","- C11 H17 N O6 P2 -","- C44 H68 N4 O24 P8 -","4","1","GS1026","Saint-Clair, Jean-François; Siméon, Fabrice; Villemin, Didier; Averbuch-Pouchot, Marie-Thérèse","2-Hydroxy-5-methyl-2-oxo-6-phenyl-4-phosphonomethyl-1,4,2-oxazoniaphosphorinane","Acta Crystallographica Section C","1999","55","4","588","590","10.1107/S0108270198016643","","","0.7107","MoKα","","0.0264","0.0264","","0.0331","0.0331","","","","1.836","1.836","1.836","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008365","12.7246","0.0015","9.5273","0.0017","18.451","0.002","90","","93.098","0.012","90","","2233.6","0.5","296","1","296","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(4-methylbenzoyl)-6-(4-methylbenzilidene)-3-phenyl-2oxa-3-azabicyclo[3.3.0] oct-7-ene","","- C28 H25 N O2 -","- C28 H25 N O2 -","- C112 H100 N4 O8 -","4","1","GS1028","Djapa, Francis; Ciamala, Kabula; Vebrel, Joël; Kubicki, Marek M.; Blacque, Olivier","4-(4-Methylbenzoyl)-6-(4-methylbenzylidene)-3-phenyl-2-oxa-3-azabicyclo[3.3.0]oct-7-ene","Acta Crystallographica Section C","1999","55","4","677","678","10.1107/S0108270198015947","","","0.71073","MoKα","","0.1658","0.0502","","","","0.1564","","","","","","0.995","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008366","3.7946","0.0002","19.1766","0.0007","13.0641","0.0006","90","","96.893","0.001","90","","943.77","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Aminopyrimidine-Fumaric Acid (1:2) co-crystal","","- C8 H9 N3 O4 -","- C8 H9 N3 O4 -","- C32 H36 N12 O16 -","4","1","HA1239","Shyamaprosad Goswami; Ajit Kumar Mahapatra; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun; Ibrahim Abdul Razak","2-Aminopyrimidine‒fumaric acid cocrystal","Acta Crystallographica Section C","1999","55","4","583","585","10.1107/S0108270198014127","","","0.71073","MoKα","","0.103","0.067","","","","0.184","","","","","","1.055","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008367","7.1276","0.0006","7.886","0.0006","8.9938","0.0007","100.143","0.002","91.493","0.002","110.972","0.001","462.47","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Acetylamino-6-methylpyridine N-oxide monohydrate","","- C8 H12 N2 O3 -","- C8 H12 N2 O3 -","- C16 H24 N4 O6 -","2","1","HA1243","Shyamaprasad Goswami; Kumaresh Ghosh; Ajit Kumar Mahapatra; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun","2-Acetylamino-6-methylpyridine <i>N</i>-oxide monohydrate","Acta Crystallographica Section C","1999","55","4","579","581","10.1107/S0108270198014139","","","0.71073","MoKα","","0.071","0.05","","","","0.161","","","","","","1.044","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008368","13.585","0.002","35.391","0.007","7.067","0.002","90","","90","","90","","3397.7","1.3","296.2","","296.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-(2-aminoethyl)-2,3-diphenylpiperazine hydrochloride","","- C18 H24 Cl N3 -","- C18 H24 Cl N3 -","- C144 H192 Cl8 N24 -","8","1","HA1247","Sarmistha Basu Majumder; Monika Mukherjee; Goutam Kumar Patra; Dipankar Datta; Madeleine Helliwell","2-(2,3-Diphenylpiperazin-1-yl)ethylammonium chloride","Acta Crystallographica Section C","1999","55","4","668","670","10.1107/S0108270198017648","","","1.5418","CuKα","","0.14","0.0561","","0.2646","0.1371","","","","1.056","1.042","1.042","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008369","7.375","0.0001","12.53","0.0002","15.8752","0.0002","84.095","0.001","86.38","0.001","77.933","0.001","1425.67","0.04","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","3,5,7,3'-tetrahydroxy-4'-methoxyflavone monohydrate","","- C16 H14 O8 -","- C16 H14 O8 -","- C64 H56 O32 -","4","2","HA1249","Nor Syarmila Shuib; Teng Wah Sam; Keng Chong Wong; Kandasamy Chinnakali; Hoong-Kun Fun","Tamarixetin monohydrate","Acta Crystallographica Section C","1999","55","4","576","578","10.1107/S0108270198017430","","","0.71073","MoKα","","0.076","0.059","","","","0.163","","","","","","1.184","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008370","31.425","0.005","14.289","0.002","12.375","0.002","90","","90","","90","","5556.8","1.5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C26 H36 Cl N3 O8 Zn -","- C26 H36 Cl N3 O8 Zn -","- C208 H288 Cl8 N24 O64 Zn8 -","8","1","JZ1294","Balogh-Hergovich, Éva; Kaizer, József; Speier, Gábor; Huttner, Gottfried; Rutsch, Peter","[3,3'-Iminobis(<i>N</i>,<i>N</i>-dimethylpropylamine)](4'-methoxyflavonolato)zinc(II) perchlorate, [Zn(4'-MeOfla)(idpaH)]ClO~4~","Acta Crystallographica Section C","1999","55","4","557","558","10.1107/S0108270198016795","","","0.71073","MoKα","","0.097","0.059","","","","0.104","","","","","","1.123","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008371","11.684","0.002","14.943","0.003","16.749","0.003","105.79","0.01","106.85","0.01","91.36","0.01","2676.4","0.9","293","2","","","","","","","","","","7","P -1","-P 1","2","","Chlorobis-[1,2-bis(diphenylphosphino)ethane]oxotungsten(IV) hexafluorophospate chloroform solvate","","- C53 H49 Cl4 F6 O P5 W -","- C53 H49 Cl4 F6 O P5 W -","- C106 H98 Cl8 F12 O2 P10 W2 -","2","1","JZ1303","Llusar, R.; Mata, J.; Peris, E.; Köckerling, M.","The oxotungsten(IV) complex [WOCl(Ph~2~PCH~2~CH~2~PPh~2~)~2~]PF~6~^.^CHCl~3~","Acta Crystallographica Section C","1999","55","4","506","508","10.1107/S0108270198015856","","","0.71073","MoKα","","","0.046","","","","0.048","","","","1.421","1.421","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008372","11.663","0.004","25.704","0.005","12.07","0.004","90","","103.856","0.014","90","","3513.1","1.8","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","μ-Oxo-bis-[N,N'-ehtylene-bis(2-thioacetophenonidenimine)iron(III)]","","- C36 H36 Fe2 N4 O S4 -","- C36 H36 Fe2 N4 O S4 -","- C144 H144 Fe8 N16 O4 S16 -","4","1","JZ1316","Karsten, Peter; Strähle, Joachim","μ-Oxo-bis[<i>N</i>,<i>N</i>'-ethylenebis(2-thioacetophenonidenimine)iron(III)]","Acta Crystallographica Section C","1999","55","4","488","489","10.1107/S0108270198014826","","","1.5418","CuKα","","0.0909","0.0563","","0.194","","0.1514","","","0.931","","","0.854","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008373","3.9321","0.0008","10.886","0.002","8.3","0.0009","90","","103.6","0.01","90","","345.32","0.1","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C4 O2 S4 -","- C4 O2 S4 -","- C8 O4 S8 -","2","0.5","JZ1320","Harald Müller; Marie-Thérèse Averbuch","1,3,4,6-Tetrathiapentalene-2,5-dione","Acta Crystallographica Section C","1999","55","4","590","592","10.1107/S0108270198014346","","","0.7107","MoKα","","0.0295","0.0295","","0.0448","0.0448","","","","1.919","1.919","1.919","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008374","26.392","0.006","8.041","0.001","18.168","0.004","90","","132.39","0.01","90","","2847.6","1.1","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis{μ-[N,N'-diethyl-N,N'-bis(β-mercaptoethyl)-1,3- propanediamine]}dimanganese(II).","","- C22 H48 Mn2 N4 S4 -","- C22 H48 Mn2 N4 S4 -","- C88 H192 Mn8 N16 S16 -","4","0.5","JZ1322","Jörg Schneider; Birgit Schnautz; Ralf Hauptmann; Gerald Henkel","Bis(μ-3,7-diethyl-3,7-diazanonane-1,9-dithiolato)dimanganese(II)","Acta Crystallographica Section C","1999","55","4","489","491","10.1107/S0108270198016485","","","0.71073","MoKα","","","0.0245","","","","0.0646","","","","1.091","1.091","","","","","has coordinates","198476","2020-10-21","18:00:00",""
"2008375","9.798","0.003","18.752","0.004","19.246","0.002","90","","90","","90","","3536.1","1.4","293","","293","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(2S,4S,5R,6S)-2-benzylcarbamoyl-6-bromo-3,3-dimethyl-4-thia-1- -azabicyclo[3.2.0]heptan-7-one 4-oxide hydrate","","- C15 H19 Br N2 O4 S -","- C15 H19 Br N2 O4 S -","- C120 H152 Br8 N16 O32 S8 -","8","2","KA1291","Danilovski, Aleksandar; Vinković, Mladen; Herak, Jure J.","Two novel optically active penam derivatives","Acta Crystallographica Section C","1999","55","4","656","659","10.1107/S0108270198015108","","","0.71073","MoKα","","0.28","0.069","","0.178","0.118","","","","0.969","1.239","1.239","","","","","has coordinates","203832","2020-10-21","18:00:00",""
"2008376","5.295","0.006","11.559","0.008","11.698","0.011","90","","90.64","0.08","90","","715.9","1.2","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","(5R)-3-benzylimino-2-isopropylidene-4-thia-1-azabicyclo[3.2.0]heptan-7-one","","- C15 H16 N2 O S -","- C15 H16 N2 O S -","- C30 H32 N4 O2 S2 -","2","1","KA1291","Danilovski, Aleksandar; Vinković, Mladen; Herak, Jure J.","Two novel optically active penam derivatives","Acta Crystallographica Section C","1999","55","4","656","659","10.1107/S0108270198015108","","","0.71073","MoKα","","0.128","0.061","","0.143","0.115","","","","0.992","1.164","1.164","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008377","12.5516","0.0015","7.6362","0.0007","19.828","0.002","90","","94.049","0.011","90","","1895.7","0.3","134","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Acetyl-2-(3,3-dimethyl-2-butylidene)hydrazine.","","- C8 H16 N2 O -","- C8 H16 N2 O -","- C64 H128 N16 O8 -","8","2","KA1301","Bats, Jan W.; Grundl, Marc A.; Hashmi, A. Stephen K.","1-Acetyl-2-(3,3-dimethyl-2-butylidene)hydrazine: a monoclinic crystal structure with local orthorhombic pseudosymmetry","Acta Crystallographica Section C","1999","55","4","689","691","10.1107/S0108270198015157","","","0.71073","Mo-Kα","","","0.063","","","0.053","","","","","1.283","1.283","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008378","14.0723","0.0009","7.462","0.002","21.489","0.001","90","","90","","90","","2256.5","0.6","296","1","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2,2'-Dibromobiphenyl","","- C12 H8 Br2 -","- C12 H8 Br2 -","- C96 H64 Br16 -","8","1","LN1062","MacNeil, Dean D.; Decken, Andreas","2,2'-Dibromobiphenyl","Acta Crystallographica Section C","1999","55","4","628","630","10.1107/S0108270198015339","","","1.54178","CuKα","","","0.0326","","","","0.113","","","","","","1.032","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008379","14.627","0.003","15.834","0.004","43.135","0.013","90","","90","","90","","9990","4","203","1","203","1","","","","","","","","5","F 2 d d","F -2d 2","43","","1,13-Diaza-2,14-cyclotetraeicosanedione","","- C22 H43 Cl N2 O2 -","- C22 H43 Cl N2 O2 -","- C352 H688 Cl16 N32 O32 -","16","1","LN1071","Escudero, Encarnacion; Subirana, José A.; Solans, Xavier","Amino-11-undecanoic acid cyclic dimer hydrochloride","Acta Crystallographica Section C","1999","55","4","644","646","10.1107/S0108270198015480","","","0.71069","MoKα","","0.2026","0.0494","","","","0.1966","","","","","","0.847","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008380","9.308","0.002","10.6395","0.0019","11.225","0.002","86.959","0.016","70.753","0.019","79.375","0.018","1031.5","0.4","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","7,11-Dihydro-9,10-dimethoxy-3,11b-diphenyl[1,2,4]oxadiazolo[5,4-a][2,3] benzodiazepin-6(5H)-one","","- C24 H21 N3 O4 -","- C24 H21 N3 O4 -","- C48 H42 N6 O8 -","2","1","NA1353","Bruno, Giuseppe; Chimirri, Alba; Gitto, Rosaria; Nicoló, Francesco; Scopelliti, Rosario","7,11b-Dihydro-9,10-dimethoxy-3,11b-diphenyl[1,2,4]oxadiazolo[5,4-<i>a</i>][2,3]benzodiazepin-6(5<i>H</i>)-one","Acta Crystallographica Section C","1999","55","4","685","687","10.1107/S010827019801227X","","","0.71073","MoKα","","0.0623","0.0342","","0.0802","0.0754","","","","0.796","1","1","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008381","6.1418","0.0002","7.5325","0.0001","14.5931","0.0005","91.876","0.002","101.71","0.001","95.106","0.002","657.55","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","fluoropyridyl-biphenyl","1-perfluoropyridyl-4-phenylbenzene","","- C17 H9 F4 N -","- C17 H9 F4 N -","- C34 H18 F8 N2 -","2","1","NA1381","Resel, Roland; Thurner, Philipp; Kahlert, Hartmut; Völlenkle, Horst; Winkler, Berthold; Müllner, Ruth; Stelzer, Franz; Tunega, Daniel; Leising, Günther","4-(4-Biphenyl)-2,3,5,6-tetrafluoropyridine, a new material for application in light-emitting diodes","Acta Crystallographica Section C","1999","55","4","693","695","10.1107/S0108270198015169","","","0.71073","MoKα","","0.065","0.046","","0.167","0.135","","","","1.189","1.116","1.116","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008382","9.2654","0.0012","10.6629","0.0014","27.703","0.004","90","","90","","90","","2736.9","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(25R)-3beta-bromo-6beta-acetoxy-5alfa-spirostan-23-one","","- C29 H43 Br O5 -","- C29 H43 Br O5 -","- C116 H172 Br4 O20 -","4","1","NA1383","Héctor Novoa de Armas; Norbert M. Blaton; Oswald M. Peeters; Camiel J. De Ranter; Ramón Pomés Hernández; Martín A. Iglesias Arteagas; Roxana Pérez Gil; Francisco Coll Manchado","(25<i>R</i>)-6β-Acetoxy-3β-bromo-5α-spirostan-23-one","Acta Crystallographica Section C","1999","55","4","601","603","10.1107/S0108270198016382","","","1.54178","CuKα","","0.081","0.061","","0.171","","0.142","","","1.097","","","1.097","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008383","9.185","0.001","12.052","0.001","18.899","0.001","90","","90","","90","","2092.1","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(1S,R~S~)-N-methyl-6,7-dimethoxy-1-(p-tolylsulfinyl)methyl- 1-trifluoromethyl-1,2,3,4-tetrahydroisoquinoline","","- C21 H24 F3 N O3 S -","- C21 H24 F3 N O3 S -","- C84 H96 F12 N4 O12 S4 -","4","1","NA1386","Pierfrancesco Bravo; Eleonora Corradi; Marcello Crucianelli; Stefano Valdo Meille; Matteo Zanda","(1<i>S</i>,<i>R</i>~S~)-6,7-Dimethoxy-<i>N</i>-methyl-1-(<i>p</i>-tolylsulfinylmethyl)-1-trifluoromethyl-1,2,3,4-tetrahydroisoquinoline","Acta Crystallographica Section C","1999","55","4","687","689","10.1107/S0108270198016114","","","1.5418","CuKα","","0.0757","0.0575","","","","0.1612","","","","","","1.057","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008384","9.619","0.001","10.325","0.002","18.91","0.003","90","","90","","90","","1878.1","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)1-(1-hydroxymethyl-propyl)-pyrrolidine-2,5-dione","","- C8 H13 N O3 -","- C8 H13 N O3 -","- C64 H104 N8 O24 -","8","2","NA1387","Pilati, Tullio; G. Biju Kumar; Amrish C. Shah","(<i>R</i>)-<i>N</i>-(1-Hydroxybut-2-yl)pyrrolidine-2,5-dione","Acta Crystallographica Section C","1999","55","4","612","613","10.1107/S010827019801484X","","","0.71073","MoKα","","0.0956","0.0465","","","","0.1163","","","","","","0.97","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008385","11.8787","0.0008","15.483","0.001","12.3467","0.0008","90","","108.21","0.01","90","","2157.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,3,6,6-tetramethyl-9-(3-nitrophenyl)-3,4,5,6,10-hexahydroacridine- 1,8(2H,7H)-dione","","- C23 H26 N2 O4 -","- C23 H26 N2 O4 -","- C92 H104 N8 O16 -","4","1","NA1388","Héctor Novoa de Armas; Norbert M. Blaton; Oswald M. Peeters; Camiel J. De Ranter; Margarita Suárez Navarro; Yamila Verdecia Reyes; Estael Ochoa Rodríguez; Esperanza Salfrán","3,3,6,6-Tetramethyl-9-(3-nitrophenyl)-3,4,5,6,9,10-hexahydroacridine-1,8(2<i>H</i>,7<i>H</i>)-dione","Acta Crystallographica Section C","1999","55","4","596","599","10.1107/S0108270198016394","","","1.54178","CuKα","","0.087","0.059","","","","0.186","","","1.108","","","1.108","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008386","7.163","0.001","18.299","0.001","10.407","0.001","90","","109.55","0.01","90","","1285.5","0.2","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Co N4 O8 -","- C26 H26 Co N4 O8 -","- C52 H52 Co2 N8 O16 -","2","0.5","NA1389","Hökelek, Tuncer; Necefoğlu, Hacalı","<i>trans</i>-Diaquabis(benzoato-<i>O</i>)bis(nicotinamide-<i>N</i>^1^)cobalt(II)","Acta Crystallographica Section C","1999","55","4","545","547","10.1107/S0108270199000153","","","0.71073","MoKα","","","0.027","","","0.038","","","","","1.38","1.38","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008387","7.7585","0.0005","15.606","0.001","22.8759","0.0009","90","","90","","90","","2769.8","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl-4β-bromine-7α-cathyloxy-3-oxo-5β-cholanoate","","- C28 H43 Br O6 -","- C28 H40 Br O6 -","- C112 H160 Br4 O24 -","4","1","NA1393","Héctor Novoa de Armas; Norbert M. Blaton; Oswald M. Peeters; Camiel J. De Ranter; Ramón Pomés Hernández; Francisco Coll Manchado; Roxana Pérez Gil","Methyl 4β-bromo-7α-cathyloxy-3-oxo-5β-cholanoate","Acta Crystallographica Section C","1999","55","4","599","601","10.1107/S0108270198016400","","","1.54178","CuKα","","0.054","0.044","","","","0.138","","","1.071","","","1.071","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2008388","10.6629","0.0004","9.8546","0.0004","17.5982","0.0008","90","","94.249","0.001","90","","1844.11","0.13","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-benzoyl-1-naphthylbenzoate","","- C24 H16 O3 -","- C24 H16 O3 -","- C96 H64 O12 -","4","1","NA1396","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan","2-Benzoyl-1-naphthyl benzoate","Acta Crystallographica Section C","1999","55","4","587","588","10.1107/S010827019801765X","","","0.71073","MoKα","","0.105","0.065","","","","0.18","","","","","","1.142","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008389","9.245","0.002","16.226","0.002","8.828","0.002","92.41","0.01","98.17","0.02","78.08","0.01","1282.5","0.4","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","5-(8,8-Dicyanoheptafulven-3-yl)-2-hydroxy-1,3-xylyl-18-crown-5 potassium salt monohydrate","","- C26 H29 K N2 O7 -","- C26 H29 K N2 O7 -","- C52 H58 K2 N4 O14 -","2","1","OA1064","Shinya Matsumoto; Kaname Yumura; Hiroyuki Otani; Jin Mizuguchi","5-(8,8-Dicyanoheptafulven-3-yl)-2-hydroxy-1,3-xylyl-18-crown-5 potassium salt monohydrate","Acta Crystallographica Section C","1999","55","4","536","538","10.1107/S0108270198014772","","","1.5418","CuKα","","0.1006","0.0556","","0.0687","0.0605","","","","1.23","1.312","1.312","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008390","18.62","0.01","12.691","0.008","17.42","0.01","90","","121.17","0.05","90","","3522","4","298","","298","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Bromo-2,3-diphenylmethano-2,3-dihydronaphthoquinone","","- C23 H15 Br O2 -","- C23 H15 Br O2 -","- C184 H120 Br8 O16 -","8","1","OA1073","Takumi Oshima; Kazuaki Fukushima; Tatsuya Kawamoto","2-Bromo-2,3-diphenylmethano-2,3-dihydronaphthoquinone","Acta Crystallographica Section C","1999","55","4","608","610","10.1107/S0108270198015212","","","0.71073","MoKα","","","0.054","","","0.067","","","","","2.296","2.296","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008391","13.15","0.002","11.545","0.002","14.565","0.002","90","","102.02","0.01","90","","2162.7","0.6","297","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(pyridine)-bis(2-thiopheneglyoxylato-O^1^,O^2^)copper(II)","","- C22 H16 Cu N2 O6 S2 -","- C22.334 H15.8 Cu N2 O6 S1.876 -","- C89.336 H63.2 Cu4 N8 O24 S7.504 -","4","0.5","OA1077","Nakasa, Kazuyuki; Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru","Copper(II) 2-thiopheneglyoxylate adducts with pyridine derivatives","Acta Crystallographica Section C","1999","55","4","513","517","10.1107/S0108270198016424","","","0.71073","MoKα","","","0.039","","","0.04","","","","","1.401","1.401","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008392","20.16","0.003","9","0.002","24.497","0.003","90","","118.47","0.01","90","","3907.2","1.2","298","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[bis(2-thiopheneglyoxylato-O^1^,O^2^)copper(II) -μ-(2-thiopheneglyoxylato-O^1^:O^1^,O^2^)-bis(3-methylpyridine)copper(II) -μ-(2-thiopheneglyoxylato-O^1^,O^2^:O^1^)monohydrate","","- C36 H28 Cu2 N2 O13 S4 -","- C37.666 H27 Cu2 N2 O13 S3.376 -","- C150.664 H108 Cu8 N8 O52 S13.504 -","4","0.5","OA1077","Nakasa, Kazuyuki; Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru","Copper(II) 2-thiopheneglyoxylate adducts with pyridine derivatives","Acta Crystallographica Section C","1999","55","4","513","517","10.1107/S0108270198016424","","","0.71073","MoKα","","","0.052","","","0.05","","","","","1.643","1.643","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008393","11.894","0.002","18.092","0.003","11.452","0.002","90","","90","","90","","2464.3","0.7","299","","","","","","","","","","","6","P n c a","-P 2a 2n","60","","Bis(4-methylpyridine)-bis(2-thiopheneglyoxylato-O^1^,O^2^)copper(II)","","- C24 H20 Cu N2 O6 S2 -","- C24 H20 Cu N2 O6 S2 -","- C96 H80 Cu4 N8 O24 S8 -","4","0.5","OA1077","Nakasa, Kazuyuki; Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru","Copper(II) 2-thiopheneglyoxylate adducts with pyridine derivatives","Acta Crystallographica Section C","1999","55","4","513","517","10.1107/S0108270198016424","","","0.71073","MoKα","","","0.054","","","0.049","","","","","1.421","1.421","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008394","15.005","0.003","20.397","0.004","6.342","0.0013","90","","90","","90","","1941","0.7","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","tri-p-tolyltriazine","2,4,6-tris-(4-Methylphenyl)-1,3,5-triazine","","- C24 H21 N3 -","- C24 H21 N3 -","- C96 H84 N12 -","4","0.5","OA1078","Thalladi, Venkat R.; Muthuraman, Meiyappan; Nangia, Ashwini; Desiraju, Gautam R.","Tri-<i>p</i>-tolyl-1,3,5-triazine","Acta Crystallographica Section C","1999","55","4","698","700","10.1107/S0108270198018496","","","0.71073","MoKα","","0.072","0.049","","0.14","0.121","","","","1.171","1.191","1.191","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008395","7.922","0.002","8.198","0.002","26.58","0.004","90","","90","","90","","1726.2","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","N-Pentenoyl Sultam","3H-3aR,6S,7aS-8,8-Dimethyl-N-[(3S)-3,4-dimethylpent-4-enoyl]-2,2- dioxo-3a-6-methano-4,5,6,7-tetrahydro-2,1-benzisothiazole","","- C17 H27 N O3 S -","- C17 H27 N O3 S -","- C68 H108 N4 O12 S4 -","4","1","OB1002","Hughes, Andrew B.; Mackay, Maureen F.; McCaffrey, Narelle L.","Absolute structure of an <i>N</i>-pentenoyl benzisothiazole","Acta Crystallographica Section C","1999","55","4","610","612","10.1107/S0108270198016126","","","1.5418","CuKα","","0.054","0.054","","0.152","0.144","","","","1.055","1.047","1.047","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008396","8.517","0.002","7.731","0.002","10.83","0.002","90","","90.38","0.03","90","","713.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H16 Cl2 N4 O10 -","- C6 H16 Cl2 N4 O10 -","- C12 H32 Cl4 N8 O20 -","2","0.5","OS1034","Cheng-Yong Su; Wen-Jun Zhang; Bei-Sheng Kang","<i>N</i>,<i>N</i>'-Bis(2-ammonioethyl)oxamide diperchlorate","Acta Crystallographica Section C","1999","55","4","636","637","10.1107/S010827019801470X","","","0.71073","MoKα","","0.0721","0.0662","","0.1746","0.1681","","","","1.115","1.115","1.115","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008397","4.76","0.001","26.181","0.005","9.62","0.002","90","","92.86","0.0005","90","","1197.4","0.4","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Caesium 5-(2-cyanoethylthio)-1,3-dithiole-2-thione-4-thiolate","","- C6 H4 Cs N S5 -","- C6 H4 Cs N S5 -","- C24 H16 Cs4 N4 S20 -","4","1","OS1038","Simonsen, Klaus B.; Simonsen, Ole; Becher, Jan","Caesium 5-(2-cyanoethylthio)-2-thioxo-1,3-dithiole-4-thiolate","Acta Crystallographica Section C","1999","55","4","547","549","10.1107/S0108270198017442","","","0.71073","MoKα","","0.046","0.033","","0.315","0.044","","","","8.19","1.189","1.189","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008398","10.223","0.001","11.48","0.001","12.058","0.001","81.619","0.008","70.668","0.006","87.605","0.006","1321","0.2","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H32 N2 O4 S2 -","- C27 H32 N2 O4 S2 -","- C54 H64 N4 O8 S4 -","2","1","OS1042","Hökelek, Tuncer; Patır, Süleyman","<i>N</i>-(2,2-Dimethoxyethyl)-<i>N</i>-{9-methoxymethyl-1,2,3,4-tetrahydrospiro[carbazole-1,2'-[1,3]dithiolan]-4-yl}benzamide","Acta Crystallographica Section C","1999","55","4","675","677","10.1107/S0108270198017454","","","0.71073","MoKα","","","0.0626","","","0.0786","","","","","1.31","1.31","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008399","5.842","0.002","16.593","0.005","17.561","0.007","90","","90","","90","","1702.3","1","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","toluene-4-sulfonic acid 2-isopropyl-5-methyl-cyclohexyl ester","","- C17 H26 O3 S -","- C17 H26 O3 S -","- C68 H104 O12 S4 -","4","1","QA0096","Degen, Alexander; Bolte, Michael","(‒)-3-<i>p</i>-Menthyl tosylate","Acta Crystallographica Section C","1999","55","4","IUC9900024","","10.1107/S0108270199099667","","","0.71073","MoKα","","0.039","0.031","","","","0.081","","","1.055","","","1.054","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008400","7.331","0.0001","14.0055","0.0003","9.2714","0.0002","90","","109.451","0.001","90","","897.6","0.03","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-(Arylazo)imidazole","","- C9 H8 N4 -","- C9 H8 N4 -","- C36 H32 N16 -","4","1","QA0098","Hoong-Kun Fun; Kandasamy Chinnakali; Xiao-Feng Chen; Xu-Hui Zhu; Xiao-Zeng You","(1<i>H</i>-Imidazol-2-yl)phenyldiazene","Acta Crystallographica Section C","1999","55","4","IUC9900025","","10.1107/S0108270199099631","","","0.71073","MoKα","","0.074","0.043","","","","0.131","","","","","","1.023","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008401","7.215","0.002","8.209","0.004","16.542","0.004","90","","100.21","0.02","90","","964.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Hydroxy-cyclooctanone-O-methyl-oxime","","- C9 H17 N O2 -","- C9 H17 N O2 -","- C36 H68 N4 O8 -","4","1","QA0099","Boese, Roland; Rademacher, Paul; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","5-Hydroxycyclooctanone <i>O</i>-methyloxime at 293K","Acta Crystallographica Section C","1999","55","4","IUC9900026","","10.1107/S010827019909962X","","","0.71073","MoKα","","0.057","0.042","","","","0.132","","","","","","1.027","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008402","8.916","0.003","6.0717","0.0015","12.62","0.003","90","","95.027","0.014","90","","680.6","0.3","103","2","103","2","","","","","","","","2","I 1 2/a 1","-I 2ya","15","","dispiro[2.1.2.1]octane","","- C8 H12 -","- C8 H12 -","- C32 H48 -","4","0.5","QA0100","Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","Dispiro[2.1.2.1]octane at 103K","Acta Crystallographica Section C","1999","55","4","IUC9900023","","10.1107/S0108270199099618","","","0.71073","MoKα","","0.069","0.054","","","","0.156","","","","","","1.047","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008403","9.222","0.005","9.365","0.005","16.728","0.009","90","","104.62","0.01","90","","1397.9","1.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Allyl-3-(ethoxycarbonylmethylen)-2-oxo-1,2,3,4-tetrahydroquinoxaline","","- C15 H16 N2 O3 -","- C15 H16 N2 O3 -","- C60 H64 N8 O12 -","4","1","QA0101","Sersra, Souad; Essassi, El-Mokhtar; El-Bali, Brahim; Bolte, Michael","Ethyl 4-allyl-4-oxo-1,2,3,4-tetrahydroquinoxalin-2-ylideneacetate","Acta Crystallographica Section C","1999","55","4","IUC9900021","","10.1107/S0108270199099655","","","0.71073","MoKα","","0.127","0.055","","","","0.135","","","","","","0.994","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008404","9.1581","0.0005","9.3318","0.0007","13.4647","0.0008","90","","100.14","0.005","90","","1132.74","0.13","293","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","azepinoquinoleine","6-chloro-5H-tetrahydroazepino[3,2-c]quinoleine","","- C13 H13 Cl N2 -","- C13 H13 Cl N2 -","- C52 H52 Cl4 N8 -","4","1","QA0102","Bureau, Isabelle; Chardon, Josiane; Leclaire, Andre; Hinschberger, Antoine; Rault, Sylvain","6-Chloro-1<i>H</i>-2,3,4,5-tetrahydroazepino[3,2-<i>c</i>]quinoline","Acta Crystallographica Section C","1999","55","4","IUC9900022","","10.1107/S010827019909959X","","","0.71073","MoKα","","0.152","0.044","","0.059","0.044","","","","0.739","","","1.008","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008405","44.3229","0.0004","13.3413","0.0001","25.3433","0.0001","90","","105.845","0.001","90","","14416.7","0.19","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[(acetato-O,O')bis(triphenylphosphine-P)silver(I)] monohydrate sesquiethanol solvate","","- C79 H77 Ag2 O6.5 P4 -","- C79 H77 Ag2 O6.5 P4 -","- C632 H616 Ag16 O52 P32 -","8","1","QA0103","Hanna, John V.; Ng, Seik Weng","Redetermination of bis[(acetato-<i>O</i>,<i>O</i>')bis(triphenylphosphine-<i>P</i>)silver(I)] monohydrate sesquiethanol solvate","Acta Crystallographica Section C","1999","55","4","IUC9900031","","10.1107/S0108270199099692","","","0.71073","MoKα","","0.071","0.043","","","","0.112","","","","","","1.013","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008406","7.3176","0.0006","8.9755","0.0006","17.909","0.001","90","","93.636","0.005","90","","1173.88","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1α,4α,4aβ,9β,9aβ,10β-hexahydro-9,10-Epithioanthracene-1,4-diol","","- C14 H14 O2 S -","- C14 H14 O2 S -","- C56 H56 O8 S4 -","4","1","QA0104","Bats, Jan W.; Krämer, Norbert H.; Linde, Hermann F.G.","1α,4α,4aβ,9β,10β,10aβ-Hexahydro-9,10-epithioanthracene-1,4-diol","Acta Crystallographica Section C","1999","55","4","IUC9900027","","10.1107/S0108270199099588","","","1.5418","CuKα","","0.034","0.034","","","","0.137","","","","","","2.148","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008407","11.9597","0.0001","18.3546","0.0003","15.0141","0.0003","90","","100.772","0.001","90","","3237.75","0.09","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Nitrito-O,O')bis(triphenylphosphine-P)silver(I)","","- C36 H30 Ag N O2 P2 -","- C36 H30 Ag N O2 P2 -","- C144 H120 Ag4 N4 O8 P8 -","4","1","QA0105","Hanna, John V.; Ng, Seik Weng","(Nitrito-<i>O</i>,<i>O</i>')bis(triphenylphosphine-<i>P</i>)silver(I)","Acta Crystallographica Section C","1999","55","4","IUC9900029","","10.1107/S0108270199099680","","","0.71073","MoKα","","0.087","0.046","","","","0.092","","","","","","1.024","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008408","8.6226","0.0016","8.6226","0.0016","21.73","0.005","90","","90","","90","","1615.6","0.6","125","2","125","2","","","","","","","","2","I 41/a :2","-I 4ad","88","","perfluoro-benzocyclobutene","","- C8 F8 -","- C8 F8 -","- C64 F64 -","8","0.5","QA0106","Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","2,3,4,5,7,7,8,8,-Octafluorobicyclo[4.2.0]octa-1,3,5-triene at 125K","Acta Crystallographica Section C","1999","55","4","IUC9900036","","10.1107/S0108270199099606","","","0.71073","MoKα","","0.074","0.063","","","","0.2","","","","","","1.075","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008409","9.985","0.002","14.839","0.003","12.744","0.003","90","","108.81","0.01","90","","1787.4","0.7","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 O4 -","- C22 H20 O4 -","- C88 H80 O16 -","4","1","QA0107","Elazami, Mohamed; Bitit, Najib; Kerbal, Abdelali; Fahim, Mohamed; El-Bali, Brahim; Bolte, Michael","Diethyl 2-anthracen-9-ylmethylenemalonate","Acta Crystallographica Section C","1999","55","4","IUC9900037","","10.1107/S0108270199099643","","","0.71073","MoKα","","0.112","0.054","","","","0.119","","","","","","1.017","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008410","10.195","0.0001","10.2164","0.0001","19.3172","0.0001","75.501","0.001","74.862","0.001","64.474","0.001","1730.53","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H30 N4 O3 W -","- C41 H30 N4 O3 W -","- C82 H60 N8 O6 W2 -","2","1","QB0073","Abboud, Khalil A.; He, Yingxia; McElwee-White, Lisa","Tricarbonylbis(1,2,3-triphenyl-1,3-diazaallyl)tungsten(IV)","Acta Crystallographica Section C","1999","55","4","IUC9900032","","10.1107/S0108270199099679","","","0.71073","MoKα","","0.033","0.027","","","0.058","0.061","","","","","","1.008","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008411","10.077","0.004","13.231","0.003","17.167","0.004","98.14","0.02","106.12","0.03","111.12","0.03","1975.2","1.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2,4-Di(triphenylphosphino)-closo-decaborane-Dichloromethane (1/1)","","- C37 H40 B10 Cl2 P2 -","- C37 H40 B10 Cl2 P2 -","- C74 H80 B20 Cl4 P4 -","2","1","QB0074","Yao, Hai-Jun; Hu, Chun-Hua; Dou, Jian-Min; Jin, Ruo-Shui; Zheng, Pei-Ju","2,4-Bis(triphenylphosphino)-<i>closo</i>-decaborane‒dichloromethane (1/1)","Acta Crystallographica Section C","1999","55","4","IUC9900033","","10.1107/S0108270199099576","","","0.71073","MoKα","","","0.057","","","","0.198","","","","","","1.046","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008412","5.493","0.002","10.104","0.002","16.288","0.004","97.26","0.02","93.4","0.02","92.6","0.03","893.9","0.4","173","2","","","","","","","","","","5","P -1","-P 1","2","Iodoproxyfan","3-(1H-imidazol-4-yl)propyl (4-iodophenyl)methyl ether hydrogen maleate","","- C17 H19 I N2 O5 -","- C17 H19 I N2 O5 -","- C34 H38 I2 N4 O10 -","2","1","QB0075","Kovalainen, Jari T.; Wegelius, Elina; Christiaans, Johannes A. M.; Huuskonen, Juhani; Gynther, Jukka","4-[3-(4-Iodophenylmethoxy)propyl]-1<i>H</i>-imidazolium hydrogen maleate (iodoproxyfan hydrogen maleate)","Acta Crystallographica Section C","1999","55","4","IUC9900035","","10.1107/S0108270199099564","","","0.71073","MoKα","","0.022","0.021","","","","0.057","","","","","","1.184","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008413","12.889","0.003","25.096","0.005","16.189","0.003","90","","94.812","0.015","90","","5218.1","1.9","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- Bi2 H88 Na6 Ni2 O112 W20 -","- Bi2 Na5.998 Ni1.62 O105 W20.38 -","- Bi4 Na11.996 Ni3.24 O210 W40.76 -","2","0.5","QB0077","Rosu, Cristina; Weakley, Timothy J.R.","Hexasodium tetrahydrogen bis(triaquanickelo)icosatungstodibismuthate(III)(10 ‒) 36-hydrate","Acta Crystallographica Section C","1999","55","4","IUC9900034","","10.1107/S0108270199099710","","","0.71073","MoKα","","0.117","0.052","","0.056","","0.05","","","1.35","","","1.5","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008414","9.364","0.0019","15.401","0.003","9.871","0.002","90","","112.38","0.03","90","","1316.3","0.5","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Cl2 P2 Pd -","- C26 H26 Cl2 P2 Pd -","- C52 H52 Cl4 P4 Pd2 -","2","0.5","QB0079","Guzman-Jimenez, Ilse Y.; Whitmire, Kenton H.","<i>trans</i>-Dichlorobis(methyldiphenylphosphine-<i>P</i>)palladium(II)","Acta Crystallographica Section C","1999","55","4","IUC9900028","","10.1107/S0108270199099709","","","0.71073","MoKα","","0.052","0.035","","","","0.098","","","","","","1.092","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008415","7.361","0.003","16.269","0.004","9.622","0.003","90","","97.6","0.03","90","","1142.2","0.7","299","","299","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","N,N'-bis(2-hydroxybenzyl)-1,2-diphenylethylenediamine","","","- C28 H28 N2 O2 -","- C28 H28 N2 O2 -","- C56 H56 N4 O4 -","2","0.5","QB0084","Hoshina, Gakuse; Ohba, Shigeru; Tsuchimoto, Masanobu","(<i>RS</i>,<i>SR</i>)-<i>N</i>,<i>N</i>'-Bis(2-hydroxybenzyl)-1,2-diphenylethylenediamine","Acta Crystallographica Section C","1999","55","4","IUC9900030","","10.1107/S0108270199099552","","","0.71073","MoKα","","0.125","0.066","","","","0.201","","","","","","1.048","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008416","10.9185","0.0011","28.281","0.004","8.638","0.0007","90","","90","","90","","2667.3","0.5","296","","296","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","L-menthyl (-)-3-methoxy-13-methyl-14-ethyl-11,12,13(S)14(R)- tetrahydrophenanthrene 13-carboxylate IUPAC: L-menthyl (-)-(1R,2S)-1-ethyl-7-methoxy-2-methyl- 1,2,3,4-tetrahydrophenanthrene-2-carboxylate","","- C29 H40 O3 -","- C29 H40 O3 -","- C116 H160 O12 -","4","1","QB0088","Robinson, Paul D.; Hou, Yuqing; Meyers, Cal Y.; Adler, Stuart; Banz, William J.; Winters, Todd A.","<small>L</small>-Menthyl ester of highly estrogenic (‒)-(<i>Z</i>)-bisdehydrodoisynolic acid 3-methyl ether","Acta Crystallographica Section C","1999","55","4","IUC9900020","","10.1107/S0108270199099540","","","0.71069","MoKα","","0.186","0.034","","","","0.121","","","","","","0.958","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008417","9.285","0.001","11.86","0.003","12.53","0.002","90","","102.94","0.01","90","","1344.8","0.4","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,5-di-tert-butyl-1,2-benzoquinone","","- C14 H20 O2 -","- C14 H20 O2 -","- C56 H80 O8 -","4","1","SK1163","Horng, Den-Nan; Chyn, Jong-Pyng; Shieh, Kuan-Jiunn; Chou, Jeh-Li; Wen, Yuh-Sheng","3,5-Di-<i>tert</i>-butyl-1,2-benzoquinone","Acta Crystallographica Section C","1999","55","4","652","653","10.1107/S010827019801436X","","","0.71073","MolybdenumKα","","0.081","0.044","","0.056","0.052","","","","","1.9","1.9","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008418","7.328","0.008","8.729","0.009","11.513","0.011","95.83","0.07","107.27","0.08","97.34","0.07","689.9","1.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Methyl 1,4,5,6-tetrahydro-2-methyl-4-(2-nitrophenyl)-6-oxo-pyridine-3- carboxylate","","- C14 H14 N2 O5 -","- C14 H14 N2 O5 -","- C28 H28 N4 O10 -","2","1","SK1228","Viktor Kettmann; Ján Svetlík","Methyl 1,4,5,6-tetrahydro-2-methyl-4-(2-nitrophenyl)-6-oxopyridine-3-carboxylate","Acta Crystallographica Section C","1999","55","4","661","663","10.1107/S0108270198015029","","","0.71073","MoKα","","0.104","0.06","","0.165","0.123","","","","1.041","1.182","1.182","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008419","4.8912","0.0006","11.6238","0.0012","5.6581","0.0003","90","","91.279","0.006","90","","321.61","0.05","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,2-Ethylenebis(phosphonic acid)","","","- C2 H8 O4 P2 -","- C2 H8 O4 P2 -","- C4 H16 O8 P4 -","2","0.5","SK1229","Joachim Bruckmann; Carl Krüger; Christian W. Lehmann; Walter Leitner; Jörg Rust; Christian Six","Ethylenebis(phosphonic acid)","Acta Crystallographica Section C","1999","55","4","695","696","10.1107/S0108270198016448","","","0.71069","MoKα","","0.041","0.038","","","0.115","0.118","","","","","","1.286","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008420","6.893","0.004","18.222","0.008","6.981","0.003","90","","108.05","0.05","90","","833.7","0.7","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","4-oxa-3,17-dioxoandrostane-5α-carbaldehyde","","- C19 H26 O4 -","- C19 H26 O4 -","- C38 H52 O8 -","2","1","SK1231","Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J.; Tavares da Silva, E. J.; Sá e Melo, M. L.; Campos Neves, A. S.","3,17-Dioxo-4-oxaandrostane-5α-carbaldehyde","Acta Crystallographica Section C","1999","55","4","637","639","10.1107/S0108270198015728","","","0.71073","MoKα","","0.0728","0.0403","","","","0.1128","","","","","","1.056","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008421","9.115","0.002","14.226","0.002","20.224","0.004","90","","93.532","0.009","90","","2617.5","0.9","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Coumarin-3-carboxylato)triphenyltin^.^ethanol","","- C30 H26 O5 Sn -","- C30 H26 O5 Sn -","- C120 H104 O20 Sn4 -","4","1","SK1234","Ng, Seik Weng","Coordination complexes of triphenyltin coumarin-3-carboxylate with <i>O</i>-donor ligands: (coumarin-3-carboxylato)triphenyltin‒<i>L</i> (<i>L</i> = ethanol, diphenylcyclopropenone and quinoline <i>N</i>-oxide) and bis[(coumarin-3-carboxylato)triphenyltin]‒<i>L</i> (<i>L</i> = triphenylphosphine oxide and triphenylarsine oxide)","Acta Crystallographica Section C","1999","55","4","523","531","10.1107/S0108270198014991","","","0.71073","MoKα","","0.096","0.052","","","","0.118","","","","","","0.992","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008422","12.712","0.002","19.402","0.002","14.456","0.003","90","","97.242","0.009","90","","3537","1","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Coumarin-3-carboxylato)triphenyltin^.^1,2-diphenylcyclopropenone","","- C43 H30 O5 Sn -","- C43 H30 O5 Sn -","- C172 H120 O20 Sn4 -","4","1","SK1234","Ng, Seik Weng","Coordination complexes of triphenyltin coumarin-3-carboxylate with <i>O</i>-donor ligands: (coumarin-3-carboxylato)triphenyltin‒<i>L</i> (<i>L</i> = ethanol, diphenylcyclopropenone and quinoline <i>N</i>-oxide) and bis[(coumarin-3-carboxylato)triphenyltin]‒<i>L</i> (<i>L</i> = triphenylphosphine oxide and triphenylarsine oxide)","Acta Crystallographica Section C","1999","55","4","523","531","10.1107/S0108270198014991","","","0.71073","MoKα","","0.126","0.059","","","","0.126","","","","","","0.989","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008423","10.4099","0.0003","11.52","0.001","13.725","0.002","111.754","0.008","95.758","0.007","98.695","0.005","1489.1","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(Coumarin-3-carboxylato)triphenyltin^.^quinoline N-oxide","","- C37 H27 N O5 Sn -","- C37 H27 N O5 Sn -","- C74 H54 N2 O10 Sn2 -","2","1","SK1234","Ng, Seik Weng","Coordination complexes of triphenyltin coumarin-3-carboxylate with <i>O</i>-donor ligands: (coumarin-3-carboxylato)triphenyltin‒<i>L</i> (<i>L</i> = ethanol, diphenylcyclopropenone and quinoline <i>N</i>-oxide) and bis[(coumarin-3-carboxylato)triphenyltin]‒<i>L</i> (<i>L</i> = triphenylphosphine oxide and triphenylarsine oxide)","Acta Crystallographica Section C","1999","55","4","523","531","10.1107/S0108270198014991","","","0.71073","MoKα","","0.041","0.032","","","","0.08","","","","","","1.013","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008424","9.4696","0.0006","16.164","0.002","20.816","0.002","79.329","0.008","81.946","0.007","80.861","0.007","3071.2","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[(coumarin-3-carboxylato)triphenyltin]^.^triphenylphosphine oxide","","- C74 H55 O9 P Sn2 -","- C74 H55 O9 P Sn2 -","- C148 H110 O18 P2 Sn4 -","2","1","SK1234","Ng, Seik Weng","Coordination complexes of triphenyltin coumarin-3-carboxylate with <i>O</i>-donor ligands: (coumarin-3-carboxylato)triphenyltin‒<i>L</i> (<i>L</i> = ethanol, diphenylcyclopropenone and quinoline <i>N</i>-oxide) and bis[(coumarin-3-carboxylato)triphenyltin]‒<i>L</i> (<i>L</i> = triphenylphosphine oxide and triphenylarsine oxide)","Acta Crystallographica Section C","1999","55","4","523","531","10.1107/S0108270198014991","","","0.71073","MoKα","","0.066","0.047","","","","0.102","","","","","","1.069","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008425","9.5242","0.0004","16.219","0.002","20.807","0.002","79.501","0.009","81.793","0.007","80.523","0.006","3096","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[(coumarin-3-carboxylato)triphenyltin]^.^triphenylarsine oxide","","- C74 H55 As O9 Sn2 -","- C74 H55 As O9 Sn2 -","- C148 H110 As2 O18 Sn4 -","2","1","SK1234","Ng, Seik Weng","Coordination complexes of triphenyltin coumarin-3-carboxylate with <i>O</i>-donor ligands: (coumarin-3-carboxylato)triphenyltin‒<i>L</i> (<i>L</i> = ethanol, diphenylcyclopropenone and quinoline <i>N</i>-oxide) and bis[(coumarin-3-carboxylato)triphenyltin]‒<i>L</i> (<i>L</i> = triphenylphosphine oxide and triphenylarsine oxide)","Acta Crystallographica Section C","1999","55","4","523","531","10.1107/S0108270198014991","","","0.71073","MoKα","","0.058","0.041","","","","0.093","","","","","","1.085","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008426","8.3216","0.0016","12.392","0.003","15.949","0.002","83.58","0.02","79.634","0.016","72.99","0.015","1544","0.5","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","1,1'-Bis(3-phenylquinoxalin-2-yl)ferrocene dichloromethane solvate","","- C38.9 H27.8 Cl1.8 Fe N4 -","- C38.898 H27.796 Cl1.796 Fe N4 -","- C77.796 H55.592 Cl3.592 Fe2 N8 -","2","1","SK1238","Ahmed, S. Zaka,; Glidewell, Christopher; Ferguson, George","1,1'-Bis(3-phenylquinoxalin-2-yl)ferrocene dichloromethane solvate","Acta Crystallographica Section C","1999","55","4","503","506","10.1107/S010827019801186X","","","0.71073","MoKα","","0.145","0.067","","","","0.144","","","","","","0.852","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008427","8.5966","0.0007","11.4966","0.0014","12.4867","0.0011","70.432","0.008","77.619","0.007","85.302","0.009","1135.7","0.2","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H18 N4 O6 Zn -","- C26 H18 N4 O6 Zn -","- C52 H36 N8 O12 Zn2 -","2","1","SK1243","Tatar, Leyla; Ülkü, Dinçer; Atakol, Orhan","Zinc(II) complexes of bidentate Schiff base ligands containing methoxyphenyl and nitrophenyl groups","Acta Crystallographica Section C","1999","55","4","508","510","10.1107/S0108270198015406","","","0.71073","MoKα","","","0.0412","","","0.0517","","","","","1.01","1.01","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008428","9.0778","0.0011","11.4052","0.0013","12.0973","0.0012","84.898","0.002","87.619","0.003","71.594","0.002","1183.6","0.2","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H24 N2 O4 Zn -","- C28 H24 N2 O4 Zn -","- C56 H48 N4 O8 Zn2 -","2","1","SK1243","Tatar, Leyla; Ülkü, Dinçer; Atakol, Orhan","Zinc(II) complexes of bidentate Schiff base ligands containing methoxyphenyl and nitrophenyl groups","Acta Crystallographica Section C","1999","55","4","508","510","10.1107/S0108270198015406","","","0.71073","MoKα","","","0.0279","","","0.0371","","","","","1.01","1.01","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008429","6.9446","0.0006","9.8415","0.0007","17.0921","0.0013","94.102","0.006","94.906","0.006","100.05","0.006","1141.57","0.16","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[diaqua(pyridine-2-carboxamide-N^1^,O)-copper(II)-μ-sulfato-O,O'] monohydrate","","- C6 H12 Cu N2 O8 S -","- C6 H12 Cu N2 O8 S -","- C24 H48 Cu4 N8 O32 S4 -","4","2","SK1250","Sieroń, Lesław; Bukowska-Strzyżewska, Maria","<i>catena</i>-Poly[[[diaqua(pyridine-2-carboxamide-<i>N</i>^1^,<i>O</i>)copper(II)]-μ-(sulfato-<i>O</i>:<i>O</i>')] monohydrate]","Acta Crystallographica Section C","1999","55","4","491","494","10.1107/S0108270198015340","","","0.71073","MoKα","","0.027","0.024","","","","0.066","","","","","","1.034","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008430","11.0232","0.0002","15.1645","0.0002","24.2826","0.0001","90","","90","","90","","4059.11","0.09","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H28 N2 S4 -","- C14 H28 N2 S4 -","- C112 H224 N16 S32 -","8","1","","Fangfang Jian; Lijian Jiang; Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak; Xiaozeng You","Bis(dipropylthiocarbamoyl) disulfide","Acta Crystallographica Section C","1999","55","","574","576","","","","","","","","","","","","","","","","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008431","16.169","0.002","7.6796","0.0009","14.153","0.002","90","","90","","90","","1757.4","0.4","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","tris(ethylenediamine)-nickel(II)tetrathiomolybdate","","","- C6 H24 Mo N6 Ni S4 -","- C6 H24 Mo N6 Ni S4 -","- C24 H96 Mo4 N24 Ni4 S16 -","4","1","SK1258","Ellermeier, Jan; Näther, Christian; Bensch, Wolfgang","Tris(ethylenediamine-<i>N</i>,<i>N</i>')nickel(II) tetrathiomolybdate","Acta Crystallographica Section C","1999","55","4","501","503","10.1107/S0108270198016461","","","0.71073","MoKα","","0.039","0.021","","0.05","0.046","","","","1.01","1.044","1.044","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008432","12.189","0.006","6.64","0.003","12.393","0.005","90","","105.36","0.02","90","","967.2","0.8","301","","301","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C3 H13 K O7 -","- C3 H13 K O7 -","- C12 H52 K4 O28 -","4","1","SX1073","Allen W. Apblett; Elizabeth M. Holt","Potassium methoxyacetate tetrahydrate","Acta Crystallographica Section C","1999","55","4","539","541","10.1107/S0108270198014395","","","0.71073","MoKα","","","0.049","","","","0.072","","","","","","1.42","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008433","7.513","0.001","12.74","0.002","8.68","0.001","90","","95.67","0.02","90","","826.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Patassium (μ-oxo) [(oxalato)-oxomolybdate] monohydrate","","- C2 H2 K2 Mo O8 -","- C2 K2 Mo O8 -","- C8 K8 Mo4 O32 -","4","1","TA1220","Xing, Yong-Heng; Wang, Zuo; Xu, Ji-Qing; Li, Dong-Mei; Wang, Ren-Zhang; Bu, Wei-Ming; Ye, Ling; Xing Yan; Yong-Hua Lin; Heng-Qing Jia","K~2~[MoO~3~(C~2~O~4~)]^.^H~2~O","Acta Crystallographica Section C","1999","55","4","521","523","10.1107/S0108270198014851","","","0.71073","MoKα","","0.0378","0.0358","","0.1049","0.1034","","","","1.099","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008434","19.3111","0.0012","7.5851","0.0004","15.514","0.0008","90","","90","","90","","2272.4","0.2","298","","298","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- H4 Mo4 O15 Sr -","- H4 Mo4 O15 Sr -","- H32 Mo32 O120 Sr8 -","8","1","TA1224","Harrison, William T. A.","Strontium tetramolybdate dihydrate, SrMo~4~O~13~^.^2H~2~O","Acta Crystallographica Section C","1999","55","4","485","487","10.1107/S0108270198013602","","","0.71073","MoKα","","","0.031","","","0.022","","","","","1.049","1.049","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008435","14.671","0.004","15.135","0.002","9.328","0.002","90","","90","","90","","2071.2","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4,5-dihydro-1,2,4-oxadiazole","Methyl (2S)-2-[(5R)-diphenyl-4,5-dihydro-1,2,4-oxadiazol-4-yl]-3-phenylpropanoate","","- C24 H22 N2 O3 -","- C24 H22 N2 O3 -","- C96 H88 N8 O12 -","4","1","TA1227","Xu, Jiaxi; Li, Xiaoyu; Wang, Zhemin; Yang, Qingchuan; Yan, Chunhua","Methyl (2<i>S</i>)-2-[(5<i>R</i>)-3,5-diphenyl-4,5-dihydro-1,2,4-oxadiazol-4-yl]-3-phenylpropanoate","Acta Crystallographica Section C","1999","55","4","650","652","10.1107/S0108270198015492","","","0.71073","MoKα","","0.0762","0.0549","","","","0.1228","","","","","","1.096","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008436","7.359","0.003","7.873","0.003","16.098","0.004","90","0.01","96","0.02","90","0.01","927.6","0.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2'-Tosyl adenosine","","- C17 H19 N5 O6 S -","- C17 H19 N5 O6 S -","- C34 H38 N10 O12 S2 -","2","1","VJ1090","D. Prahadeeswaran; T. P. Seshadri","2'-<i>O</i>-Tosyladenosine","Acta Crystallographica Section C","1999","55","4","606","608","10.1107/S0108270198015236","","","1.5418","CuKα","","0.0573","0.0565","","0.1371","0.1356","","","","1.086","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008437","9.412","0.002","6.914","0.001","14.667","0.002","90","0.01","102.89","0.02","90","0.02","930.4","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N^6^Anisoyl Adenosine Monohydrate","","- C18 H21 N5 O7 -","- C18 H21 N5 O7 -","- C36 H42 N10 O14 -","2","1","VJ1092","S. Kolappan; T. P. Seshadri","<i>N</i>^6^-Anisoyladenosine monohydrate","Acta Crystallographica Section C","1999","55","4","603","604","10.1107/S0108270198015248","","","1.5418","CuKα","","0.0371","0.0356","","0.1048","0.1021","","","","1.013","1.009","1.009","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008438","14.202","0.002","5.737","0.003","33.319","0.005","90","0.02","92.93","0.02","90","0.03","2711.2","1.5","293","2","293","2","","","","","","","","4","P 1 2 1","P 2y","3","","N^3^,2',3'-Tri-O-Benzoyluridine","","- C30 H24 N2 O9 -","- C30 H24 N2 O9 -","- C120 H96 N8 O36 -","4","2","VJ1093","S. Kolappan; T. P. Seshadri","<i>N</i>^3^-Benzoyl-2',3'-di-<i>O</i>-benzoyluridine","Acta Crystallographica Section C","1999","55","4","604","606","10.1107/S0108270198015224","","","1.5418","CuKα","","0.0632","0.0407","","0.157","0.1174","","","","1.03","1.055","1.055","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008439","9.2989","0.0007","14.057","0.001","3.6066","0.0003","90","","90","","90","","471.44","0.06","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4-NRTZ","4-nitramino-1,2,4-triazole","","- C2 H3 N5 O2 -","- C2 H3 N5 O2 -","- C8 H12 N20 O8 -","4","1","AV1027","Vasiliev, Alexander D.; Astachov, Alexander M.; Stepanov, Rudolf S.; Kirik, Sergei D.","4-Nitramino-1,2,4-triazole","Acta Crystallographica Section C","1999","55","5","830","832","10.1107/S0108270199002243","","","1.5418","CuKα","","0.028","0.027","","","","0.073","","","","","","1.096","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008440","20.652","0.002","8.8934","0.0006","7.5917","0.0005","90","","90","","90","","1394.34","0.19","297","","273","","","","","","","","","5","A b a 2","A 2 -2ab","41","cadmium isopropylxanthate","cadmium(II) bis-(O-isopropyldithiocarbonate)","","- C8 H14 Cd O2 S4 -","- C8 H14 Cd0.5 O2 S4 -","- C32 H56 Cd2 O8 S16 -","4","","BK1413","Tomlin, David W.; Cooper, Thomas M.; Zelmon, David E.; Gebeyehu, Zewdu; Hughes, John M.","Cadmium isopropylxanthate","Acta Crystallographica Section C","1999","55","5","717","719","10.1107/S010827019801823X","","","0.7107","MoKα","","0.025","0.025","","","0.034","","","","1.27","1.27","1.27","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008441","13.2852","0.0004","11.4419","0.0003","13.5434","0.0004","90","","98.438","0.002","90","","2036.42","0.1","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H29 N O4 -","- C22 H29 N O4 -","- C88 H116 N4 O16 -","4","1","BK1450","Thuéry, Pierre; Nierlich, Martine; Wang, Zhen-He; Hirose, Takuji","Imide and tribenzyl ester derivatives of Kemp's triacid","Acta Crystallographica Section C","1999","55","5","808","811","10.1107/S0108270198018241","","","0.71073","MoKα","","0.068","0.047","","0.123","0.105","","","","1.066","1.073","1.073","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008442","9.1757","0.0004","13.1247","0.0006","18.6567","0.0009","90","","97.412","0.003","90","","2228.02","0.18","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H33 N O5 -","- C23 H33 N O5 -","- C92 H132 N4 O20 -","4","1","BK1450","Thuéry, Pierre; Nierlich, Martine; Wang, Zhen-He; Hirose, Takuji","Imide and tribenzyl ester derivatives of Kemp's triacid","Acta Crystallographica Section C","1999","55","5","808","811","10.1107/S0108270198018241","","","0.71073","MoKα","","0.097","0.059","","0.162","0.125","","","","1.083","1.064","1.064","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008443","14.5445","0.0005","9.668","0.0002","19.8101","0.0007","90","","90.186","0.001","90","","2785.61","0.15","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C33 H36 O6 -","- C33 H36 O6 -","- C132 H144 O24 -","4","1","BK1450","Thuéry, Pierre; Nierlich, Martine; Wang, Zhen-He; Hirose, Takuji","Imide and tribenzyl ester derivatives of Kemp's triacid","Acta Crystallographica Section C","1999","55","5","808","811","10.1107/S0108270198018241","","","0.71073","MoKα","","0.063","0.044","","0.115","0.099","","","","1.032","1.046","1.046","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008444","7.669","0.005","12.402","0.008","27.204","0.007","90","","90","","90","","2587","2","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C16 H14 O4 -","- C16 H14 O4 -","- C128 H112 O32 -","8","1","BM1292","K. Rajalakshmi; Niveta Jain; S. Deepthi; H.G. Krishnamurthy; Vasantha Pattabhi","7-Hydroxy-4-(4-methoxyphenyl)-3,4-dihydrocoumarin","Acta Crystallographica Section C","1999","55","5","813","815","10.1107/S0108270198016072","","","1.5418","CuKα","","0.0749","0.0699","","0.2033","0.1918","","","","1.077","1.114","1.114","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008445","7.3239","0.0014","9.8199","0.0014","13.738","0.003","90","","90","","90","","988","0.3","143","2","143","2","","","","","","","","5","P n a 21","P 2c -2n","33","","1,2,4-Triazolium Di(methanesulfonyl)amidate","","- C4 H10 N4 O4 S2 -","- C4 H10 N4 O4 S2 -","- C16 H40 N16 O16 S8 -","4","1","BM1307","Moers, Oliver; Wijaya, Karna; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CIX. 1,2,4-Triazolium di(methanesulfonyl)amidate","Acta Crystallographica Section C","1999","55","5","754","756","10.1107/S0108270199000426","","","0.71073","MoKα","","0.0204","0.0199","","","","0.0549","","","","","","1.068","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008446","7.4177","0.0008","21.393","0.002","9.2734","0.001","90","","101.766","0.008","90","","1440.6","0.3","173","2","173","2","","","","","","","","3","C 1 c 1","C -2yc","9","","4-(2'-furyl)[2.2]paracyclophane","","- C20 H18 O -","- C20 H18 O -","- C80 H72 O4 -","4","1","BM1314","Dix, Ina; Hopf, Henning; Jones, Peter G.","Heterocycle-substituted [2.2]paracyclophanes","Acta Crystallographica Section C","1999","55","5","756","759","10.1107/S0108270199001808","","","0.71073","MoKα","","0.0536","0.0478","","","","0.1254","","","","","","1.062","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008447","16.85","0.002","7.6203","0.001","11.574","0.002","90","","95.523","0.011","90","","1479.2","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-(2'-thienyl)[2.2]paracyclophane","","- C20 H18 S -","- C20 H18 S -","- C80 H72 S4 -","4","1","BM1314","Dix, Ina; Hopf, Henning; Jones, Peter G.","Heterocycle-substituted [2.2]paracyclophanes","Acta Crystallographica Section C","1999","55","5","756","759","10.1107/S0108270199001808","","","0.71073","MoKα","","0.0708","0.0378","","","","0.0841","","","","","","0.862","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008448","8.958","0.005","13.258","0.007","14.769","0.008","71.61","0.05","88.37","0.04","70.53","0.04","1563.5","1.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","5,9,14,18-N-(2,3,6,8,11,12,15,17-octamethyl-5,9,14,18- tetraazadibenzo-[a,h]-tetraazacyclotetradecene)- dichlorozirconium(IV) tetrahydrofuran solvate(1/0.5)","","- C28 H34 Cl2 N4 O0.5 Zr -","- C28 H34 Cl2 N4 O0.5 Zr -","- C56 H68 Cl4 N8 O Zr2 -","2","1","CF1287","Corden, Jonathan P; Errington, William; Moore, Peter; Wallbridge, Malcolm G H","Dichloro(2,3,6,8,11,12,15,17-octamethyl-5,9,14,18-tetraazadibenzo[<i>a</i>,<i>h</i>]cyclotetradecene-κ^4^<i>N</i>)zirconium(IV) tetrahydrofuran hemisolvate","Acta Crystallographica Section C","1999","55","5","706","707","10.1107/S0108270198018010","","","0.71073","MoKα","","0.123","0.051","","","","0.117","","","","","","0.709","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2008449","16.234","0.003","11.017","0.002","7.1954","0.0014","90","","93.15","0.03","90","","1285","0.4","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(3-pyridyl)4-p-tolyl-1,2,4-oxadiazoline-5-thione","","- C14 H11 N3 O S -","- C14 H11 N3 O S -","- C56 H44 N12 O4 S4 -","4","1","DA1041","Billodeaux, Damon R.; Fronczek, Frank R.; Dürüşt, Yas̨ar","Two novel 3,4-disubstituted 1,2,4-oxadiazole-5(4<i>H</i>)-thiones","Acta Crystallographica Section C","1999","55","5","761","764","10.1107/S0108270199000475","","","1.54184","CuKα","","0.091","0.07","","0.201","0.169","","","","1.069","1.088","1.088","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008450","7.728","0.001","8.826","0.002","9.3699","0.0009","112.89","0.01","112.029","0.009","94.84","0.01","525.57","0.16","100","","100","","","","","","","","","5","P -1","-P 1","2","","3-(2-pyridyl)-4-n-propyl-1,2,4-oxadiazoline-5-thione","","- C10 H11 N3 O S -","- C10 H11 N3 O S -","- C20 H22 N6 O2 S2 -","2","1","DA1041","Billodeaux, Damon R.; Fronczek, Frank R.; Dürüşt, Yas̨ar","Two novel 3,4-disubstituted 1,2,4-oxadiazole-5(4<i>H</i>)-thiones","Acta Crystallographica Section C","1999","55","5","761","764","10.1107/S0108270199000475","","","0.71073","MoKα","","0.05","0.044","","0.058","0.058","","","","","1.955","1.955","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008451","12.105","0.003","12.105","0.003","5.776","0.003","90","","90","","90","","846.4","0.5","293","2","293","2","","","","","","","","4","P 43","P 4cw","78","","2-amino-4-phenylthiazole","","- C9 H8 N2 S -","- C9 H8 N2 S -","- C36 H32 N8 S4 -","4","1","DA1045","Au-Alvarez, Oscar; Peterson, Ronald C.; Crespo, Alexis Acosta; Esteva, Yolanda Rodríguez; Alvarez, Heidy Marquez; Stiven, Ana M. Plutín; Hernández, Ramón Pomés","2-Amino-4-phenylthiazole","Acta Crystallographica Section C","1999","55","5","821","823","10.1107/S0108270199001961","","","0.71073","MoKα","","0.066","0.042","","","","0.105","","","","","","1.072","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008452","10.068","0.003","10.068","0.003","16.728","0.006","90","","90","","120","","1468.5","0.8","293","2","293","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","","","","- C24 H27 Cl2 Mn N7 O8 -","- C24 H27 Cl2 Mn N7 O8 -","- C48 H54 Cl4 Mn2 N14 O16 -","2","0.333333","DA1054","Qian, Ming; Gou, Shao-Hua; He, Ling; Zhou, Yu-Ming; Duan, Chun-Ying","[Tris(2-pyridyl-κ<i>N</i>-methyleneamino-κ<i>N</i>-ethyl)amine-κ<i>N</i>]manganese(II) diperchlorate","Acta Crystallographica Section C","1999","55","5","742","744","10.1107/S0108270198017624","","","0.71073","MoKα","","0.0844","0.0516","","0.1267","0.1165","","","","1.052","1.244","1.244","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008453","7.1325","0.0006","9.7959","0.0008","12.3235","0.0008","74.082","0.006","81.086","0.006","86.242","0.007","817.78","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H14 Cl2 O Ti -","- C18 H14 Cl2 O Ti -","- C36 H28 Cl4 O2 Ti2 -","2","1","FG1495","Bu, Weiming; Wang, Jianhui; Ye, Ling; Mu, Ying; Yang, Guangdi; Fan, Yuguo","Dichloro{2-[(η^5^-cyclopentadienyl)phenylmethyl]phenolato-<i>O</i>}titanium","Acta Crystallographica Section C","1999","55","5","728","730","10.1107/S0108270198015479","","","0.71073","MoKα","","0.0562","0.0421","","0.0707","0.0615","","","","1.105","1.189","1.189","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008454","11.5121","0.0003","8.5186","0.0003","20.4454","0.0007","90","","100.768","0.002","90","","1969.71","0.11","150","0.1","150","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Dibenzo[b,f]azepin-2-one","","- C14 H9 N O -","- C14 H9 N O -","- C112 H72 N8 O8 -","8","1","FG1517","Ruane, Patrick H.; McClelland, Robert A.; Lough, Alan J.","2<i>H</i>-Dibenzo[<i>b</i>,<i>f</i>]azepin-2-one","Acta Crystallographica Section C","1999","55","5","819","821","10.1107/S0108270198016357","","","0.71073","MoKα","","0.046","0.038","","","","0.099","","","","","","1.035","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008455","10.2782","0.0001","11.4269","0.0002","13.5079","0.0002","96.11","0.01","99.224","0.001","113.462","0.001","1410.87","0.06","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","6,11-Dihydroxy-1,4-methano-1,4,4a-tetrahydronaphthacene-5,12-dione","","- C19 H14 O4 -","- C19 H14 O4 -","- C76 H56 O16 -","4","2","FR1163","Kandasamy Chinnakali; Hoong-Kun Fun; Dipakranjan Mal; Sujit Kumar Ghorai; Nirmal Kumar Hazra; Gur Dayal Nigam","6,11-Dihydroxy-1,4-methano-1,4,4a,12a-tetrahydronaphthacene-5,12-dione","Acta Crystallographica Section C","1999","55","5","776","778","10.1107/S0108270199000657","","","0.71073","MoKα","","0.1033","0.0609","","","","0.1499","","","","","","1.079","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008456","9.063","0.001","16.543","0.002","8.46","0.001","90","","83.11","0.01","90","","1259.2","0.3","295","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 Cl F N2 O2 -","- C13 H10 Cl F N2 O2 -","- C52 H40 Cl4 F4 N8 O8 -","4","1","FR1168","Candan, M. Murat; Kendi, Engin; Göker, Hakan","4-Chloro-<i>N</i>-(<i>p</i>-fluorobenzyl)-2-nitroaniline","Acta Crystallographica Section C","1999","55","5","825","827","10.1107/S0108270199001456","","","0.71069","MoKα","","","0.039","","","0.046","","","","","0.97","0.97","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008457","13.887","0.001","7.162","0.001","32.124","0.003","90","","90","","90","","3195","0.6","153","2","153","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2-[3-(tosyloxy)-propoxy]benzaldehyde","","- C17 H18 O5 S -","- C17 H18 O5 S -","- C136 H144 O40 S8 -","8","2","FR1170","Jene, Paul G.; Chan, David S.; Cooke, Bethany L.; Ibers, James A.","Capped-porphyrin precursors","Acta Crystallographica Section C","1999","55","5","801","806","10.1107/S0108270198018034","","","0.71073","MoKα","","0.089","0.049","","","","0.11","","","","","","0.91","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008458","8.532","0.001","9.576","0.001","9.953","0.001","76.679","0.001","84.054","0.001","70.29","0.001","744.65","0.14","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","2-[3-(Tosyloxy)ethoxy]benzaldehyde","","- C16 H16 O5 S -","- C16 H16 O5 S -","- C32 H32 O10 S2 -","2","1","FR1170","Jene, Paul G.; Chan, David S.; Cooke, Bethany L.; Ibers, James A.","Capped-porphyrin precursors","Acta Crystallographica Section C","1999","55","5","801","806","10.1107/S0108270198018034","","","0.71073","MoKα","","0.055","0.041","","","","0.11","","","","","","1.41","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008459","14.415","0.001","6.693","0.001","31.692","0.002","90","","90","","90","","3057.6","0.5","153","2","153","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","2-[3-(Tosyloxy)-ethoxy]benzaldehyde hemihydrate","","- C16 H17 O5.5 S -","- C16 H17 O5.5 S -","- C128 H136 O44 S8 -","8","1","FR1170","Jene, Paul G.; Chan, David S.; Cooke, Bethany L.; Ibers, James A.","Capped-porphyrin precursors","Acta Crystallographica Section C","1999","55","5","801","806","10.1107/S0108270198018034","","","0.71073","MoKα","","0.07","0.043","","","","0.097","","","","","","1.13","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008460","7.685","0.001","9.042","0.001","32.071","0.003","90","","93.46","0.01","90","","2224.5","0.4","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2,4,5-Tetrakis{3-[2-(1,3-dioxolan-2-yl)phenoxy]propoxy}-benzene","","- C50 H54 O16 -","- C50 H54 O16 -","- C100 H108 O32 -","2","0.5","FR1170","Jene, Paul G.; Chan, David S.; Cooke, Bethany L.; Ibers, James A.","Capped-porphyrin precursors","Acta Crystallographica Section C","1999","55","5","801","806","10.1107/S0108270198018034","","","0.71073","MoKα","","0.089","0.042","","","","0.092","","","","","","0.88","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008461","12.148","0.002","24.682","0.002","8.021","0.002","90","","90","","90","","2405","0.7","296","","296","","","","","","","","","3","P b c a","-P 2ac 2ab","61","3-[2-(1,3-dioxolan-2-yl)ethyl]-2-methylbenzoic acid","","","- C13 H16 O4 -","- C13 H16 O4 -","- C104 H128 O32 -","8","1","FR1181","Gerkin, Roger E.","3-[2-(1,3-Dioxolan-2-yl)ethyl]-2-methylbenzoic acid","Acta Crystallographica Section C","1999","55","5","798","801","10.1107/S0108270199000128","","","0.71073","MoKα","","","0.065","","","0.077","","","","","1.42","1.42","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008462","18.6342","0.0019","11.1941","0.0008","34.734","0.002","90","","99.188","0.009","90","","7152.3","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Trinitrato-bis[N-(2-pyridinylmethylene)-N'-benzoyl-hydrazino]cerium(III) acetone dihydrate","","- C29 H32 Ce N9 O14 -","- C29.5 H28 Ce N8.5 O14 -","- C236 H224 Ce8 N68 O112 -","8","2","GD1012","Christidis, Panayiotis C.; Tossidis, Ioannis A.; Paschalidis, Damianos G.","Bis[<i>N</i>-benzoyl-<i>N</i>'-(2-pyridylmethylene)hydrazine]trinitratocerium(III) acetone dihydrate","Acta Crystallographica Section C","1999","55","5","707","710","10.1107/S0108270199000438","","","0.7107","MoKα","","0.1077","0.0462","","","","0.1162","","","","","","0.945","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008463","12.369","0.001","12.998","0.001","13.39","0.001","63.54","0.01","88.97","0.01","79.89","0.01","1892.9","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","N-[2,3-dihydro-4-(2,5-Dimethoxyphenyl)thiazol-2-ylidene]-2,4- dichlorobenzenesulfonamide.","","- C17 H14 Cl2 N2 O4 S2 -","- C17 H14 Cl2 N2 O4 S2 -","- C68 H56 Cl8 N8 O16 S8 -","4","2","GS1030","Beuchet, Pierre; Léger, Jean-Michel; Varache-Lembége, Martine; Nuhrich, Alain","Tautomerism in a 2,4-dichlorobenzenesulfonamide derived from 2-amino-4-(2,5-dimethoxyphenyl)thiazole","Acta Crystallographica Section C","1999","55","5","791","794","10.1107/S0108270198017922","","","1.54178","CuKα","","0.07","0.041","","0.101","0.134","","","","1.043","1.088","1.088","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008465","9.033","0.001","11.081","0.001","13.447","0.001","90","","90","","90","","1346","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(E)-3-(Benzoylmethylene)-N-methyl isoindolin-1-one","(E)-3-(Benzoylmethylene)-N-methyl isoindolin-1-one","","- C17 H13 N O2 -","- C17 H13 N O2 -","- C68 H52 N4 O8 -","4","1","HA1246","Guha, Subhadra; Mukherjee, Alok K.; Khan, M. Wahab; Kundu, Nitya G.","(<i>E</i>)-3-(Benzoylmethylene)-<i>N</i>-methylisoindolin-1-one","Acta Crystallographica Section C","1999","55","5","818","819","10.1107/S0108270198018393","","","0.71073","MoKα","","0.069","0.04","","0.104","0.096","","","","0.863","0.968","0.968","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008466","11.245","0.002","11.752","0.002","14.476","0.005","90","","90","","90","","1913","0.8","150","1","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1'R, 2'R)-3-[(cis-2'-Cyclohexylmethylcyclopentyl)imino]-2-azabicyclo[2.2.2] octan-HBr","","- C19 H33 Br N2 -","- C19 H33 Br N2 -","- C76 H132 Br4 N8 -","4","1","JZ1314","Hartmann, Susanne; Weckert, Edgar; Frahm, August W.","(1'<i>R</i>,2'<i>R</i>)-3-[(<i>cis</i>-2'-Cyclohexylmethylcyclopentyl)imino]-2-azabicyclo[2.2.2]octane hydrobromide, a hypoglycaemic semicyclic amidine","Acta Crystallographica Section C","1999","55","5","806","808","10.1107/S0108270199000402","","","0.71069","MoKα","","0.0196","0.0195","","","","0.0512","","","","","","1.102","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008467","12.106","0.002","6.831","0.001","13.411","0.003","90","","116.74","0.03","90","","990.4","0.4","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Diaquahydrogen(1+) hexachloroantimonat","","","- Cl6 H5 O2 Sb -","- Cl6 H5 O2 Sb -","- Cl24 H20 O8 Sb4 -","4","0.5","JZ1325","Minkwitz, Rolf; Hirsch, Claudia","Tieftemperaturstruktur von diaquahydrogen(1+) hexachloroantimonat, H~5~O~2~^+^^.^SbCl~6~^{-^}","Acta Crystallographica Section C","1999","55","5","703","705","10.1107/S0108270198018058","","","0.71069","MoKα","","0.065","0.034","","0.064","0.058","","","","0.995","1.074","1.074","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008468","6.914","0.003","9.48","0.007","13.644","0.004","102.9","0.04","90.3","0.03","106.85","0.05","831.9","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","dimethyl (Z)-2-[1-methyl-2-(p-tolyl)-4,5-dihydro-1H-pyrrol-3- yl]but-2-enedioate","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C36 H42 N2 O8 -","2","1","JZ1327","Zellmer, Dirk; Niewa, Rainer; Kreher, Richard P.","A functionalized dimethyl maleate (maleic acid dimethyl ester)","Acta Crystallographica Section C","1999","55","5","823","825","10.1107/S0108270199000852","","","0.71069","MoKα","","0.153","0.054","","","","0.142","","","","","","1.09","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008469","4.8112","0.0007","4.8112","0.0007","23.302","0.005","90","","90","","120","","467.12","0.14","173","2","173","2","","","","","","","","4","R -3 :H","-R 3","148","","barium dinickel(II) bis(phosphate)","","- Ba Ni2 O8 P2 -","- Ba Ni2 O8 P2 -","- Ba3 Ni6 O24 P6 -","3","0.166667","JZ1337","El-Bali, Brahim; Bolte, Michael; Boukhari, Ali; Aride, Jilali; Taibe, M'Hamed","BaNi~2~(PO~4~)~2~","Acta Crystallographica Section C","1999","55","5","701","702","10.1107/S0108270199000499","","","0.71073","MoKα","","0.039","0.039","","","","0.099","","","","","","1.167","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008470","12.0311","0.0016","24.574","0.003","8.9357","0.0011","90","","99.245","0.014","90","","2607.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7-oxa-bicyclo[2.2.1]heptane-2-exo,3-exo-dicarboxylato-(2,2'-bipyridine-N,N') manganese(II) 7-oxa-bicyclo[2.2.1]heptane-2-exo,3-exo-dicarboxylic acid monohydrate","","- C26 H28 Mn N2 O11 -","- C26 H28 Mn N2 O11 -","- C104 H112 Mn4 N8 O44 -","4","1","KA1307","Baumeister, Ute; Hartung, Helmut; Kaplonek, Roland","(2,2'-Bipyridine-<i>N</i>,<i>N</i>')(7-oxabicyclo[2.2.1]heptane-2-<i>exo</i>,3-<i>exo</i>-dicarboxylato-κ^3^<i>O</i>^2,3,7^)manganese(II)‒7-oxabicyclo[2.2.1]heptane-2-<i>exo</i>,3-<i>exo</i>-dicarboxylic acid‒water (1/1/1)","Acta Crystallographica Section C","1999","55","5","715","717","10.1107/S0108270198018095","","","0.71073","MoKα","","0.103","0.052","","","","0.123","","","","","","1.1","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008471","7.2842","0.0006","13.45","0.001","16.503","0.002","90","","90","","90","","1616.8","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","androst-4-ene-3,6,17-trione","Androst-4-ene-3,6,17-trione","","- C19 H24 O3 -","- C19 H24 O3 -","- C76 H96 O12 -","4","1","KA1312","Addlagatta Anthony; Mariusz Jaskólski; Ashwini Nangia","Androst-4-ene-3,6,17-trione","Acta Crystallographica Section C","1999","55","5","787","789","10.1107/S0108270199000517","","","1.54178","CuKα","","0.042","0.035","","","","0.101","","","","","","1.01","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008472","8.181","0.002","9.036","0.002","8.392","0.001","90","","90","","90","","620.4","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H4 Ba O6 -","- C4 H4 Ba O6 -","- C16 H16 Ba4 O24 -","4","1","LN1069","González-Silgo, Cristina; González-Platas, Javier; Ruiz-Pérez, Catalina; López, Trinidad; Torres, Manuel","Barium <small>L</small>-tartrate","Acta Crystallographica Section C","1999","55","5","740","742","10.1107/S0108270198016709","","","0.71069","MoKα","","0.019","0.019","","0.048","","0.048","","","1.21","","","1.21","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008473","9.5461","0.0015","6.251","0.001","20.773","0.003","90","","98.008","0.004","90","","1227.5","0.3","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-benzyloxy-1[H]-phenyltetrazole","","- C14 H12 N4 O -","- C14 H12 N4 O -","- C56 H48 N16 O4 -","4","1","LN1073","Brigas, Amadeu F.; Clegg, William; Johnstone, Robert A.W.; Mendonca, Ricardo F.","5-Benzyloxy-1-phenyltetrazole: catalytic transfer hydrogenolysis of benzyl ethers","Acta Crystallographica Section C","1999","55","5","778","781","10.1107/S0108270199000141","","","0.71073","MoKα","","0.0902","0.0397","","","","0.0896","","","","","","0.91","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008474","14.276","0.003","15.29","0.003","19.807","0.004","90","","102.36","0.02","90","","4223.3","1.5","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","cis-chlorohydridotetrakis(triethylphosphine)iridium(III) bis(catecholato)borate","","- C36 H69 B Cl Ir O4 P4 -","- C36 H69 B Cl Ir O4 P4 -","- C144 H276 B4 Cl4 Ir4 O16 P16 -","4","1","LN1074","Clegg, William; Elsegood, Mark R.J.; Scott, Andrew J.; Marder, Todd B.; Dai, Chaoyang; Norman, Nicholas C.; Pickett, Nigel L.; Robins, Edward G.","Salts of the bis(catecholato)borate anion with rhodium‒ and iridium‒phosphine complex cations","Acta Crystallographica Section C","1999","55","5","733","739","10.1107/S0108270199000323","","","0.71073","MoKα","","0.05","0.0289","","","","0.0796","","","","","","1.02","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008475","12.5401","0.0008","13.5374","0.0009","16.931","0.0011","91.937","0.002","97.051","0.002","90.121","0.002","2850.8","0.3","160","2","160","2","","","","","","","","7","P -1","-P 1","2","","trans-chlorohydridobis(1,2-bis(diphenylphosphino)ethane)rhodium(III) bis(catecholato)borate dichloromethane solvate","","- C65 H59 B Cl3 O4 P4 Rh -","- C65 H59 B Cl3 O4 P4 Rh -","- C130 H118 B2 Cl6 O8 P8 Rh2 -","2","1","LN1074","Clegg, William; Elsegood, Mark R.J.; Scott, Andrew J.; Marder, Todd B.; Dai, Chaoyang; Norman, Nicholas C.; Pickett, Nigel L.; Robins, Edward G.","Salts of the bis(catecholato)borate anion with rhodium‒ and iridium‒phosphine complex cations","Acta Crystallographica Section C","1999","55","5","733","739","10.1107/S0108270199000323","","","0.71073","MoKα","","0.0591","0.0461","","","","0.1041","","","","","","1.139","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008476","13.932","0.0008","21.2938","0.001","25.5613","0.0014","90","","90","","90","","7583.1","0.7","160","2","160","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","trans-chlorohydridobis(1,2-bis(dicyclohexylphosphino)ethane)rhodium(III) bis(catecholato)borate dichloromethane tetrasolvate","","- C68 H113 B Cl9 O4 P4 Rh -","- C68 H113 B Cl9 O4 P4 Rh -","- C272 H452 B4 Cl36 O16 P16 Rh4 -","4","1","LN1074","Clegg, William; Elsegood, Mark R.J.; Scott, Andrew J.; Marder, Todd B.; Dai, Chaoyang; Norman, Nicholas C.; Pickett, Nigel L.; Robins, Edward G.","Salts of the bis(catecholato)borate anion with rhodium‒ and iridium‒phosphine complex cations","Acta Crystallographica Section C","1999","55","5","733","739","10.1107/S0108270199000323","","","0.71073","MoKα","","0.0993","0.0858","","","","0.1783","","","","","","1.381","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008477","9.7315","0.0009","29.559","0.003","10.8716","0.001","90","","102.541","0.002","90","","3052.6","0.5","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tetrakis(trimethylphosphine)rhodium(I) bis(catecholato)borate","","- C24 H44 B O4 P4 Rh -","- C24 H44 B O4 P4 Rh -","- C96 H176 B4 O16 P16 Rh4 -","4","1","LN1074","Clegg, William; Elsegood, Mark R.J.; Scott, Andrew J.; Marder, Todd B.; Dai, Chaoyang; Norman, Nicholas C.; Pickett, Nigel L.; Robins, Edward G.","Salts of the bis(catecholato)borate anion with rhodium‒ and iridium‒phosphine complex cations","Acta Crystallographica Section C","1999","55","5","733","739","10.1107/S0108270199000323","","","0.71073","MoKα","","0.0609","0.0365","","","","0.0815","","","","","","1.053","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008478","13.4442","0.0007","18.7746","0.001","24.5809","0.0012","90","","90","","90","","6204.5","0.6","160","2","160","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","cis-dihydridotetrakis(trimethylphosphine)rhodium(III) bis(catecholato)borate","","- C24 H46 B O4 P4 Rh -","- C24 H46 B O4 P4 Rh -","- C192 H368 B8 O32 P32 Rh8 -","8","1","LN1074","Clegg, William; Elsegood, Mark R.J.; Scott, Andrew J.; Marder, Todd B.; Dai, Chaoyang; Norman, Nicholas C.; Pickett, Nigel L.; Robins, Edward G.","Salts of the bis(catecholato)borate anion with rhodium‒ and iridium‒phosphine complex cations","Acta Crystallographica Section C","1999","55","5","733","739","10.1107/S0108270199000323","","","0.71073","MoKα","","0.1043","0.0878","","","","0.1903","","","","","","1.448","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008479","10.387","0.001","10.248","0.001","13.857","0.003","90","","107.54","0.02","90","","1406.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 N2 O3 -","- C16 H14 N2 O3 -","- C64 H56 N8 O12 -","4","1","NA1384","Subramanian, E.; Renganayaki, S.; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","<i>N</i>-Methyl-2'-nitrocinnamanilide","Acta Crystallographica Section C","1999","55","5","764","766","10.1107/S010827019801806X","","","0.71073","MoKα","","0.058","0.044","","0.124","0.113","","","","1.029","1.083","1.083","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008480","13.5557","0.0013","9.8241","0.0009","17.604","0.002","90","","90","","90","","2344.4","0.4","295","2","","","","","","","","","","5","P n a 21","P 2c -2n","33","","Dichloro(pentamethylcyclopentadienyl)(2,6-diisopropylaniline)rhodium(III)","","- C22 H34 Cl2 N Rh -","- C22 H34 Cl2 N Rh -","- C88 H136 Cl8 N4 Rh4 -","4","1","NA1385","Lee, Soon W.; Lee, Jae-Gyung","Dichloro(2,6-diisopropylaniline-<i>N</i>)(η^5^-pentamethylcyclopentadienyl)rhodium(III)","Acta Crystallographica Section C","1999","55","5","722","724","10.1107/S0108270198014693","","","0.71073","MoKα","","","0.0232","","","","0.0611","","","","","","1.083","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008481","12.336","0.001","13.447","0.001","20.024","0.001","75.44","0.01","88.71","0.01","63.8","0.01","2869.6","0.5","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","A W-Ag-Se Cluster Compound, (μ~3~-bromine)(μ~3~-tetraselenidotungstide)tris(triphenylphosphinesilver)- ethanol [(μ~3~-Br)(μ~3~-WSe~4~)(AgPPh~3~)~3~]^.^EtOH","","- C56 H51 Ag3 Br O P3 Se4 W -","- C56 H51 Ag3 Br O P3 Se4 W -","- C112 H102 Ag6 Br2 O2 P6 Se8 W2 -","2","1","NA1390","Zhang, Qianfeng; Xin, Xinquan; Hong, Maochun; Cao, Rong; S.Shanmuga Sundara Raj; Hoong-Kun Fun","A W‒Ag‒Se cluster compound: (μ~3~-bromo)(μ~3~-tetraselenidotungstide)tris(triphenylphosphinesilver) ethanol solvate, [(μ~3~-Br)(μ~3~-WSe~4~)(AgPPh~3~)~3~]^.^EtOH","Acta Crystallographica Section C","1999","55","5","726","728","10.1107/S0108270199000207","","","0.71073","MoKα","","0.055","0.041","","","","0.107","","","","","","1.038","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008482","14.084","0.005","14.047","0.005","10.402","0.005","90","0.005","93.463","0.005","90","0.005","2054.2","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[(N,N,N',N"",N""pentamethyldiethylenetriamine)iodoplatinum(II)] [tetraiodo-μ-,μ'-diiododiplatinate(II)]","","- C18 H46 I8 N6 Pt4 -","- C18 H46 I8 N6 Pt4 -","- C36 H92 I16 N12 Pt8 -","2","0.5","NA1394","Francesco P. Fanizzi; Francesco P. Intini; Luciana Maresca; Giovanni Natile; Concetta Pacifico","Bis[iodo(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''-pentamethyldiethylenetriamine-κ^3^<i>N</i>)platinum(II)] di-μ-iodo-bis[diiodoplatinate(II)]","Acta Crystallographica Section C","1999","55","5","712","714","10.1107/S010827019801693X","","","0.71069","MoKα","","","0.043","","","","0.079","","","","","","0.841","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008483","10.386","0.001","22.501","0.001","11.114","0.001","90","","110.08","0.03","90","","2439.4","0.6","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H23 Cl5 N3 O P3 -","- C15 H23 Cl5 N3 O P3 -","- C60 H92 Cl20 N12 O4 P12 -","4","1","NA1395","Hökelek, Tuncer; Kılıç, Adem; Begeç, Saliha; Kılıç, Zeynel","2,4,4,6,6-Pentachloro-2-(2,6-di-<i>tert</i>-butyl-4-methylphenoxy)cyclo-2λ^5^,4λ^5^,6λ^5^-triphosphazatriene","Acta Crystallographica Section C","1999","55","5","783","785","10.1107/S0108270198016941","","","0.71073","MoKα","","","0.038","","","0.05","","","","","1.6","1.6","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008484","8.4481","0.0001","16.4652","0.0001","16.814","0.0002","104.33","0.001","97.886","0.001","92.943","0.001","2235.74","0.04","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,2-di(2-methoxyphenyl)-4-methyl-7,8,9,10-tetrahydro-8,9epoxy[2H]benzo [ 1,2-b]chromene","","- C28 H26 O4 -","- C28 H26 O4 -","- C112 H104 O16 -","4","2","NA1398","Chinnakali, Kandasamy; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vayalakkavoor T.","2,2-Bis(2-methoxyphenyl)-4-methyl-8,9-epoxy-7,8,9,10-tetrahydro-2<i>H</i>-benzo[<i>h</i>]chromene","Acta Crystallographica Section C","1999","55","5","768","770","10.1107/S0108270198018071","","","0.71073","MoKα","","0.118","0.049","","","","0.138","","","","","","0.884","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008485","22.07","0.02","4.419","0.006","22.29","0.03","90","","127.18","0.08","90","","1732","4","293","","","","","","","","","","","5","C 1 2 1","C 2y","5","","(+)-(2R-cis)-10-Bromo-2,3,3a,8-tetrahydro- N,N-dimethyl-dibenz[c,f]isoxazolo[2,3-a]azepine-2-methanamine","","- C19 H21 Br N2 O -","- C19 H21 Br N2 O -","- C76 H84 Br4 N8 O4 -","4","1","NA1399","Oswald M. Peeters; Norbert M. Blaton; Camiel J. De Ranter; Hans L. De Winter","(+)-(2<i>R</i>-<i>cis</i>)-Dimethyl(10-bromo-2,3,3a,8-tetrahydrodibenz[<i>c</i>,<i>f</i>]isoxazolo[2,3-<i>a</i>]azepin-2-ylmethyl)amine","Acta Crystallographica Section C","1999","55","5","794","796","10.1107/S0108270199000219","","","0.71073","MoKα","","0.0633","0.0365","","0.0908","","0.0908","","","1.056","","","1.056","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008486","6.376","0.0001","18.121","0.0002","10.6546","0.0001","90","","107.408","0.0001","90","","1174.65","0.03","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 O3 -","- C16 H12 O3 -","- C64 H48 O12 -","4","1","","Chinnakali, Kandasamy; Fun, Hoong-Kun; Mal, Dipakranjan; Bandopadhyay, Mousumi; Datta, Kalyani; Nigam, Gur Dayal","5a,6,9,9a-Tetrahydro-4-hydroxy-6,9-methano-5H-fluoreno[2,3-b]furan-5-one and 5a,6,9,9a-tetrahydro-6,9-methano-4-methoxy-5H-fluoreno[2,3-b]furan-5-ol","Acta Crystallographica Section C","1999","55","","774","776","","","","","","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008487","9.8318","0.0001","9.9472","0.0002","14.2471","0.0003","73.852","0.008","86.554","0.009","78.916","0.001","1313.38","0.07","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","5,5a,6,9,9a-pentahydro-5-hydroxy-6,9-methano-4-methoxyfluoreno[ 2,3-d]furan","","- C17 H16 O3 -","- C17 H16 O3 -","- C68 H64 O12 -","4","2","NA1407","Chinnakali, Kandasamy; Fun, Hoong-Kun; Mal, Dipakranjan; Bandopadhyay, Mousumi; Datta, Kalyani; Nigam, Gur Dayal","5a,6,9,9a-Tetrahydro-4-hydroxy-6,9-methano-5<i>H</i>-fluoreno[2,3-<i>b</i>]furan-5-one and 5a,6,9,9a-tetrahydro-6,9-methano-4-methoxy-5<i>H</i>-fluoreno[2,3-<i>b</i>]furan-5-ol","Acta Crystallographica Section C","1999","55","5","774","776","10.1107/S0108270199001596","","","0.71073","MoKα","","0.142","0.058","","","","0.159","","","","","","0.906","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008488","10.762","0.002","10.96","0.002","7.16","0.001","100.76","0.01","97.53","0.01","115.33","0.01","728.5","0.2","298.2","","298.2","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H16 N4 O3 Pd -","- C15 H16 N4 O3 Pd -","- C30 H32 N8 O6 Pd2 -","2","1","OA1076","Tamura, Masana; Kajikawa, Yuji; Azuma, Nagao; Tani, Hiroyuki; Tajima, Kunihiko; Kanaori, Kenji; Makino, Keisuke; Takayama, Toshio","[1,3-Bis(pyridine-2-carboxamido)propane]palladium(II) monohydrate and its nickel(II) analogue","Acta Crystallographica Section C","1999","55","5","719","722","10.1107/S0108270198016412","","","0.7107","MoKα","","","0.032","","","","0.035","","","","","","1.57","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008489","7.183","0.002","9.307","0.003","11.326","0.003","90","","105.73","0.02","90","","728.8","0.4","298.2","","298.2","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C15 H16 N4 Ni O3 -","- C14.5 H16 N4 Ni0.5 O2.5 -","- C29 H32 N8 Ni O5 -","2","0.5","OA1076","Tamura, Masana; Kajikawa, Yuji; Azuma, Nagao; Tani, Hiroyuki; Tajima, Kunihiko; Kanaori, Kenji; Makino, Keisuke; Takayama, Toshio","[1,3-Bis(pyridine-2-carboxamido)propane]palladium(II) monohydrate and its nickel(II) analogue","Acta Crystallographica Section C","1999","55","5","719","722","10.1107/S0108270198016412","","","0.7107","MoKα","","","0.043","","","","0.045","","","","","","1.674","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008490","7.145","0.004","32.419","0.009","5.142","0.002","90","","90","","90","","1191.1","0.9","298.2","","298.2","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1,11-undecanediol","","","- C11 H24 O2 -","- C11 H24 O2 -","- C44 H96 O8 -","4","1","OB1004","Naotake Nakamura; Shigetaka Setodoi; Tatsuhiro Ikeya","1,11-Undecanediol","Acta Crystallographica Section C","1999","55","5","789","791","10.1107/S0108270198018253","","","1.5418","CuKα","","0.066","0.0499","","0.0771","0.07","","","","1.334","1.38","1.38","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008491","8.608","0.003","10.393","0.004","12.455","0.005","109.36","0.04","102.24","0.03","92.1","0.03","1020.4","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","10β-Hydroxy-6α-(3,4,5-trimethoxyphenyl)-2,3,6,6aα,7,9,9aβ,10- octahydroisobenzofuro[5,6-g][1,4]benzodioxin-7-one","","- C23 H24 O8 -","- C23 H24 O8 -","- C46 H48 O16 -","2","1","OS1046","A. Sergi Capilla; M. Dolors Pujol; Xavier Solans; Mercè Font-Bardia","10β-Hydroxy-6α-(3,4,5-trimethoxyphenyl)-2,3,6,6aα,7,9,9aβ,10-octahydroisobenzofuro[5,6-<i>g</i>][1,4]benzodioxin-7-one","Acta Crystallographica Section C","1999","55","5","786","787","10.1107/S0108270198017296","","","0.71069","MoKα","","0.067","0.057","","","","0.141","","","","","","1.044","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008492","7.6235","0.0015","7.9661","0.0016","7.9712","0.0016","106.71","0.03","108.96","0.03","95.64","0.03","428.6","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H16 Cl2 Cu N4 O8 -","- C12 H16 Cl2 Cu N4 O8 -","- C12 H16 Cl2 Cu N4 O8 -","1","0.5","QA0091","Huai-Ming Hu; De-Liang Long; Hui-Yi Zeng; Wen-Dan Cheng; Jin-Shun Huang","A redetermination of bis(2-aminomethylpyridine)diperchloratocopper(II)","Acta Crystallographica Section C","1999","55","5","IUC9900049","","10.1107/S0108270199099485","","","0.71073","MoKα","","0.054","0.036","","","","0.083","","","","","","1.048","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008493","14.06","0.0009","26.4879","0.0016","32.732","0.002","90","","90","","90","","12190","1.3","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Tris(1,3-diaminopropane-N,N')nickel(II) diperchlorate","Tris(1,3-diaminopropane-N,N')nickel(II) diperchlorate","","- C9 H30 Cl2 N6 Ni O8 -","- C9 H30 Cl2 N6 Ni O8 -","- C216 H720 Cl48 N144 Ni24 O192 -","24","3","QA0097","Olof Kristiansson","Tris(1,3-diaminopropane-<i>N</i>,<i>N</i>')nickel(II) diperchlorate","Acta Crystallographica Section C","1999","55","5","IUC9900038","","10.1107/S0108270199099539","","","0.71073","MoKα","","0.104","0.06","","","","0.195","","","","","","1.03","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008494","7.4603","0.0005","9.5852","0.0006","10.4734","0.0006","90","","106.713","0.005","90","","717.3","0.08","294","1","294","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7-aminothiazolino[3,2a]pyrimidin-5-one","","- C6 H7 N3 O S -","- C6 H7 N3 O S -","- C24 H28 N12 O4 S4 -","4","1","QA0108","Low, John Nicolson; Ferguson, George; Melguizo, Manuel; Sanchez, Adolfo","7-Amino-2,3-dihydro-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyrimidin-5-one","Acta Crystallographica Section C","1999","55","5","IUC9900048","","10.1107/S0108270199099461","","","0.71073","MoKα","","0.054","0.038","","","","0.127","","","","","","1.32","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008495","11.586","0.001","15.48","0.002","15.408","0.001","90","","103.436","0.008","90","","2687.8","0.5","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","5-Ethyl-2-phenyl-3-trifluoromethyl-1-(2,4,6-trichlorophenyl)-1H- 1,2,4-triazolium hexachloroantimonate","","- C17 H12 Cl9 F3 N3 Sb -","- C17 H12 Cl9 F3 N3 Sb -","- C68 H48 Cl36 F12 N12 Sb4 -","4","1","QA0110","Xian-Jun Liu; Yu-Bo Fan; Yi Liu; Quan-Rui Wang","5-Ethyl-2-phenyl-1-(2,4,6-trichlorophenyl)-3-trifluoromethyl-1<i>H</i>-1,2,4-triazolium hexachloroantimonate","Acta Crystallographica Section C","1999","55","5","IUC9900047","","10.1107/S0108270199099473","","","0.7107","MoKα","","","0.03","","","0.038","","","","","1.54","1.54","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008496","10.649","0.002","5.8777","0.0016","14.8257","0.0015","90","","107.705","0.01","90","","884","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","N,N'-dibenzenesulfonylputrescine","N-{4-[(benzenesulfonyl)amino]butyl}benzenesulfonamide","","- C16 H20 N2 O4 S2 -","- C16 H20 N2 O4 S2 -","- C32 H40 N4 O8 S4 -","2","0.5","QA0111","Linden, Anthony; Bienz, Stefan","<i>N</i>,<i>N</i>'-Dibenzenesulfonylputrescine","Acta Crystallographica Section C","1999","55","5","IUC9900046","","10.1107/S010827019909945X","","","0.71069","MoKα","","0.06","0.036","","","","0.105","","","","","","1.027","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008498","8.1864","0.0006","18.141","0.002","9.3307","0.0007","90","","103.662","0.006","90","","1346.5","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis{[2-(1,5-diazacyclooctane)methyl phenol]copper}-di(μ-(end-on)azide)","","- C26 H38 Cu2 N10 O2 -","- C26 H38 Cu2 N10 O2 -","- C52 H76 Cu4 N20 O4 -","2","0.5","QB0072","Weiming Bu; Ling Ye; Qiang Xu; Xianhe Bu; Guangdi Yang; Yuguo Fan","Bis(μ-azido-κ<i>N</i>^1^:κ<i>N</i>^1^)bis{[2-(1,5-diazacyclooct-1-yl-κ^2^<i>N</i>,<i>N</i>'-methyl)phenolato-κ<i>O</i>]copper(II)}","Acta Crystallographica Section C","1999","55","5","IUC9900044","","10.1107/S0108270199099515","","","0.71073","MoKα","","0.051","0.041","","0.065","0.05","","","","1.002","1.028","1.028","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008499","8.332","0.002","13.766","0.003","17.264","0.004","90","","90","0.03","90","","1980.2","0.8","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","Sodium hydrogen dichloro(ethylenediaminetetra-acetate) ruthenium(III) eneahydrate","","- C20 H47 Cl4 N4 Na O25 Ru2 -","- C20 H46 Cl4 N4 Na O25 Ru2 -","- C40 H92 Cl8 N8 Na2 O50 Ru4 -","2","1","QB0080","Stadler, Eduardo; Stadler, Carlos C.; Peixoto, Carlos R. de M.; Vencato, Ivo","Sodium hydrogen bis[dichloro(dihydrogen ethylenediaminetetraacetato-<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>')ruthenium(III)] nonahydrate","Acta Crystallographica Section C","1999","55","5","IUC9900051","","10.1107/S0108270199099503","","","0.71073","MoKα","","0.023","0.023","","","","0.062","","","","","","1.082","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008500","6.318","0.004","15.69","0.04","11.161","0.006","90","","103.48","0.05","90","","1076","3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3β,4β-epoxy-7-oxo-7a-oxa-5β-cholanoic acid","","- C24 H36 O5 -","- C24 H36 O5 -","- C48 H72 O10 -","2","1","QB0082","Angel Dago Morales; Santiago García-Granda; Roxana Pérez Gil; Francisco Coll-Manchado","3β,4β-Epoxy-7-oxo-7a-oxa-7a-homo-5β-cholan-24-oic acid","Acta Crystallographica Section C","1999","55","5","IUC9900043","","10.1107/S0108270199099448","","","0.71073","MoKα","","0.107","0.053","","","","0.155","","","","","","1.034","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008501","10.361","0.01","13.044","0.01","18.806","0.006","90","","90","","90","","2542","3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(25R)-3β-Bromo-5α-spirostan-6,23-dione","","- C27 H39 Br O4 -","- C27 H39 Br O4 -","- C108 H156 Br4 O16 -","4","1","QB0083","Angel Dago Morales; Santiago García-Granda; Martín Andrés Iglesias-Arteaga; Francisco Coll-Manchado","(25<i>R</i>)-3β-Bromo-5α-spirostan-6,23-dione","Acta Crystallographica Section C","1999","55","5","IUC9900042","","10.1107/S0108270199099436","","","0.71073","MoKα","","0.305","0.041","","","","0.107","","","","","","0.929","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008502","6.001","0.003","12.107","0.004","22.995","0.005","90","","90","","90","","1670.7","1.1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S,S)-Ferrocenyl[methyl(1-phenyl-ethyl)amino]acetonitrile","","- C21 H22 Fe N2 -","- C21 H22 Fe N2 -","- C84 H88 Fe4 N8 -","4","1","QB0089","Howell, James A. S.; Humphries, Kristina; McArdle, Patrick; Cunningham, Desmond; Walsh, Martin; Daly, Pearl","(<i>S</i>,<i>S</i>)-Ferrocenyl[methyl(1-phenylethyl)amino]acetonitrile","Acta Crystallographica Section C","1999","55","5","IUC9900050","","10.1107/S0108270199099497","","","0.5","synchrotron","","0.032","0.029","","","","0.074","","","","","","1.004","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008503","20.62","0.006","13.147","0.004","9.601","0.005","90","","101.14","0.03","90","","2553.7","1.7","293","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H12 Cl N3 O2 -","- C13 H12 Cl N3 O2 -","- C104 H96 Cl8 N24 O16 -","8","1","QB0090","Benakli, K.; Crozet, M. P.; Vanelle, P.; Giorgi, M.","(<i>E</i>)-2-[2-(4-Chloromethylphenyl)vinyl]-1-methyl-5-nitro-1<i>H</i>-imidazole","Acta Crystallographica Section C","1999","55","5","IUC9900041","","10.1107/S0108270199099424","","","0.71073","MoKα","","0.084","0.051","","","","0.148","","","","","","1.063","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008504","11.337","0.002","9.96","0.002","11.423","0.002","90","","117.15","0.01","90","","1147.7","0.4","297","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","4,4-Dimethyltricyclo[6.3.0.0^1,7^]undecane-2,6-dione","","- C13 H18 O2 -","- C13 H18 O2 -","- C52 H72 O8 -","4","1","QB0094","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","<i>cis</i>-4,4-Dimethyltricyclo[6.3.0.0^1,7^]undecane-2,6-dione","Acta Crystallographica Section C","1999","55","5","IUC9900039","","10.1107/S0108270199099412","","","0.71073","MoKα","","","0.065","","","","0.076","","","","","","1.09","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008505","10.994","0.002","6.718","0.002","16.824","0.002","90","","102.59","0.01","90","","1212.7","0.4","297","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione","","- C12 H17 Br O2 -","- C12 H17 Br O2 -","- C48 H68 Br4 O8 -","4","1","QB0095","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","3-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (I), 5-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 3,5-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 1,7-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (IV)","Acta Crystallographica Section C","1999","55","5","IUC9900040","","10.1107/S0108270199099400","","","0.71073","MoKα","","","0.054","","","","0.069","","","","","","1.31","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008506","7.186","0.001","18.104","0.002","9.569","0.002","90","","97.34","0.02","90","","1234.7","0.3","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione","","- C12 H17 Br O2 -","- C12 H17 Br O2 -","- C48 H68 Br4 O8 -","4","1","QB0095","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","3-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (I), 5-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 3,5-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 1,7-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (IV)","Acta Crystallographica Section C","1999","55","5","IUC9900040","","10.1107/S0108270199099400","","","0.71073","MoKα","","","0.057","","","","0.074","","","","","","1.31","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008507","16.027","0.003","11.741","0.004","14.477","0.003","90","","102.56","0.01","90","","2659","1.2","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,5-Dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione","","- C12 H16 Br2 O2 -","- C12 H16 Br2 O2 -","- C96 H128 Br16 O16 -","8","1","QB0095","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","3-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (I), 5-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 3,5-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 1,7-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (IV)","Acta Crystallographica Section C","1999","55","5","IUC9900040","","10.1107/S0108270199099400","","","0.71073","MoKα","","","0.055","","","","0.085","","","","","","1.88","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008508","7.228","0.002","15.875","0.003","5.851","0.002","99.57","0.03","98.31","0.03","77.2","0.02","641.5","0.3","298","","","","","","","","","","","4","P -1","-P 1","2","","1,7-Dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione","","- C12 H16 Br2 O2 -","- C12 H16 Br2 O2 -","- C24 H32 Br4 O4 -","2","1","QB0095","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","3-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (I), 5-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 3,5-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 1,7-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (IV)","Acta Crystallographica Section C","1999","55","5","IUC9900040","","10.1107/S0108270199099400","","","0.71073","MoKα","","","0.041","","","","0.055","","","","","","1.23","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008509","21.797","0.004","17.904","0.004","12.497","0.002","90","","112.59","0.03","90","","4502.8","1.8","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","aqua(2,2'-bipyrimidine-N,N')(2,6-di(2-pyridyl)-pyridineN,N',N'') dicopper(II) tetraperchlorate","","- C38 H30 Cl4 Cu2 N10 O17 -","- C38 H30 Cl4 Cu2 N10 O17 -","- C152 H120 Cl16 Cu8 N40 O68 -","4","0.5","SK1194","Francese, Giancarlo; Schmalle, Helmut W.; Decurtins, Silvio","A copper(II) dimer: aqua(μ-2,2'-bipyrimidine-<i>N</i>,<i>N</i>')(perchlorato)bis{[2,6-bis(2-pyridyl)pyridine-<i>N</i>,<i>N</i>',<i>N</i>'']copper(II)} triperchlorate","Acta Crystallographica Section C","1999","55","5","730","733","10.1107/S0108270199000530","","","0.71073","MoKα","","0.1036","0.0461","","","","0.1478","","","","","","1.029","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008510","12.9","0.002","18.135","0.002","21.822","0.004","90","","97.42","0.01","90","","5062.3","1.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-poly[triphenyltin-μ-(N,N-diethylthiocarbamoylthioacetato)-O:O']","","- C25 H27 N O2 S2 Sn -","- C25 H27 N O2 S2 Sn -","- C200 H216 N8 O16 S16 Sn8 -","8","2","SK1233","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng; Hook, James M.","<i>catena</i>-Poly[triphenyltin-μ-(<i>N</i>,<i>N</i>-diethylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')], <i>catena</i>-poly[triphenyltin-μ-(<i>N</i>-methyl-<i>N</i>-phenylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')] and triphenyl(<i>N</i>,<i>N</i>-tetramethylenethiocarbamoylthioacetato-<i>O</i>)tin","Acta Crystallographica Section C","1999","55","5","744","748","10.1107/S0108270199002954","","","0.71073","MoKα","","0.1","0.058","","","","0.166","","","","","","1.009","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008511","17.019","0.002","18.466","0.002","18.921","0.002","71.952","0.007","72.482","0.008","73.333","0.009","5267.3","1.1","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","catena-poly[(triphenyltin-μ-N-methyl-N-phenyldithiocarbamoylacetato)-O:O']","","- C28 H25 N O2 S2 Sn -","- C28 H25 N O2 S2 Sn -","- C224 H200 N8 O16 S16 Sn8 -","8","4","SK1233","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng; Hook, James M.","<i>catena</i>-Poly[triphenyltin-μ-(<i>N</i>,<i>N</i>-diethylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')], <i>catena</i>-poly[triphenyltin-μ-(<i>N</i>-methyl-<i>N</i>-phenylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')] and triphenyl(<i>N</i>,<i>N</i>-tetramethylenethiocarbamoylthioacetato-<i>O</i>)tin","Acta Crystallographica Section C","1999","55","5","744","748","10.1107/S0108270199002954","","","0.71073","MoKα","","0.097","0.052","","","","0.124","","","","","","1.002","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008512","9.7442","0.0003","9.8923","0.0005","13.3187","0.0004","107.064","0.004","95.246","0.003","97.153","0.004","1206.62","0.09","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","(N,N-tetramethylenethiocarbamoylthioacetato)triphenyltin","","- C25 H25 N O2 S2 Sn -","- C25 H25 N O2 S2 Sn -","- C50 H50 N2 O4 S4 Sn2 -","2","1","SK1233","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng; Hook, James M.","<i>catena</i>-Poly[triphenyltin-μ-(<i>N</i>,<i>N</i>-diethylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')], <i>catena</i>-poly[triphenyltin-μ-(<i>N</i>-methyl-<i>N</i>-phenylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')] and triphenyl(<i>N</i>,<i>N</i>-tetramethylenethiocarbamoylthioacetato-<i>O</i>)tin","Acta Crystallographica Section C","1999","55","5","744","748","10.1107/S0108270199002954","","","0.71073","MoKα","","0.024","0.021","","","","0.057","","","","","","1.003","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008513","7.654","0.002","11.578","0.002","17.771","0.003","90","","90","","90","","1574.8","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Polimeric (Aqua-1κO)bis[(R,R)-tartrato-1κ^2^O^1^,O^2^:2κ^2^O^3^,O^4^] dicadmium(II) Trihydrate","","- C8 H16 Cd2 O16 -","- C8 H8 Cd2 O16 -","- C32 H32 Cd8 O64 -","4","1","SK1241","González-Silgo, Cristina; González-Platas, Javier; Ruiz-Pérez, Catalina; López, Trinidad; Torres, Manuel Eulalio","Polymeric aqua-1κ<i>O</i>-bis[μ-(<i>R</i>,<i>R</i>)-tartrato-1κ^2^<i>O</i>^1^,<i>O</i>^2^:2κ^2^<i>O</i>^3^,<i>O</i>^4^]dicadmium(II) trihydrate","Acta Crystallographica Section C","1999","55","5","710","712","10.1107/S0108270199000542","","","0.71069","MoKα","","0.0285","0.028","","0.0717","","0.0717","","","1.204","","","1.204","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008514","6.8228","0.0001","7.1672","0.0002","31.9396","0.0006","90","","90","","90","","1561.86","0.06","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Pipemidic Acid Hydrochloride","","- C14 H18 Cl N5 O3 -","- C14 H18 Cl N5 O3 -","- C56 H72 Cl4 N20 O12 -","4","1","SK1259","Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak; Shu-zhong Zhan; Chuan-jiang Hu; Qingjin Meng","Pipemidic acid hydrochloride","Acta Crystallographica Section C","1999","55","5","766","768","10.1107/S0108270198018277","","","0.71073","MoKα","","0.055","0.049","","","","0.13","","","","","","1.118","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008515","22.2132","0.0015","12.9986","0.0013","8.5456","0.0005","90","","96.107","0.005","90","","2453.5","0.3","294","1","294","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5,5,6-Triacetyl-5,6-diaminopyrimidine-2,4-(1H,3H)-dione","","- C10 H12 N4 O5 -","- C10 H12 N4 O5 -","- C80 H96 N32 O40 -","8","1","SK1260","Low, John Nicolson; Ferguson, George; Nogueras, Manuel; Sánchez, Adolfo; Cobo, Justo","6-Acetylamino-5-(diacetylamino)pyrimidine-2,4(1<i>H</i>,3<i>H</i>)-dione","Acta Crystallographica Section C","1999","55","5","749","751","10.1107/S0108270198018290","","","0.71073","MoKα","","0.0765","0.0426","","","","0.1087","","","","","","1.025","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008516","11.9991","0.0002","9.0405","0.0002","12.0566","0.0002","90","","99.472","0.001","90","","1290.04","0.04","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-Ethyl-2-(3-oxobutyl)cycloheptane-1,3-dione","","- C13 H20 O3 -","- C13 H20 O3 -","- C52 H80 O12 -","4","1","SK1261","Kandasamy Chinnakali; Hoong-Kun Fun; Desikan Rajagopal; Sambasivam Swaminathan","2-Ethyl-2-(3-oxobutyl)cycloheptane-1,3-dione","Acta Crystallographica Section C","1999","55","5","772","774","10.1107/S0108270198018289","","","0.71073","MoKα","","0.092","0.057","","","","0.172","","","","","","0.981","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008517","11.5436","0.0004","18.282","0.0006","8.2935","0.0003","90","","107.141","0.001","90","","1672.52","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(p-Methoxyphenyl)-3,5-bis(2-pyridyl)-4H-1,2,4-triazole","","- C19 H15 N5 O -","- C19 H15 N5 O -","- C76 H60 N20 O4 -","4","1","SK1269","Hoong-Kun Fun; Kandasamy Chinnakali; Sichang Shao; Dunru Zhu; Xiao Zeng You","4-(<i>p</i>-Methoxyphenyl)-3,5-bis(2-pyridyl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","1999","55","5","770","772","10.1107/S0108270199001821","","","0.71073","MoKα","","0.074","0.046","","","","0.12","","","","","","1.029","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008518","9.9485","0.0006","9.3724","0.0006","20.3571","0.0011","90","","98.605","0.006","90","","1876.8","0.2","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2'-Biphenol‒1,10-phenanthroline (1/1).","","- C24 H18 N2 O2 -","- C24 H18 N2 O2 -","- C96 H72 N8 O8 -","4","1","SK1270","Lavender, Emma S.; Gregson, Richard M.; Ferguson, George; Glidewell, Christopher","2,2'-Biphenol‒1,10-phenanthroline (1/1): a two-dimensional structure built up from three types of hydrogen bond and π‒π stacking interactions","Acta Crystallographica Section C","1999","55","5","751","754","10.1107/S0108270199002942","","","0.7107","MoKα","","0.081","0.039","","","","0.107","","","","","","1.022","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008519","7.3635","0.0007","9.8643","0.001","11.4142","0.0015","110.845","0.008","99.069","0.012","92.998","0.009","759.83","0.16","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","1,4,8,11-Tetraazacyclotetradecane‒2,2'-biphenol (1/2)","","- C34 H44 N4 O4 -","- C34 H44 N4 O4 -","- C34 H44 N4 O4 -","1","0.5","SK1271","Ferguson, George; Gregson, Richard M.; Glidewell, Christopher","A chain of fused <i>R</i>^2^~2~(10) and <i>R</i>^4^~6~(12) rings in the hydrogen-bonded structure of 1,4,8,11-tetraazacyclotetradecane‒2,2'-biphenol (1/2)","Acta Crystallographica Section C","1999","55","5","815","817","10.1107/S0108270199001833","","","0.71073","MoKα","","0.074","0.043","","","","0.111","","","","","","1.03","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008520","12.748","0.002","6.11","0.003","14.87","0.006","90","","99.51","0.02","90","","1142.3","0.8","100","","100","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","dl-3-[[2,5-dihydro-3-methyl-2-oxo-5-furanyl]oxo]methylene-3,3a,6,6a- tetrahydro-2H-cyclopenta[b]furan-2-one","","- C13 H12 O5 -","- C13 H12 O5 -","- C52 H48 O20 -","4","1","SX1062","Rugutt, Joseph K.; Fronczek, Frank R.; Yarabe, Houphouet H.; Shamsi, Shahab A.; Henry III, Charles W.; Billiot, Eugene J.; Warner, Isiah M.","A racemic strigol analogue at 100K","Acta Crystallographica Section C","1999","55","5","759","761","10.1107/S0108270199001341","","","0.71073","Mo-Kα","","0.063","0.05","","0.056","0.055","","","","1.992","1.976","1.976","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008521","21.205","0.004","37.941","0.008","12.227","0.002","90","","90","","90","","9837","3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","TNLP","Theonellapeptolide-Id","","- C70 H149 N13 O28 -","- C70 H125 N13 O27.65 -","- C280 H500 N52 O110.6 -","4","1","SX1064","Mitsunobu Doi; Toshimasa Ishida; Motomasa Kobayashi; Jeffrey R. Deschamps; Judith L. Flippen-Anderson","The highly solvated structure of theonellapeptolide Id, a tridecapeptide lactone from the Okinawa marine sponge <i>Theonella swinhoei</i>","Acta Crystallographica Section C","1999","55","5","796","798","10.1107/S0108270198014383","","","1.5418","CuKα","","0.136","0.113","","","","0.287","","","","","","1.02","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008522","5.869","0.001","22.53","0.003","8.753","0.001","90","","98.67","0.01","90","","1144.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","PHTU","1-(2-Pyridyl)-3-phenylthiourea","","- C12 H11 N3 S -","- C12 H11 N3 S -","- C48 H44 N12 S4 -","4","1","SX1068","West, Douglas X.; Hermetet, Anne K.; Ackerman, Lily J.; Valdés-Martínez, Jesús; Hernández-Ortega, Simón","3-Phenyl-1-(2-pyridyl)thiourea","Acta Crystallographica Section C","1999","55","5","811","813","10.1107/S0108270198018083","","","0.71073","MoKα","","0.08","0.05","","","0.13","0.149","","","","","","1.072","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008523","8.144","0.002","10.004","0.002","24.101","0.005","90","","90","","90","","1963.6","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","acetylated illustrol","3'-14-epoxy-4',15-dioxaandrost-5-en-3β-yl acetate","","- C22 H30 O5 -","- C22 H30 O5 -","- C88 H120 O20 -","4","1","SX1075","Vencato, Ivo; Niero, Rivaldo; Montanari, João L.; Calixto, João B.; Sant'Ana, Antonio E. G.; Yunes, Rosendo A.","A new 14:15-seco-15-norpregnane derivative from <i>Mandevilla illustris</i> Woodson (Apocynaceae)","Acta Crystallographica Section C","1999","55","5","827","829","10.1107/S0108270199000529","","","0.71073","MoKα","","0.067","0.045","","","","0.143","","","","","","1.069","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008524","10.399","0.003","14.467","0.005","14.216","0.006","90","","104.27","0.03","90","","2072.7","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Cis-(Nitrato-O,O')(C-rac-1,5,8,12-tetramethyl-1,4,8,11- tetraazacyclotetradecane-N,N',N'',N''')nickel(II) Nitrate","","- C14 H32 N6 Ni O6 -","- C14 H32 N6 Ni O6 -","- C56 H128 N24 Ni4 O24 -","4","0.5","TA1219","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Liao, Fen-Ling; Chung, Chung-Sun","<i>cis</i>-(Nitrato-<i>O</i>,<i>O</i>')[(1<i>RS</i>,4<i>SR</i>,5<i>SR</i>,8<i>RS</i>,11<i>SR</i>,12<i>SR</i>)-<i>C</i>-<i>rac</i>-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>]nickel(II) nitrate","Acta Crystallographica Section C","1999","55","5","724","726","10.1107/S0108270198014449","","","0.71073","MoKα","","0.0435","0.0369","","","","0.1035","","","","","","1.075","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008525","10.594","0.002","7.461","0.004","22.92","0.005","90","","90","","90","","1811.6","1.1","153.2","","153.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C2 H10 N4 O6 S -","- C2 H10 N4 O6 S -","- C16 H80 N32 O48 S8 -","8","1","BK1397","Chen, Tianlang; Xiao, Shenxiu; Zhong, Boyu; Stern, Charlotte L.; Ellis, Donald E.","Uronium sulfate, [OHC(NH~2~)~2~]~2~(SO~4~)","Acta Crystallographica Section C","1999","55","6","994","996","10.1107/S0108270198014619","","","0.7107","MoKα","","0.0411","0.023","","0.066","","0.034","","","2.217","","","2.44","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008526","13.702","0.003","14.167","0.003","10.598","0.002","90","","97.34","0.03","90","","2040.4","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 F3 Na2 O11 S2 -","- C13 H15 F3 Na2 O11 S2 -","- C52 H60 F12 Na8 O44 S8 -","4","1","BK1421","Wang, Feng; Qi, Yinghua; Chen, Tianlu; Xing, Yan; Lin, Yonghua; Xu, Jiping","Disodium 4,4'-difluoro-3,3'-carbonyldibenzenesulfonate hydrofluoride tetrahydrate","Acta Crystallographica Section C","1999","55","6","871","873","10.1107/S0108270198016710","","","0.71073","MoKα","","0.0553","0.0407","","0.1274","0.1216","","","","1.009","1.113","1.113","","","","","has coordinates","199684","2020-10-21","18:00:00",""
"2008527","8.951","0.0018","10.8181","0.0016","16.585","0.003","77.735","0.014","81.298","0.016","73.906","0.015","1500.5","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Hexakis(imidazole)nickel(II) oxydiacetate ethanol solvate","","- C24 H34 N12 Ni O6 -","- C23.04 H30.6 N12 Ni O5.52 -","- C46.08 H61.2 N24 Ni2 O11.04 -","2","1","BK1429","Perec, Mireille; Baggio, Ricardo; Garland, Maria Teresa","Hexakis(imidazole-<i>N</i>^3^)nickel(II) oxydiacetate ethanol solvate","Acta Crystallographica Section C","1999","55","6","858","860","10.1107/S0108270199001420","","","0.71073","MoKα","","0.076","0.049","","","","0.147","","","","","","1.077","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008528","3.8724","0.0002","12.0839","0.0005","18.4079","0.0006","90","","91.412","0.002","90","","861.11","0.06","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","naphthalene-2,3-dicarbaldehyde","","- C12 H8 O2 -","- C12 H8 O2 -","- C48 H32 O8 -","4","1","BK1446","Britton, Doyle","Naphthalene-2,3-dicarbaldehyde","Acta Crystallographica Section C","1999","55","6","978","980","10.1107/S0108270199000840","","","0.71073","MoKα","","0.047","0.039","","0.108","0.101","","","","1.06","1.08","1.08","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008529","12.922","0.002","13.914","0.002","14.263","0.006","65.05","0.02","73.3","0.03","64.59","0.01","2082.4","1","295","","295","","","","","","","","","7","P -1","-P 1","2","","","","- C16 H12 F3 N2 O8 Re S -","- C16 H8 F3 N2 O7.995 Re S -","- C64 H32 F12 N8 O31.98 Re4 S4 -","4","2","BK1449","Connick, William B.; Di Bilio, Angel J.; Schaefer, William P.; Gray, Harry B.","The red form of [Re(phen)(CO)~3~(H~2~O)]CF~3~SO~3~^.^H~2~O","Acta Crystallographica Section C","1999","55","6","913","916","10.1107/S0108270199001432","","","0.7107","MoKα","","0.058","0.058","","0.075","0.075","","","","1.66","1.66","1.66","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008530","11.148","0.002","14.47","0.01","11.08","0.01","110.13","0.06","96.85","0.03","81.97","0.04","1657","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tetra-μ-[(2,6-dichlorophenyl)amino-phenyl(acetato-O,O')]-bis(acetone-O) -di-copper(II), acetaldeyde solvate","","- C64 H56 Cl8 Cu2 N4 O11 -","- C64 H56 Cl8 Cu2 N4 O11 -","- C64 H56 Cl8 Cu2 N4 O11 -","1","0.5","BM1274","Castellari, Carlo; Feroci, Giorgio; Ottani, Stefano","Diclofenac interactions: tetrakis[μ-2-(2,6-dichloroanilino)phenylacetato]-1:2κ^8^<i>O</i>:<i>O</i>'-diacetone-1κ<i>O</i>,2κ<i>O</i>-dicopper(II)(<i>Cu</i>—<i>Cu</i>) acetaldehyde solvate","Acta Crystallographica Section C","1999","55","6","907","910","10.1107/S0108270199002206","","","0.71069","MoKα","","0.137","0.042","","","","0.11","","","","","","0.902","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008531","13.82","0.001","9.3728","0.0011","15.308","0.0012","90","","92.144","0.002","90","","1981.5","0.3","295","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Cu I2 N2 O2 Zn -","- C17 H16 Cu I2 N2 O2 Zn -","- C68 H64 Cu4 I8 N8 O8 Zn4 -","4","1","BM1298","Ercan, Filiz; Arıcı, Cengiz; Ülkü, Dinçer; Atakol, Orhan; Aksu, Mecit","{[μ-Bis(salicylidene)-1,3-propanediaminato]-copper(II)}diiodozinc(II)","Acta Crystallographica Section C","1999","55","6","930","932","10.1107/S0108270199002851","","","0.71073","MoKα","","","0.04","","","0.044","","","","","0.98","0.98","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008532","8.4341","0.0001","15.5112","0.0003","11.4293","0.0001","90","","90.397","0.001","90","","1495.18","0.04","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 O4 -","- C17 H18 O4 -","- C68 H72 O16 -","4","1","","Ercan, Filiz; Arıcı, Cengiz; Ülkü, Dinçer; Atakol, Orhan; Aksu, Mecit","{[μ-Bis(salicylidene)-1,3-propanediaminato]copper(II)}diiodozinc(II)","Acta Crystallographica Section C","1999","55","","930","932","","","","","","","","","","","","","","","","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008533","14.835","0.002","7.157","0.003","14.971","0.003","90","","103.05","0.04","90","","1548.5","0.8","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Oleana-13(18), 15(16)-diene-3β, 28-diol diacetate","","- C34 H52 O4 -","- C34 H52 O4 -","- C68 H104 O8 -","2","1","BM1304","Bhattacharyya, Kinkini; Kar, Tanusree; Dutta, Pradeep Kumar; Bocelli, Gabriele; Righi, Lara","Dimethyl oleana-13(18),15(16)-diene-3β,28-diacetate","Acta Crystallographica Section C","1999","55","6","992","994","10.1107/S0108270199002255","","","1.54178","CuKα","","0.1122","0.0539","","0.1716","0.1247","","","","0.822","1.048","1.048","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008534","7.9607","0.0002","9.9649","0.0002","14.2553","0.0003","86.208","0.001","79.818","0.001","73.889","0.001","1069.14","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Acetyl-6-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl 4-toluenesulfonate","","- C25 H24 O4 S -","- C25 H24 O4 S -","- C50 H48 O8 S2 -","2","1","BM1306","Chinnakali, Kandasamy; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vayalakkavoor T.","2-Acetyl-6-phenyl-5,6,7,8-tetrahydro-1-naphthyl <i>p</i>-toluenesulfonate","Acta Crystallographica Section C","1999","55","6","944","946","10.1107/S0108270199001791","","","0.71073","MoKα","","0.123","0.07","","","","0.195","","","","","","1.014","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008535","10.412","0.001","8.516","0.001","21.556","0.001","90","","101.223","0.01","90","","1874.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-ethyl-5-[(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalene)-methynyl]- 2,4-triazolidindione","","- C20 H25 N O2 S -","- C20 H25 N O2 S -","- C80 H100 N4 O8 S4 -","4","1","BM1315","Bozdag-Dundar, Oya; Dundar, Burak; Buyukbingol, Erdem; Caira, Mino R","3-Ethyl-5-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthylmethylene)thiazolidine-2,4-dione","Acta Crystallographica Section C","1999","55","6","1027","1029","10.1107/S0108270199002267","","","0.71069","MoKα","","0.068","0.0521","","0.1674","","0.1516","","","1.049","","","1.093","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008536","11.662","0.005","14.323","0.007","8.7","0.004","90","0.03","94.57","0.04","90","0.03","1448.6","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-phenylamide of 2-cyano-5-phenylpent-2-en-4-ynoic acid","","- C18 H12 N2 O -","- C18 H12 N2 O -","- C72 H48 N8 O4 -","4","1","BM1318","Borbulevych, Oleg Ya.; Golding, Igor R.; Kharitonkin, Andrey B.; Shishkin, Oleg V.; Gololobov, Yuriy G.","The <i>N</i>-phenylamide of 2-cyano-5-phenylpent-2-en-4-ynoic acid","Acta Crystallographica Section C","1999","55","6","1019","1020","10.1107/S0108270199002218","","","0.71073","MoKα","","0.1255","0.0487","","0.1521","","0.1131","","","0.86","","","1.092","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008537","9.529","0.002","16.354","0.005","13.719","0.005","90","","105.13","0.01","90","","2063.8","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(n-butyl)(dichloro)(2,2'-bipyridyl)tin(IV)","","- C18 H26 Cl2 N2 Sn -","- C18 H26 Cl2 N2 Sn -","- C72 H104 Cl8 N8 Sn4 -","4","1","BM1319","Jennifer Gill; Hans Parge; Christine J. Cardin; Chris Tsiamis; Constantin Kavounis","(2,2'-Bipyridyl-<i>N</i>,<i>N</i>')di-<i>n</i>-butyldichlorotin(IV)","Acta Crystallographica Section C","1999","55","6","875","876","10.1107/S010827019900325X","","","0.71073","MoKα","","0.065","0.054","","","","0.158","","","","","","1.119","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008538","6.142","0.001","6.142","0.001","14.395","0.002","90","","90","","120","","470.29","0.13","295","2","295","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","potassium oxo antimonide","","- K4 O3 Sb2 -","- K4 O3 Sb2 -","- K8 O6 Sb4 -","2","0.166667","BR1231","Tillard, Monique; Monconduit, Laure; Traber, Boris; Belin, Claude","K~4~Sb~2~O~3~ containing the Sb~2~O~3~^4-^ anion","Acta Crystallographica Section C","1999","55","6","833","835","10.1107/S0108270198018484","","","0.71073","MoKα","","0.086","0.048","","","","0.126","","","","","","1.133","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008539","7.274","0.0011","7.2911","0.0011","18.551","0.003","96.375","0.009","90.714","0.009","119.656","0.008","847.1","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","sodium tungsten oxide","","- Na5 O44 W14 -","- Na5 O44 W14 -","- Na5 O44 W14 -","1","0.5","BR1234","Triantafyllou, Spyros T.; Christidis, Panayiotis C.","Triclinic sodium tungsten oxide, Na~5~W~14~O~44~","Acta Crystallographica Section C","1999","55","6","838","841","10.1107/S0108270199002760","","","0.7107","MoKα","","0.09","0.063","","","","0.159","","","","","","1.004","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008540","5.221","0.001","9.983","0.001","7.388","0.001","90","","90.21","0.004","90","","385.07","0.1","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","sodium cobalt(II) phosphate","","- Co Na O4 P -","- Co Na O4 P -","- Co4 Na4 O16 P4 -","4","1","BR1238","Chippindale, Ann M.; Cowley, Andrew R.; Chen, Jiesheng; Gao, Qiuming; Xu, Ruren","A new modification of NaCoPO~4~ with the zeolite ABW structure","Acta Crystallographica Section C","1999","55","6","845","847","10.1107/S010827019900414X","","","0.71069","MoKα","","","0.0182","","","0.02","","","","","1.0847","1.0847","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008541","18.793","0.002","18.793","0.002","18.793","0.002","90","","90","","90","","6637.3","1.2","200","2","200","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C27 H36 Cl4 Fe2 N6 -","- C27 H36 Cl4 Fe2 N6 -","- C216 H288 Cl32 Fe16 N48 -","8","0.333333","CF1275","Alcock, Nathaniel W.; Zhang, Delong; Busch, Daryle H.","Tris(2-pyridylmethyl)triazacyclododecane complexes of Fe^II^ and Cu^II^","Acta Crystallographica Section C","1999","55","6","886","889","10.1107/S0108270198018381","","","0.71073","MoKα","","0.088","0.063","","0.173","0.157","","","","1.094","1.165","1.165","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008542","24.309","0.005","13.543","0.003","41.392","0.008","90","","90","","90","","13627","5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C28 H37.5 Cu F12 N6.5 P2 -","- C28 H27.988 Cu F12 N6.5 P2 -","- C448 H447.808 Cu16 F192 N104 P32 -","16","2","CF1275","Alcock, Nathaniel W.; Zhang, Delong; Busch, Daryle H.","Tris(2-pyridylmethyl)triazacyclododecane complexes of Fe^II^ and Cu^II^","Acta Crystallographica Section C","1999","55","6","886","889","10.1107/S0108270198018381","","","0.71073","MoKα","","0.124","0.066","","","","0.179","","","","","","0.842","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2008543","9.5694","0.001","12.0225","0.001","19.5555","0.001","103.82","0.01","91.434","0.01","110.249","0.01","2035.3","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","trans-carbonyl[η^2^-dihydrobis(pyrazol-1-yl)borato]hydridobis- (triphenylarsino)ruthenium(II) monohydrate","","- C43 H41 As2 B N4 O2 Ru -","- C43 H39 As2 B N4 O2 Ru -","- C86 H78 As4 B2 N8 O4 Ru2 -","2","1","CF1291","Huh, Seong; Kim, Youngmee; Park, Seongsoon; Park, Tae-Jin; Jun, Moo-Jin","<i>trans</i>-Carbonyl[η^2^-dihydrobis(pyrazol-1-yl-<i>N</i>^2^)borato]hydridobis(triphenylarsine)ruthenium(II) monohydrate","Acta Crystallographica Section C","1999","55","6","850","852","10.1107/S0108270199002279","","","0.71073","MoKα","","0.0778","0.0463","","","","0.1526","","","","","","1.118","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008544","6.377","0.002","6.972","0.003","10.514","0.016","90","","104.45","","90","","452.7","0.7","122","0.2","122","0.5","","","","","","","","4","P 1 21 1","P 2yb","4","","(R)-(+)-2-(4-Chlorophenoxy)propionic acid","","- C9 H9 Cl O3 -","- C9 H9 Cl O3 -","- C18 H18 Cl2 O6 -","2","1","CF1292","Henning Osholm Sørensen; André Collet; Sine Larsen","(<i>R</i>)-(+)-2-(4-Chlorophenoxy)propionic acid","Acta Crystallographica Section C","1999","55","6","953","956","10.1107/S0108270199002280","","","1.54184","CuKα","","0.022","0.022","","","","0.062","","","","","","1.048","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008545","7.898","0.002","10.188","0.003","7.064","0.002","95","0.02","92.92","0.02","105.17","0.02","544.9","0.3","293","","293","","","","","","","","","5","P -1","-P 1","2","","μ-[N,N'-bis(3-aminopropyl)-oxamidato(2-)]-N,N',O':N'',N''',O-bis[(nitrato-O) (imidazole-N^3^)copper(II)]","","- C14 H24 Cu2 N10 O8 -","- C14 H24 Cu2 N10 O8 -","- C14 H24 Cu2 N10 O8 -","1","0.5","CF1295","Zhang, Cungen; Sun, Jie; Kong, Xiangfu; Zhao, Chengxue","An oxamidato-bridged binuclear imidazole‒copper(II) complex","Acta Crystallographica Section C","1999","55","6","873","875","10.1107/S0108270199001110","","","0.7107","MoKα","","","0.027","","","","0.04","","","","","","1.65","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008546","5.2624","0.0009","8.8737","0.0014","14.518","0.003","82.455","0.015","85.847","0.018","89.393","0.012","670.3","0.2","290","1","290","1","","","","","","","","4","P 1","P 1","1","","(2S,4S,5R)-(-)-3,4-dimethyl-5-phenyl-2-(pyrrol-2-yl)-1,3- oxazolidine","","- C15 H18 N2 O -","- C15 H18 N2 O -","- C30 H36 N4 O2 -","2","2","CF1298","Gallagher, John F.; Fitzsimons, Lavelle M.","Intermolecular N—H···O and C—H···O interactions form a two-dimensional network in (2<i>S</i>,4<i>S</i>,5<i>R</i>)-(‒)-3,4-dimethyl-5-phenyl-2-(pyrrol-2-yl)-1,3-oxazolidine","Acta Crystallographica Section C","1999","55","6","1000","1003","10.1107/S0108270199002292","","","0.7107","MolybdenumKα","","0.078","0.052","","","","0.137","","","","","","1.004","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008547","7.281","0.002","16.084","0.007","12.849","0.006","90","","100.51","0.02","90","","1479.5","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichloro-bis[2-(2-hydroxymethyl)-1-methylimidazole-N^3^]zinc(II)","","- C10 H16 Cl2 N4 O2 Zn -","- C10 H16 Cl2 N4 O2 Zn -","- C40 H64 Cl8 N16 O8 Zn4 -","4","1","CF1299","Yang, Shi-Ping; Long, La-Sheng; Chen, Xiao-Ming; Ji, Liang-Nian","Dichlorobis(2-hydroxymethyl-1-methylimidazole-<i>N</i>^3^)zinc(II)","Acta Crystallographica Section C","1999","55","6","869","871","10.1107/S0108270199002309","","","0.71073","MoKα","","0.099","0.06","","","","0.166","","","","","","1.033","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008548","8.7836","0.0006","16.5431","0.0013","15.5118","0.0011","90","","93.117","0.006","90","","2250.7","0.3","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","8b,8c-dibenzoyl-4b,8b,8c,8d-tetrahydrodibenzo[a,f]cyclopropa[cd]pentalene-4b -carbaldehyde","","- C31 H20 O3 -","- C31 H20 O3 -","- C124 H80 O12 -","4","1","DA1047","Muneer, M.; Ramaiah, D.; Ajitkumar, E. S.; Sajimon, M. C.; Rath, Nigam P.; George, M. V.","Regioselectivity in dibenzobarrelene photorearrangements: photoproducts derived from 9-substituted-dibenzobarrelenes","Acta Crystallographica Section C","1999","55","6","996","1000","10.1107/S0108270199000487","","","1.54178","CuKα","","0.078","0.057","","","","0.175","","","","","","1.073","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008549","9.0656","0.0015","8.779","0.003","29.758","0.005","90","","94.672","0.013","90","","2360.5","1","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4b-acetyl-8b,8c-dibenzoyl-4b,8b,8c,8d- tetrahydrodibenzo[a,f]cyclopropa[cd]pentalene","","- C32 H22 O3 -","- C32 H22 O3 -","- C128 H88 O12 -","4","1","DA1047","Muneer, M.; Ramaiah, D.; Ajitkumar, E. S.; Sajimon, M. C.; Rath, Nigam P.; George, M. V.","Regioselectivity in dibenzobarrelene photorearrangements: photoproducts derived from 9-substituted-dibenzobarrelenes","Acta Crystallographica Section C","1999","55","6","996","1000","10.1107/S0108270199000487","","","0.71073","MoKα","","0.22","0.077","","","","0.184","","","","","","1.04","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008550","16.8684","0.0001","15.3955","0.0001","17.52","0.0002","90","","90","","90","","4549.9","0.07","223","2","223","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","8b,8c-dibenzoyl-4b-nitro-4b,8b,8c,8d- tetrahydrodibenzo[a,f]cyclopropa[cd]pentalene","","- C30 H19 N O4 -","- C30 H19 N O4 -","- C240 H152 N8 O32 -","8","1","DA1047","Muneer, M.; Ramaiah, D.; Ajitkumar, E. S.; Sajimon, M. C.; Rath, Nigam P.; George, M. V.","Regioselectivity in dibenzobarrelene photorearrangements: photoproducts derived from 9-substituted-dibenzobarrelenes","Acta Crystallographica Section C","1999","55","6","996","1000","10.1107/S0108270199000487","","","0.71073","MoKα","","0.061","0.045","","","","0.11","","","","","","1.056","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008551","16.6439","0.0006","17.9178","0.0008","8.3487","0.0003","90","","94.963","0.005","90","","2480.43","0.17","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","10c-benzoyl-6b-tert-butyl-2-phenyl-10b,10c-dihydro-6bH-dibenzo[a,f]furo[2,3,4- cd]pentalene","","- C34 H28 O2 -","- C34 H28 O2 -","- C136 H112 O8 -","4","1","DA1047","Muneer, M.; Ramaiah, D.; Ajitkumar, E. S.; Sajimon, M. C.; Rath, Nigam P.; George, M. V.","Regioselectivity in dibenzobarrelene photorearrangements: photoproducts derived from 9-substituted-dibenzobarrelenes","Acta Crystallographica Section C","1999","55","6","996","1000","10.1107/S0108270199000487","","","1.54178","CuKα","","0.05","0.042","","","","0.124","","","","","","1.062","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008552","5.925","0.002","8.321","0.001","16.126","0.003","103.41","0.01","98.85","0.02","99.51","0.02","747.3","0.3","293","2","300","","","","","","","","","4","P -1","-P 1","2","Indole","Ethyl 1-2'-Cyanoethyl-3,5-Dimethyl-2-Indolecarboxylate","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C32 H36 N4 O4 -","2","1","DA1055","T. N. Chandrakantha; Puttaraja; M. K. Kokila; N. C. Shivaprakash","Ethyl 1-(2-cyanoethyl)-3,5-dimethyl-1<i>H</i>-indole-2-carboxylate","Acta Crystallographica Section C","1999","55","6","990","992","10.1107/S0108270199001973","","","1.5418","CuKα","","0.0855","0.0636","","0.1824","0.1476","","","","1.101","1.134","1.134","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008553","8.401","0.001","10.704","0.001","9.325","0.001","90","","104.96","0.01","90","","810.12","0.15","295","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(trigonelline)-dichlorocopper(II)","","- C14 H14 Cl2 Cu N2 O4 -","- C14 H14 Cl2 Cu N2 O4 -","- C28 H28 Cl4 Cu2 N4 O8 -","2","0.5","DA1057","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Hideaki, Matsushima; Tokii, Tadashi","A monomeric and a dimeric copper(II) trigonelline adduct with chloride, and a dimeric copper(II) 1-methyl-2-pyrrolecarboxylate adduct with 3-methylpyridine","Acta Crystallographica Section C","1999","55","6","882","886","10.1107/S0108270199001985","","","0.71073","MoKα","","","0.044","","","0.045","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008554","10.156","0.002","13.883","0.002","7.793","0.001","99.4","0.01","109.29","0.01","75.57","0.01","1000.4","0.3","299","","","","","","","","","","","6","P -1","-P 1","2","","Tetrakis(μ-trigonelline-O,O')-dichlorocopper(II) dichloride octahydrate","","- C28 H44 Cl4 Cu2 N4 O16 -","- C28 H44 Cl4 Cu2 N4 O16 -","- C28 H44 Cl4 Cu2 N4 O16 -","1","0.5","DA1057","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Hideaki, Matsushima; Tokii, Tadashi","A monomeric and a dimeric copper(II) trigonelline adduct with chloride, and a dimeric copper(II) 1-methyl-2-pyrrolecarboxylate adduct with 3-methylpyridine","Acta Crystallographica Section C","1999","55","6","882","886","10.1107/S0108270199001985","","","0.71073","MoKα","","","0.043","","","0.043","","","","","1.48","1.48","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008555","10.431","0.002","17.795","0.003","10.685","0.002","90","","114.4","0.01","90","","1806.2","0.6","299","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Tetrakis(μ-1-methylpyrrole-2-carboxylato-O,O')-dipyridinecopper(II)","","- C36 H38 Cu2 N6 O8 -","- C36 H38 Cu2 N6 O8 -","- C72 H76 Cu4 N12 O16 -","2","0.5","DA1057","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Hideaki, Matsushima; Tokii, Tadashi","A monomeric and a dimeric copper(II) trigonelline adduct with chloride, and a dimeric copper(II) 1-methyl-2-pyrrolecarboxylate adduct with 3-methylpyridine","Acta Crystallographica Section C","1999","55","6","882","886","10.1107/S0108270199001985","","","0.71073","MoKα","","","0.052","","","0.043","","","","","1.26","1.26","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008556","9.849","0.002","10.8","0.002","25.682","0.003","90","0.01","90","0.01","90","0.01","2731.8","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2^'^,3^'^,5^'^-Tri-O-Benzoylinosine","","- C31 H24 N4 O8 -","- C31 H24 N4 O8 -","- C124 H96 N16 O32 -","4","1","DE1094","S.Kolappan; T. Parthasarathy Seshadri","2',3',5'-Tri-<i>O</i>-benzoylinosine","Acta Crystallographica Section C","1999","55","6","986","987","10.1107/S0108270198014668","","","1.5418","CuKα","","0.0456","0.0327","","","","0.1167","","","","","","0.691","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008557","9.296","0.002","10.524","0.003","11.044","0.003","113.89","0.02","100.15","0.02","109.75","0.02","866.1","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-acetyl-5-(2-chlorophenyl)-3-(2-chlorostyryl)-2-pyrazoline","","- C19 H16 Cl2 N2 O -","- C19 H16 Cl2 N2 O -","- C38 H32 Cl4 N4 O2 -","2","1","DE1102","R. V. Krishnakumar; S. Natarajan; V. Vijayabaskar; S. Perumal; S. Selvaraj","1-Acetyl-5-(4-methoxyphenyl)-3-(4-methoxystyryl)-2-pyrazoline and 1-acetyl-5-(2-chlorophenyl)-3-(2-chlorostyryl)-2-pyrazoline","Acta Crystallographica Section C","1999","55","6","987","990","10.1107/S0108270199000712","","","0.71073","MoKα","","0.101","0.067","","","","0.15","","","","","","1.232","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008558","5.72","0.001","12.085","0.004","26.654","0.004","90","","91.78","0.02","90","","1841.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-acetyl-5-(4-methoxyphenyl)-3-(4-methoxystyryl)-2-pyrazoline","","- C21 H22 N2 O3 -","- C21 H22 N2 O3 -","- C84 H88 N8 O12 -","4","1","DE1102","R. V. Krishnakumar; S. Natarajan; V. Vijayabaskar; S. Perumal; S. Selvaraj","1-Acetyl-5-(4-methoxyphenyl)-3-(4-methoxystyryl)-2-pyrazoline and 1-acetyl-5-(2-chlorophenyl)-3-(2-chlorostyryl)-2-pyrazoline","Acta Crystallographica Section C","1999","55","6","987","990","10.1107/S0108270199000712","","","1.5418","CuKα","","0.049","0.043","","","","0.127","","","","","","1.138","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008559","4.586","0.002","12.843","0.004","9.767","0.001","90","","133.98","0.02","90","","413.9","0.3","296.2","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C2 H4 N4 -","- C2 H4 N4 -","- C8 H16 N16 -","4","1","DE1103","Ohno, Yoshio; Akutsu, Yoshiaki; Arai, Mitsuru; Tamura, Masamitsu; Takehiro Matsunaga","5-Methyl-1<i>H</i>-tetrazole","Acta Crystallographica Section C","1999","55","6","1014","1016","10.1107/S0108270199002437","","","0.7107","MoKα","","","0.04","","","","0.052","","","","","","1.859","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008560","6.069","0.007","7.829","0.002","13.455","0.003","90","","91.76","0.03","90","","639","0.8","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethylene bis(dimethyldithiocarbamate)","","- C8 H16 N2 S4 -","- C8 H16 N2 S4 -","- C16 H32 N4 S8 -","2","0.5","FG1520","Jian Fangfang; Zhu Dunru; Fun Hoong-Kun; Kandasamy Chinnakali; Ibrahim Abdul Razak; You Xiaozeng","Ethylene bis(dimethyldithiocarbamate) and butane-1,4-diyl bis(dimethyldithiocarbamate)","Acta Crystallographica Section C","1999","55","6","940","942","10.1107/S0108270198016370","","","0.71073","MoKα","","0.0687","0.041","","","","0.0954","","","","","","1.043","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008561","7.4875","0.0001","7.4424","0.0002","13.7568","0.0003","90","","97.536","0.001","90","","759.98","0.03","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Butylene bis(dimethyldithiocarbamate)","","- C10 H20 N2 S4 -","- C10 H20 N2 S4 -","- C20 H40 N4 S8 -","2","0.5","FG1520","Jian Fangfang; Zhu Dunru; Fun Hoong-Kun; Kandasamy Chinnakali; Ibrahim Abdul Razak; You Xiaozeng","Ethylene bis(dimethyldithiocarbamate) and butane-1,4-diyl bis(dimethyldithiocarbamate)","Acta Crystallographica Section C","1999","55","6","940","942","10.1107/S0108270198016370","","","0.71073","MoKα","","0.0309","0.0268","","","","0.0754","","","","","","1.103","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008562","6.2578","0.0005","16.352","0.001","14.819","0.001","90","","91.255","0.001","90","","1516.03","0.18","296","1","296","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H24 Co N2 O14 P2 -","- C2 H22 Co N2 O14 P2 -","- C8 H88 Co4 N8 O56 P8 -","4","1","FR1152","Yongkui Shan; Songping D. Huang","(C~2~H~10~N~2~)[Co(H~2~O)~6~](HPO~4~)~2~: a supramolecular three-dimensional hydrogen-bonding network","Acta Crystallographica Section C","1999","55","6","921","923","10.1107/S0108270199001584","","","0.7107","MoKα","","0.061","0.034","","0.051","","0.044","","","1.024","","","1.09","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008563","8.9034","0.0012","10.0168","0.0011","16.709","0.0012","73.579","0.002","74.837","0.003","65.376","0.002","1281.6","0.2","295","","","","","","","","","","","7","P -1","-P 1","2","","","","- C23 H23 Cu I2 N3 O2 Zn -","- C24 H21 Cu I2 N3 O2 Zn -","- C48 H42 Cu2 I4 N6 O4 Zn2 -","2","1","FR1157","Ercan, Filiz; Arıcı, Cengiz; Akay, Abdülkadir; Atakol, Orhan; Ülkü, Dinc̨er","{[μ-Bis(salicylidene)-1,3-propanediaminato]-(3-methylpyridine)copper(II)}diiodozinc(II)","Acta Crystallographica Section C","1999","55","6","925","928","10.1107/S0108270199003273","","","0.71073","MoKα","","","0.032","","","0.039","","","","","0.92","0.92","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008564","8.2202","0.0003","18.2074","0.0006","11.9429","0.0004","90","","93.079","0.001","90","","1784.9","0.11","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aminoguanidinium (N,N'-ethylenediaminetetraacetato)antimonate(III) hydrate","","- C11 H21 N6 O9 Sb -","- C11 H21 N6 O9 Sb -","- C44 H84 N24 O36 Sb4 -","4","1","FR1177","Hoong-Kun Fun; S. Shanmuga Sundara Raj; Abdul Razak, Ibrahim; Ilyukhin, Andrey B.; Davidovich, Ruven L.; Huang, Jing-Wei; Hu, Sheng-Zhi; Ng, Seik Weng","Aminoguanidinium (ethylenediamine-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetraacetato)antimonate(III) monohydrate","Acta Crystallographica Section C","1999","55","6","905","907","10.1107/S0108270199002310","","","0.71073","MoKα","","0.026","0.021","","","","0.051","","","","","","1.087","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008565","6.8822","0.0008","8.9557","0.001","11.0364","0.0012","98.765","0.002","92.365","0.002","98.66","0.002","663.18","0.13","293","","","","","","","","","","","5","P -1","-P 1","2","","4-Methoxybenzaldehyde-(pentafluorophenylmethylidene)hydrazone","","- C15 H9 F5 N2 O -","- C15 H9 F5 N2 O -","- C30 H18 F10 N4 O2 -","2","1","FR1178","Lewis, Michael; Barnes, Charles L.; Hathaway, Bruce A.; Glaser, Rainer","4-Methoxybenzaldehyde pentafluorophenylmethylidenehydrazone","Acta Crystallographica Section C","1999","55","6","975","978","10.1107/S0108270199002541","","","0.7093","MolybdenumKα","","","0.058","","","","0.075","","","","","","1.19","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008566","11.1445","0.0007","11.7843","0.0007","14.0877","0.0009","90","","95.819","0.001","90","","1840.6","0.2","198","2","198","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H19 N2 P -","- C23 H19 N2 P -","- C92 H76 N8 P4 -","4","1","","Filippo Minutolo; Scott R. Wilson; John A. Katzenellenbogen","Crystallographic evidence for the electronic distribution in (2,4-cyclopentadien-1-ylidenehydrazono)triphenylphosphorane","Acta Crystallographica Section C","1999","55","6","1016","1016","","","","","","","","0.033","","","0.0651","","","","","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008567","8.438","0.002","27.496","0.001","4.894","0.001","90","","117.38","0.02","90","","1008.3","0.4","296","","296","","","","","","","","","4","C 1 c 1","C -2yc","9","quinolinium-4-carboxylate dihydrate","","","- C10 H11 N O4 -","- C10 H11 N O4 -","- C40 H44 N4 O16 -","4","1","FR1183","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding in quinolinium-4-carboxylate dihydrate","Acta Crystallographica Section C","1999","55","6","935","937","10.1107/S0108270199002565","","","0.71073","MoKα","","","0.032","","","0.055","","","","","1.85","1.85","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008568","7.714","0.002","17.848","0.002","6.91","0.002","90","","107.34","0.02","90","","908.1","0.4","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","naphthalene-1,2-dicarboxylic anhydride","","","- C12 H6 O3 -","- C12 H6 O3 -","- C48 H24 O12 -","4","1","FR1187","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Network of C—H···O interactions in 1,2-naphthalenedicarboxylic anhydride","Acta Crystallographica Section C","1999","55","6","937","940","10.1107/S0108270199002577","","","0.71073","MoKα","","","0.045","","","","0.052","","","","","","1.62","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008569","7.937","0.003","37.789","0.004","9.696","0.003","90","","90","","90","","2908.1","1.5","296","","296","","","","","","","","","4","P b c a","-P 2ac 2ab","61","dipotassium naphthalene-1,8-dicarboxylate.potassium bicarbonate","","","- C13 H7 K3 O7 -","- C13 H7 K3 O7 -","- C104 H56 K24 O56 -","8","1","FR1190","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Dipotassium naphthalene-1,8-dicarboxylate‒potassium bicarbonate","Acta Crystallographica Section C","1999","55","6","918","921","10.1107/S0108270199002966","","","0.71073","MoKα","","","0.044","","","","0.074","","","","","","1.35","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008570","8.8712","0.0018","10.2642","0.0012","14.4412","0.0009","98.78","0.005","92.483","0.009","104.804","0.014","1251.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","aquachloro(1-ethyl-1,4-dihydro-4-oxo-1,3-dioxolo[4,5-g]cinnoline-3-carboxylato- O^3^,O^4^)(1-ethyl-1,4-dihydro-4-oxo-1,3-dioxolo[4,5-g]cinnoline-3-carboxylic acid-O^3^,O^4^)copper(II)","","- C24 H21 Cl Cu N4 O11 -","- C24 H21 Cl Cu N4 O11 -","- C48 H42 Cl2 Cu2 N8 O22 -","2","1","GD1017","Ruíz, Monica; Ortiz, Rosa; Perelló, Lourdes; Alfonso Castiñeiras","[CuCl(C~12~H~9~N~2~O~5~)(C~12~H~10~N~2~O~5~)(H~2~O)]","Acta Crystallographica Section C","1999","55","6","878","880","10.1107/S0108270199001122","","","1.54184","CuKα","","0.057","0.041","","","","0.12","","","","","","1.08","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008571","12.694","0.005","16.353","0.005","11.122","0.003","90","","90","","90","","2308.8","1.3","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rubidium molybdyl arsenate","","- As Mo O6 Rb -","- As Mo O6 Rb -","- As16 Mo16 O96 Rb16 -","16","0.5","GS1008","Zid, Mohamed Faouzi; Jouini, Tahar","RbMoO~2~AsO~4~","Acta Crystallographica Section C","1999","55","6","843","845","10.1107/S0108270198016102","","","0.71069","MoKα","","0.0335","0.024","","0.0674","0.0553","","","","1.173","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008572","5.763","0.001","10.153","0.002","12.022","0.002","83.37","0.01","86.46","0.01","78.83","0.01","684.9","0.2","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H18 O S -","- C16 H18 O S -","- C32 H36 O2 S2 -","2","1","GS1033","Zukerman-Schpector, J.; Gruber, Jonas; Camilo, Fernanda Ferraz","Two new 2,3-substituted 5-norbornenes","Acta Crystallographica Section C","1999","55","6","980","983","10.1107/S010827019900236X","","","0.71073","MoKα","","0.103","0.042","","","","0.115","","","","","","1.019","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008573","9.763","0.001","12.097","0.002","12.164","0.001","90","","107.292","0.008","90","","1371.7","0.3","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 N O3 S -","- C15 H15 N O3 S -","- C60 H60 N4 O12 S4 -","4","1","GS1033","Zukerman-Schpector, J.; Gruber, Jonas; Camilo, Fernanda Ferraz","Two new 2,3-substituted 5-norbornenes","Acta Crystallographica Section C","1999","55","6","980","983","10.1107/S010827019900236X","","","0.71073","MoKα","","0.15","0.05","","","","0.165","","","","","","1.039","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008574","7.7541","0.0013","14.4655","0.0019","31.108","0.005","90","","90","","90","","3489.3","0.9","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","(2S,3S)-2-[2-(benzyloxy)ethyl]-3-(6-chloro-9H-purin-9-yl)oxolane","","- C18 H19 Cl N4 O2 -","- C18 H19 Cl N4 O2 -","- C144 H152 Cl8 N32 O16 -","8","1","GS1035","George Balayiannis; Ioannis Argiris; Dionissios Papaioannou; Constantin Kavounis","(2<i>S</i>,3<i>S</i>)- and (2<i>R</i>,3<i>S</i>)-2-[2-(benzyloxy)ethyl]-3-(6-chloro-9<i>H</i>-purin-9-yl)oxolane","Acta Crystallographica Section C","1999","55","6","1005","1008","10.1107/S0108270199002784","","","0.71069","MoKα","","0.073","0.044","","","","0.127","","","","","","1.018","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008575","7.5238","0.0005","10.9972","0.0008","20.9169","0.0019","90","","90","","90","","1730.7","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2R,3S)-2-[2-(benzyloxy)ethyl]-3-(6-chloro-9H-purin-9-yl)oxolane","","- C18 H19 Cl N4 O2 -","- C18 H19 Cl N4 O2 -","- C72 H76 Cl4 N16 O8 -","4","1","GS1035","George Balayiannis; Ioannis Argiris; Dionissios Papaioannou; Constantin Kavounis","(2<i>S</i>,3<i>S</i>)- and (2<i>R</i>,3<i>S</i>)-2-[2-(benzyloxy)ethyl]-3-(6-chloro-9<i>H</i>-purin-9-yl)oxolane","Acta Crystallographica Section C","1999","55","6","1005","1008","10.1107/S0108270199002784","","","0.71069","MoKα","","0.105","0.053","","","","0.137","","","","","","1.027","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008576","10.045","0.003","14.347","0.005","15.606","0.006","99.24","0.02","100.22","0.02","108.76","0.02","2037.8","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(3,3'-dimethylene-2,2'-biquinoline)bromotricarbonylrhenium(I)","","- C23 H14 Br N2 O3 Re -","- C23 H14 Br N2 O3 Re -","- C92 H56 Br4 N8 O12 Re4 -","4","2","HA1240","Juan Guerrero; Sergio A. Moya; María Teresa Garland; Ricardo F. Baggio","Bromotricarbonyl(3,3'-dimethylene-2,2'-biquinoline)rhenium(I)","Acta Crystallographica Section C","1999","55","6","932","934","10.1107/S0108270198017181","","","0.71073","MoKα","","0.059","0.036","","","","0.077","","","","","","1.064","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008577","6.88","0.0008","13.8033","0.0009","29.389","0.002","90","0.01","90","0.01","90","0.01","2791","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Olean-12-en[2,3-d]isoxazole-28-oic acid methyl ester","","- C32 H47 N O3 -","- C32 H47 N O3 -","- C128 H188 N4 O12 -","4","1","JZ1306","Gzella, Andrzej; Linkowska, Ewa; Zaprutko, Lucjusz; Wrzeciono, Urszula","Triterpenoide. XIV. [2,3-<i>d</i>]Isoxazoltriterpenderivate","Acta Crystallographica Section C","1999","55","6","1031","1034","10.1107/S010827019900013X","","","1.54178","CuKα","","0.0398","0.0353","","0.1034","0.0994","","","","1.035","1.036","1.036","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008578","6.5284","0.001","30.614","0.002","13.5481","0.001","90","0.01","101.31","0.01","90","0.01","2655.1","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","19β,28-Epoxy-18Hα-oleanan[2,3-d]isoxazole","","- C31 H47 N O2 -","- C31 H47 N O2 -","- C124 H188 N4 O8 -","4","2","JZ1306","Gzella, Andrzej; Linkowska, Ewa; Zaprutko, Lucjusz; Wrzeciono, Urszula","Triterpenoide. XIV. [2,3-<i>d</i>]Isoxazoltriterpenderivate","Acta Crystallographica Section C","1999","55","6","1031","1034","10.1107/S010827019900013X","","","1.54178","CuKα","","0.0481","0.0361","","0.1045","0.0997","","","","1.003","1.023","1.023","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008579","6.425","0.001","7.895","0.001","21.883","0.002","90","","95.5","0.01","90","","1104.9","0.2","293","2","","","","","","","","","","5","P 1 21 1","P 2yb","4","","(1R,2R,3S,4S,5S,6S)-exo-3-[(S)-1,2-dibenzyloxyethyl]-exo-2-cyano-endo-6- hydroxy-exo-5-iodobicyclo[2.2.1]heptane-endo-2-carboxylic Acid Lactone.","","- C25 H24 I N O4 -","- C25 H24 I N O4 -","- C50 H48 I2 N2 O8 -","2","1","JZ1323","Alías, Miriam; Buñuel, Elena; Cativiela, Carlos; Díaz-de-Villegas, María D.; Gálvez, José A.","(1<i>R</i>,2<i>R</i>,3<i>S</i>,4<i>S</i>,5<i>S</i>,6<i>S</i>)-<i>exo</i>-2-Cyano-<i>exo</i>-3-[(<i>S</i>)-1,2-dibenzyloxyethyl]-<i>exo</i>-5-iodobicyclo[2.2.1]heptane-<i>endo</i>-2,6-carbolactone","Acta Crystallographica Section C","1999","55","6","1009","1012","10.1107/S010827019900222X","","","0.71073","MoKα","","","0.0384","","","","0.0969","","","","","","1.017","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008580","10.503","0.001","13.889","0.002","10.678","0.001","90","","90.68","0.02","90","","1557.6","0.3","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cyclo-tri-μ-methoxo-tris(dichloroaluminium)","","- C3 H9 Al3 Cl6 O3 -","- C3 H9 Al3 Cl6 O3 -","- C12 H36 Al12 Cl24 O12 -","4","1","KA1308","Gelbrich, Thomas","A trimeric aluminium alkoxide: methoxyaluminium dichloride","Acta Crystallographica Section C","1999","55","6","856","858","10.1107/S0108270199000505","","","0.71073","MoKα","","0.066","0.034","","","","0.099","","","","","","1.019","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008581","15.21","0.002","5.539","0.0006","17.192","0.002","90","","134.45","0.01","90","","1034","0.3","291","","291","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,3,5,6-tetraphenylpyrazine (α form)","","- C28 H20 N2 -","- C28 H20 N2 -","- C56 H40 N4 -","2","0.5","LN1076","Bartnik, Romuald; Faure, René; Gebicki, Krzysztof","Dimorphism of 2,3,5,6-tetraphenylpyrazine","Acta Crystallographica Section C","1999","55","6","1034","1037","10.1107/S0108270199002450","","","1.54056","CuKα","","","0.06","","","0.137","","","","","","","1.9","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008582","18.654","0.003","23.509","0.002","9.576","0.001","90","","92.18","0.01","90","","4196.4","0.9","291","","291","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,3,5,6-tetraphenylpyrazine (β form)","","- C28 H20 N2 -","- C28 H20 N2 -","- C224 H160 N16 -","8","1","LN1076","Bartnik, Romuald; Faure, René; Gebicki, Krzysztof","Dimorphism of 2,3,5,6-tetraphenylpyrazine","Acta Crystallographica Section C","1999","55","6","1034","1037","10.1107/S0108270199002450","","","1.54056","CuKα","","","0.057","","","0.077","","","","","","","1.24","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008583","7.904","0.005","8.899","0.006","9.335","0.007","108.26","0.04","112.63","0.03","91.41","0.03","567.6","0.7","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","catena-poly[[bis[μ-(2,6-dimethylpiperidinido)-N:N]dilithium]-μ-(N,N,N',N'- tetramethylethylenediamine-N:N')]","","- C20 H44 Li2 N4 -","- C20 H44 Li2 N4 -","- C20 H44 Li2 N4 -","1","0.5","LN1078","Clegg, William; Horsburgh, Lynne; Couper, Scott A.; Mulvey, Robert E.","<i>catena</i>-Poly[[bis(μ-2,6-dimethylpiperidinido-<i>N</i>:<i>N</i>)dilithium]-μ-(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-<i>N</i>:<i>N</i>')]","Acta Crystallographica Section C","1999","55","6","867","869","10.1107/S0108270199001171","","","0.71073","MoKα","","0.05","0.038","","","","0.109","","","","","","1.027","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008584","9.733","0.003","17.579","0.004","13.016","0.003","90","","97.12","0.02","90","","2209.8","1","160","2","160","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H32 Mo N2 -","- C22 H32 Mo N2 -","- C88 H128 Mo4 N8 -","4","1","LN1081","Clegg, William; Elsegood, Mark R. J.; Dyer, Philip W.; Gibson, Vernon C.; Marshall, Edward L.","Dibenzylbis(<i>tert</i>-butylimido)molybdenum(VI), containing both η^1^- and η^2^-benzyl ligands","Acta Crystallographica Section C","1999","55","6","916","918","10.1107/S0108270199003510","","","0.71073","MoKα","","0.02","0.018","","","","0.051","","","","","","1.086","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008585","9.003","0.005","12.699","0.003","20.522","0.008","90","","90","","90","","2346.3","1.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","melaniline","N,N' diphenyl guanidine","","- C13 H13 N3 -","- C13 H13 N3 -","- C104 H104 N24 -","8","2","NA1391","Paixão, J. A.; Matos Beja, A.; Pereira Silva, P. S.; Ramos Silva, M.; Alte da Veiga, L.","A new orthorhombic phase of <i>N</i>,<i>N</i>'-diphenylguanidine","Acta Crystallographica Section C","1999","55","6","1037","1040","10.1107/S0108270199002462","","","0.71073","MoKα","","0.0628","0.0364","","","","0.1094","","","","","","1.03","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008586","15.67","0.004","10.556","0.002","12.258","0.004","90","","96.1","0.01","90","","2016.1","0.9","150","1","150","1","","","","","","","","5","P 1 21 1","P 2yb","4","","1-(2R,3R)-5-(N-benzyl-N-methylamino)-2-[N-(4-methoxyphenyl)carbamoyl]-4-nitro-2-phenyl-2,3-dihydro-3-thienyl]-1,2,3,4,5-penta-O-acetyl-D-manno-pentitol","","- C41 H45 N3 O14 S -","- C41 H45 N3 O14 S -","- C82 H90 N6 O28 S2 -","2","1","NA1392","María Jesús Diánez; María Dolores Estrada; Amparo López-Castro; Simeón Pérez-Garrido","Study of a diastereoisomeric dihydrothiophene derivative at 150K","Acta Crystallographica Section C","1999","55","6","1020","1023","10.1107/S010827019900102X","","","0.71073","MoKα","","0.047","0.042","","0.124","0.119","","","","1.047","1.054","1.054","","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2008587","7.32","0.004","20.15","0.005","10.448","0.003","90","","103.33","0.04","90","","1499.5","1","299","3","299","3","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Disodium hexaaquacobalt(II) dihydrogen 1,2,4,5-benzenetetracarboxylate(2-) tetrahydrate","","- C20 H28 Co Na2 O26 -","- C20 H28 Co Na2 O26 -","- C40 H56 Co2 Na4 O52 -","2","0.25","NA1397","Karanović, Ljiljana; Poleti, Dejan; Bogdanović, Goran A.; Spasojević-de Biré, Anne","Disodium hexaaquacobalt(II) bis[dihydrogen 1,2,4,5-benzenetetracarboxylate(2 ‒)] tetrahydrate","Acta Crystallographica Section C","1999","55","6","911","913","10.1107/S0108270199002498","","","0.71069","MoKα","","0.057","0.045","","0.1207","","0.1159","","","0.945","","","0.987","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008588","5.4931","0.0001","22.2521","0.0003","11.035","0.0002","90","","104.23","0.001","90","","1307.45","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-hydroxy-8-iodo-4-methyl-7,8,9,10-tetrahydro-7,8-benzocoumarin","","- C14 H13 I O3 -","- C14 H13 I O3 -","- C56 H52 I4 O12 -","4","1","NA1400","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan","9-Hydroxy-8-iodo-4-methyl-7,8,9,10-tetrahydrobenzo[<i>h</i>]coumarin","Acta Crystallographica Section C","1999","55","6","946","948","10.1107/S0108270199002036","","","0.71073","MoKα","","0.06","0.053","","","","0.151","","","","","","1.208","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008589","13.6977","0.0005","19.8307","0.0008","12.7594","0.0008","90","","90","","90","","3465.9","0.3","296.2","","296.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(1S,3R)-Carpropamide","","","- C15 H18 Cl3 N O -","- C15 H18 Cl3 N O -","- C120 H144 Cl24 N8 O8 -","8","2","NA1401","Koketsu, Mamoru; Kagabu, Shinzo; Matsuoka, Masashi","Absolute configuration of the active stereoisomer of new rice fungicide Carpropamid","Acta Crystallographica Section C","1999","55","6","1025","1027","10.1107/S0108270199002504","","","0.7107","MoKα","","0.0952","0.0552","","","","0.0671","","","","","","1.484","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008590","7.3993","0.0002","8.9006","0.0002","11.7469","0.0003","101.651","0.001","100.54","0.001","93.448","0.001","741.11","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Chloro(di-2-pyridylamine-N,N')(propionato-O,O')copper(II) Monohydrate","","- C13 H16 Cl Cu N3 O3 -","- C13 H16 Cl Cu N3 O3 -","- C26 H32 Cl2 Cu2 N6 O6 -","2","1","NA1404","Sujittra Youngme; Kandasamy Chinnakali; Suchada Chantrapromma; Hoong-Kun Fun","Chloro(di-2-pyridyl-κ<i>N</i>-amine)(propionato-κ^2^<i>O</i>,<i>O</i>')copper(II) monohydrate","Acta Crystallographica Section C","1999","55","6","899","901","10.1107/S0108270199002048","","","0.71073","MoKα","","0.037","0.031","","","","0.087","","","","","","1.045","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008591","13.088","0.001","8.765","0.001","18.717","0.001","90","","97.77","0.01","90","","2127.4","0.3","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H72 N12 P4 -","- C34 H72 N12 P4 -","- C68 H144 N24 P8 -","2","0.5","NA1406","Hökelek, Tuncer; Kılıç, Emine; Kılıç, Zeynel","<i>trans</i>-2,6-Bis(ethylamino)-2,4,4,6,8,8-hexapiperidinocyclo-2λ^5^,4λ^5^,6λ^5^,8λ^5^-tetraphosphazatetraene","Acta Crystallographica Section C","1999","55","6","983","985","10.1107/S0108270199002474","","","0.71073","MoKα","","","0.037","","","","0.053","","","","","","1.2","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008592","15.578","0.001","22.428","0.001","19.406","0.001","90","","108.83","0.01","90","","6417.3","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(2'-formylphenyl)-1,4-dioxabutane S-methylbenzyl dithiocarbazate Cobalt(II)","","- C32 H28 Co N4 O2 S4 -","- C32 H28 Co N4 O2 S4 -","- C256 H224 Co8 N32 O16 S32 -","8","1","NA1408","Hoong-Kun Fun; S. Shanmuga Sundara Raj; Xu-Hui Zhu; Xiao-Feng Chen; Jing-Lin Zuo; Xiao-Zeng You","A neutral cobalt(II) complex of a Schiff base ligand containing mixed O~2~S~2~N~2~ donors","Acta Crystallographica Section C","1999","55","6","896","899","10.1107/S0108270199001602","","","0.71073","MoKα","","0.133","0.059","","0.109","","0.087","","","1.036","","","1.145","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008593","7.3875","0.0002","12.4718","0.0003","14.8382","0.0004","90","","96.727","0.001","90","","1357.71","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","p-Methoxybenzaldehyde Isonicotinoyl Hydrazone Monohydrate","","- C14 H15 N3 O3 -","- C14 H15 N3 O3 -","- C56 H60 N12 O12 -","4","1","NA1409","S.Shanmuga Sundara Raj; Hoong-Kun Fun; Zhong-Lin Lu; Wen Xiao; Ye-Xiang Tong; Bei-Sheng Kang","<i>p</i>-Methoxybenzaldehyde isonicotinoylhydrazone monohydrate","Acta Crystallographica Section C","1999","55","6","942","944","10.1107/S0108270199002486","","","0.71073","MoKα","","0.0722","0.0485","","","","0.1413","","","","","","1.056","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008594","18.46","0.004","6.552","0.0005","32.603","0.007","90","","103.34","0.01","90","","3836.9","1.2","208","2","208","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","tetraphenylphosphonium tetra(1-methyl-1,2,3,4-tetrazol-5-thiolato)aurate(III)","","- C32 H33 Au N16 O0.5 P S4 -","- C32 H33 Au N16 O0.5 P S4 -","- C128 H132 Au4 N64 O2 P4 S16 -","4","0.5","NA1415","Schulz Lang, Ernesto; Dahmer, Marisa; Abram, Ulrich","Tetraphenylphosphonium tetrakis(1-methyl-1,2,3,4-tetrazole-5-thiolato-<i>S</i>)aurate(III) hemihydrate","Acta Crystallographica Section C","1999","55","6","854","856","10.1107/S0108270199004357","","","0.71073","MoKα","","0.043","0.024","","","","0.06","","","","","","1.056","","","","has coordinates,has Fobs","188927","2020-10-21","18:00:00",""
"2008595","7.208","0.002","6.291","0.004","14.432","0.005","90","","104.04","0.02","90","","634.9","0.5","293","","","","","","","","","","","4","P 1 c 1","P -2yc","7","","3-(2'-hydroxyphenylamino)-5,5-dimethyl-2-cyclohexenone","","- C14 H17 N O2 -","- C14 H17 N O2 -","- C28 H34 N2 O4 -","2","1","NA1416","Héctor Novoa de Armas; Norbert M. Blaton; Oswald M. Peeters; Camiel J. De Ranter; Margarita Suárez Navarro; Yamila Verdecia Reyes; Estael Ochoa Rodríguez; Esperanza Salfrán Solano","3-(2-Hydroxyphenylamino)-5,5-dimethylcyclohex-2-enone","Acta Crystallographica Section C","1999","55","6","1029","1031","10.1107/S0108270199004369","","","1.54184","CuKα","","0.044","0.043","","0.133","","0.133","","","1.139","","","1.139","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008596","24.0723","0.0005","6.6483","0.0001","5.3569","0.0001","90","","90","","90","","857.32","0.03","296","2","296","2","","","","","","","","2","P n a 21","P 2c -2n","33","","","","- Mo4 O11 -","- Mo4 O11 -","- Mo16 O44 -","4","1","OA1071","Hoong-Kun Fun; Ping Yang; Minoru Sasaki; Masasi Inoue; Hideoki Kadomatsu","γ-Mo~4~O~11~","Acta Crystallographica Section C","1999","55","6","841","843","10.1107/S0108270199000165","","","0.71073","MoKα","","0.039","0.038","","0.093","0.092","","","","1.293","1.292","1.292","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008597","7.712","0.005","9.617","0.005","16.155","0.003","90","","101.88","0.03","90","","1172.5","1","173.2","","173.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-t-butyl-3-(N,N-dimethylcarbamoyl)pyridine","","- C12 H18 N2 O -","- C12 H18 N2 O -","- C48 H72 N8 O4 -","4","1","OA1072","Yuji Mikata; Ryoko Maesaki","Unexpectedly produced 2-<i>tert</i>-butyl-5-(<i>N</i>,<i>N</i>-dimethylcarbamoyl)pyridine from 2-chloro-3-(<i>N</i>,<i>N</i>-dimethylcarbamoyl)pyridine with a <i>tert</i>-butyl Grignard reagent","Acta Crystallographica Section C","1999","55","6","973","975","10.1107/S0108270198013079","","","0.7107","MoKα","","0.0586","0.0512","","0.0907","0.0847","","","","1.419","1.42","1.42","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008598","6.8422","0.0008","12.4","0.001","12.609","0.001","90","","94.825","0.008","90","","1066","0.17","130","0.1","130","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-allyl-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane","","- C9 H17 N O3 Si -","- C9 H17 N O3 Si -","- C36 H68 N4 O12 Si4 -","4","1","OA1074","White, Jonathan M.; Jones, Scott","Low-temperature structure of allyl silatrane","Acta Crystallographica Section C","1999","55","6","962","963","10.1107/S0108270199002371","","","0.71069","MoKα","","0.03","0.028","","","","0.074","","","","","","1.059","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008599","9.6615","0.001","9.7829","0.001","18.4857","0.001","101.784","0.01","96.993","0.01","115.568","0.01","1498.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Dichloro[ferrocene-1,1'-diylbis(diphenylphosphine-P)]cobalt(II)","","- C34 H28 Cl2 Co Fe P2 -","- C34 H28 Cl2 Co Fe P2 -","- C68 H56 Cl4 Co2 Fe2 P4 -","2","1","OB1001","Park, Tae-Jin; Huh, Seong; Kim, Youngmee; Jun, Moo-Jin","Dichloro[ferrocene-1,1'-diylbis(diphenylphosphine-<i>P</i>)]cobalt(II)","Acta Crystallographica Section C","1999","55","6","848","850","10.1107/S0108270199001183","","","0.71073","MoKα","","0.078","0.036","","","","0.095","","","","","","1.034","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008600","9.641","0.004","10.251","0.004","13.893","0.005","90","","101","0.03","90","","1347.8","0.9","150","","150","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H32 N2 O7 -","- C26 H32 N2 O7 -","- C52 H64 N4 O14 -","2","1","OB1005","Kazuhiro Yamato; Hiroyuki Miyake; Ken Hirotsu; Yoshitane Kojima","<i>N</i>-<i>tert</i>-Butoxycarbonyl-<i>N</i>,<i>N</i>'-ethylene-bridged (<i>S</i>)-tyrosyl-(<i>S</i>)-tyrosine methyl ester","Acta Crystallographica Section C","1999","55","6","1023","1025","10.1107/S0108270199002449","","","0.7107","MoKα","","","0.039","","","0.042","","","","","1.962","1.962","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008601","9.713","0.002","12.079","0.003","7.716","0.002","93.11","0.02","106.85","0.02","81.92","0.02","857.7","0.4","224.4","","","","","","","","","","","5","P -1","-P 1","2","","Bis(2-methyl-8-quinolinolate)tin(II)","","- C20 H16 N2 O2 Sn -","- C20 H16 N2 O2 Sn -","- C40 H32 N4 O4 Sn2 -","2","1","OB1007","Kitamura, Chitoshi; Yoneda, Akio; Sugiura, Ken-ichi; Sakata, Yoshiteru","Bis(2-methyl-8-quinolinolato-<i>N</i>,<i>O</i>)tin(II)","Acta Crystallographica Section C","1999","55","6","876","878","10.1107/S0108270199002887","","","0.7107","MoKα","","0.034","0.031","","0.089","","0.089","","","1.551","","","1.551","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008602","11.6141","0.0015","15.9238","0.0014","15.115","0.002","90","","100.31","0.01","90","","2750.2","0.6","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H38 B9 P -","- C25 H38 B9 P -","- C100 H152 B36 P4 -","4","1","OS1036","Sillanpää, Reijo; Pedrajas, Josefina; Viñas, Clara; Teixidor, Frances; Kivekäs, Raikko","(PMePh~3~)(7,8-Et~2~-7,8-<i>nido</i>-C~2~B~9~H~10~)","Acta Crystallographica Section C","1999","55","6","1008","1009","10.1107/S0108270199002516","","","0.71069","MoKα","","0.1762","0.0657","","","","0.1491","","","","","","1.006","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008603","9.3229","0.0003","9.2536","0.0001","14.0823","0.0004","90","","90","","90","","1214.89","0.05","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","μ-oxalato-O,O',O'', O''')(2,2'-bipyridine-N,N')Fe(II)","","- C12 H8 Fe N2 O4 -","- C12 H8 Fe N2 O4 -","- C48 H32 Fe4 N8 O16 -","4","1","OS1041","Fun, Hoong-Kun; Shanmuga Sundara Raj, S.; Fang, Xia; Zheng, Li-Min; Xin, Xin-Quan","<i>catena</i>-Poly[[(2,2'-bipyridine)iron(II)]-μ-oxalato]","Acta Crystallographica Section C","1999","55","6","903","905","10.1107/S0108270199001924","","","0.71073","MoKα","","0.13","0.057","","0.092","0.072","","","","1.112","1.158","1.158","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008604","9.8412","0.0006","15.6366","0.0007","9.4044","0.0005","90","","90","","90","","1447.18","0.13","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","6,7-dihydroxy-1-(2-methoxypropyl)-1,2,3,4-tetrahydroisoquinolinium chloride hydrate","","- C13 H22 Cl N O4 -","- C13 H22 Cl N O4 -","- C52 H88 Cl4 N4 O16 -","4","1","OS1043","Domagała, Małgorzata; Rybarczyk, Agnieszka J.; Olszak, Tomasz A.; Brzezińska, Elżbieta","X-ray investigations of potential β-blockers. IV","Acta Crystallographica Section C","1999","55","6","1003","1005","10.1107/S0108270199002383","","","1.54178","CuKα","","0.035","0.029","","","","0.08","","","","","","1.04","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008605","6.9675","0.0001","9.5232","0.0002","11.0979","0.0003","97.556","0.001","104.298","0.001","95.403","0.001","701.2","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5-(2-Chlorophenyl)-4-phenyl-4H-1,2,4-triazole-3-thione","","- C14 H10 Cl N3 S -","- C14 H10 Cl N3 S -","- C28 H20 Cl2 N6 S2 -","2","1","OS1044","Puviarasan, K.; Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Jayanthi, G.; Hoong-Kun Fun","5-(2-Chlorophenyl)-4-phenyl-3,4-dihydro-2<i>H</i>-1,2,4-triazole-3-thione","Acta Crystallographica Section C","1999","55","6","951","953","10.1107/S0108270199002796","","","0.71073","MoKα","","0.052","0.041","","","","0.109","","","","","","1.018","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008606","9.4282","0.0011","18.717","0.0012","19.6325","0.0012","90","","103","0.002","90","","3375.7","0.5","295","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H34 I2 N4 Ni O2 Zn -","- C31 H34 I2 N4 Ni O2 Zn -","- C124 H136 I8 N16 Ni4 O8 Zn4 -","4","1","OS1045","Arıcı, Cengiz; Ercan, Filiz; Atakol, Orhan; Akay, Abdülkadir; Ülkü, Dinçer","{[μ-Bis(salicylidene)-1,3-propanediaminato]-bis(3,5-dimethylpyridine)nickel(II)}diiodozinc(II)","Acta Crystallographica Section C","1999","55","6","928","930","10.1107/S0108270199002802","","","0.71073","MoKα","","","0.025","","","0.033","","","","","0.98","0.98","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008607","7.2691","0.0007","10.4214","0.0013","16.868","0.002","90","","90","","90","","1277.8","0.3","122","0.5","122","0.5","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-2-amino-3-methyl-1-butanol-(2S,3S)-hydrogen-tartrate monohydrate","","- C9 H21 N O8 -","- C9 H21 N O8 -","- C36 H84 N4 O32 -","4","1","OS1047","Bruun, Rikke Mattsson; Larsen, Sine","(<i>S</i>)-2-Amino-3-methyl-1-butanol (2<i>S</i>,3<i>S</i>)-hydrogen tartrate monohydrate","Acta Crystallographica Section C","1999","55","6","956","958","10.1107/S0108270199003042","","","1.54184","CuKα","","0.0262","0.0256","","","","0.0731","","","","","","1.077","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008608","9.7934","0.0002","9.5005","0.0001","15.2958","0.0001","90","","102.297","0.001","90","","1390.5","0.03","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-methyl-3-(2-methylphenyl)-1,2,4-triazolo-[3,4-b][1,3]benzothiazole","","- C16 H13 N3 S -","- C16 H13 N3 S -","- C64 H52 N12 S4 -","4","1","OS1049","Puviarasan, K.; Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Jayanthi, G.; Hoong-Kun Fun","7-Methyl-3-(2-methylphenyl)-1,2,4-triazolo[3,4-<i>b</i>][1,3]benzothiazole, (I), and 7-methyl-3-(4-methylphenyl)-1,2,4-triazolo[3,4-<i>b</i>][1,3]benzothiazole, (II)","Acta Crystallographica Section C","1999","55","6","948","951","10.1107/S0108270199000864","","","0.71073","MoKα","","0.119","0.056","","","","0.163","","","","","","0.959","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008609","24.482","0.0012","7.5509","0.0004","7.506","0.0004","90","","90","","90","","1387.57","0.12","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","7-methyl-3-(4-methylphenyl)-1,2,4-triazolo-[3,4-b][1,3]benzothiazole","","- C16 H13 N3 S -","- C16 H13 N3 S -","- C64 H52 N12 S4 -","4","1","OS1049","Puviarasan, K.; Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Jayanthi, G.; Hoong-Kun Fun","7-Methyl-3-(2-methylphenyl)-1,2,4-triazolo[3,4-<i>b</i>][1,3]benzothiazole, (I), and 7-methyl-3-(4-methylphenyl)-1,2,4-triazolo[3,4-<i>b</i>][1,3]benzothiazole, (II)","Acta Crystallographica Section C","1999","55","6","948","951","10.1107/S0108270199000864","","","0.71073","MoKα","","0.064","0.048","","","","0.125","","","","","","1.016","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008610","6.573","0.005","10.687","0.005","30.531","0.005","90","","90","","90","","2144.7","1.9","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","2,4-dicholoro-5-nitrobenzoic sodium dihydrate","","- C7 H6 Cl2 N Na O6 -","- C7 H6 Cl2 N Na O6 -","- C56 H48 Cl16 N8 Na8 O48 -","8","1","QA0071","Morales, Angel Dago; Novoa de Armas, Héctor; Lisbet Xuárez Marill; Rolando Pellón Comdom; García-Granda, Santiago","Sodium 2,4-dichloro-5-nitrobenzoate dihydrate","Acta Crystallographica Section C","1999","55","6","IUC9900056","","10.1107/S0108270199099382","","","0.71069","MoKα","","0.122","0.057","","0.197","0.138","","","","1.204","1.266","1.266","","","","","has coordinates","199684","2020-10-21","18:00:00",""
"2008611","7.507","0.001","7.507","0.001","7.507","0.001","92.29","0.02","92.29","0.02","92.29","0.02","422.02","0.1","293","2","293","2","","","","","","","","5","R -3 :R","-P 3*","148","Sodium iodide tris(1,4-dioxane)","","","- C12 H24 I Na O6 -","- C12 H24 I Na O6 -","- C12 H24 I Na O6 -","1","0.166667","QA0095","Belsky, Vitaly K.; Maslennikova, Vera I.","Sodium tris(1,4-dioxane) iodide","Acta Crystallographica Section C","1999","55","6","IUC9900057","","10.1107/S0108270199099370","","","0.71073","MoKα","","0.022","0.022","","","","0.063","","","","","","1.108","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008612","8.1525","0.0005","7.9948","0.0005","12.7269","0.0006","90","","108.008","0.004","90","","788.87","0.08","293","2","293","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","none","Bis(3-acetylamino-1,2,4-triazole-O,N^4^) dinitratocopper (II)","","- C8 H12 Cu N10 O8 -","- C8 H12 Cu N10 O8 -","- C16 H24 Cu2 N20 O16 -","2","0.5","QA0112","Virovets, Alexander V.; Naumov, Dmitry Yu.; Lavrenova, Ludmila G.; Bushuev, Mark B.","Bis(3-acetylamino-1,2,4-triazole-<i>O</i>,<i>N</i>^4^)bis(nitrato-<i>O</i>)copper(II)","Acta Crystallographica Section C","1999","55","6","IUC9900059","","10.1107/S0108270199099357","","","0.71069","MoKα","","0.04","0.034","","","","0.104","","","","","","1.08","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008613","6.676","0.001","5.567","0.0009","11.471","0.003","90","","103.88","0.04","90","","413.87","0.16","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N,N'-Dimethyl-2,2'-biimidazole","","- C8 H10 N4 -","- C8 H10 N4 -","- C16 H20 N8 -","2","0.5","QA0113","Therrien, Bruno; Beauchamp, André L.","1,1'-Dimethyl-2,2'-biimidazole","Acta Crystallographica Section C","1999","55","6","IUC9900054","","10.1107/S0108270199099321","","","0.71069","MoKα","","0.048","0.036","","0.088","","0.084","","","0.911","","","1.027","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008614","11.046","0.001","12.545","0.001","13.624","0.001","90","","90","","90","","1887.9","0.3","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H24 Br4 -","- C17 H24 Br4 -","- C68 H96 Br16 -","4","1","QA0114","Auhmani, A.; Kossareva, E.; Lassaba, E.; Réglier, M.; Pierrot, M.; Benharref, A.","Cyclopropanation reactions on α-<i>cis</i>-himachalene and a β-himachalene","Acta Crystallographica Section C","1999","55","6","IUC9900055","","10.1107/S010827019909931X","","","0.71073","MoKα","","","0.041","","","0.071","","","","","1.65","1.65","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008615","11.018","0.001","12.278","0.001","13.299","0.001","90","","90","","90","","1799.1","0.3","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H24 Cl4 -","- C17 H24 Cl4 -","- C68 H96 Cl16 -","4","1","QA0114","Auhmani, A.; Kossareva, E.; Lassaba, E.; Réglier, M.; Pierrot, M.; Benharref, A.","Cyclopropanation reactions on α-<i>cis</i>-himachalene and a β-himachalene","Acta Crystallographica Section C","1999","55","6","IUC9900055","","10.1107/S010827019909931X","","","0.71073","MoKα","","","0.048","","","0.131","","","","","1.484","1.484","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008616","9.599","0.001","11.922","0.001","13.517","0.001","90","","90","","90","","1546.9","0.2","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H24 Cl2 -","- C16 H24 Cl2 -","- C64 H96 Cl8 -","4","1","QA0114","Auhmani, A.; Kossareva, E.; Lassaba, E.; Réglier, M.; Pierrot, M.; Benharref, A.","Cyclopropanation reactions on α-<i>cis</i>-himachalene and a β-himachalene","Acta Crystallographica Section C","1999","55","6","IUC9900055","","10.1107/S010827019909931X","","","0.71073","MoKα","","","0.063","","","0.134","","","","","1.469","1.469","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008617","7.153","0.001","11.035","0.002","26.824","0.004","90","","90","","90","","2117.3","0.6","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1S,2R)-di-p-methoxyphenyl ammonium alcohol-L-tartrate-water","","- C20 H27 N O10 -","- C20 H27 N O10 -","- C80 H108 N4 O40 -","4","1","QA0116","Jian, Liao; Chen, Daimo; Jiang, Yaozhong; Yu, Kaibei; Chan, Albert S. C.","[2-Hydroxy-(1<i>S</i>,2<i>R</i>)-1,2-bis(4-methoxyphenyl)ethyl]ammonium <small>L</small>-tartrate hydrate","Acta Crystallographica Section C","1999","55","6","IUC9900053","","10.1107/S0108270199099308","","","0.71073","MoKα","","0.067","0.036","","0.103","0.073","","","","0.826","0.973","0.973","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008618","5.993","0.004","5.993","0.004","12.574","0.008","90","","90","","90","","451.6","0.5","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium periodate","Ammonium tetraoxoiodate(VII)","","- H4 I N O4 -","- H4 I N O4 -","- H16 I4 N4 O16 -","4","0.25","QA0117","Levason, William; Webster, Michael","Ammonium tetraoxoiodate(VII)","Acta Crystallographica Section C","1999","55","6","IUC9900052","","10.1107/S0108270199099394","","","0.71073","MoKα","","0.022","0.018","","","","0.049","","","","","","1.091","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008619","7.3408","0.0002","8.632","0.0002","15.0033","0.0003","73.476","0.001","85.741","0.001","70.288","0.001","857.78","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","hexaaquonickel(II) diaquo-μ-triethylenetetraaminehexaacetatodinickel(II) tetrahydrate","","- C18 H48 N4 Ni3 O24 -","- C18 H48 N4 Ni3 O24 -","- C18 H48 N4 Ni3 O24 -","1","0.5","QA0118","Li, Dong-Feng; Liao, Zhan-Ru; Xiong, Yun","A dinuclear nickel(II) complex with triethylenetetraaminehexaacetic acid","Acta Crystallographica Section C","1999","55","6","IUC9900058","","10.1107/S0108270199099369","","","0.71073","MoKα","","0.033","0.028","","0.077","0.075","","","","1.026","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008620","15.7794","0.0004","4.8525","0.0002","9.8771","0.0003","90","","97.952","0.001","90","","749.01","0.04","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DL-aminophenyl acetic acid","DL-2-amino-2-phenyl ethanoic acid","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C32 H36 N4 O8 -","4","1","QA0123","Dalhus, Bjørn; Görbitz, Carl Henrik","<small>DL</small>-Aminophenylacetic acid","Acta Crystallographica Section C","1999","55","6","IUC9900061","","10.1107/S0108270199099291","","","0.71073","MoKα","","0.097","0.058","","0.158","","0.139","","","1.033","","","1.11","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008621","8.5125","0.0002","18.262","0.0004","11.2164","0.0002","90","","105.328","0.001","90","","1681.62","0.06","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C28 H24 Cl8 P2 Pd -","- C28 H24 Cl8 P2 Pd -","- C56 H48 Cl16 P4 Pd2 -","2","0.5","QA0124","Juanatey, Pilar; Suárez, Antonio; López, Margarita; Vila, José M.; Ortigueira, Juan M.; Fernández, Alberto","<i>cis</i>-[1,2-Bis(diphenylphosphino)ethene]dichloropalladium(II) bis(trichloromethane) solvate","Acta Crystallographica Section C","1999","55","6","IUC9900062","","10.1107/S0108270199099345","","","0.71073","MoKα","","0.054","0.041","","","","0.116","","","","","","1.028","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008622","9.6489","0.0009","13.0543","0.0011","14.1245","0.0007","90","","101.173","0.006","90","","1745.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","8-Chloro-11-(4-methylpiperazin-1-yl)dibenzo[b,f]-1,4-selenazepine","","- C18 H18 Cl N3 Se -","- C18 H18 Cl N3 Se -","- C72 H72 Cl4 N12 Se4 -","4","1","QA0125","Dupont, Léon; Pignon, Bernard; Christiaens, Léon","8-Chloro-11-(4-methylpiperazin-1-yl)dibenzo[<i>b</i>,<i>f</i>]-1,4-selenazepine","Acta Crystallographica Section C","1999","55","6","IUC9900064","","10.1107/S010827019909928X","","","1.5418","CuKα","","0.049","0.035","","","","0.1","","","","","","1.007","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008623","21.913","0.002","5.254","0.002","23.553","0.002","90","","112.41","0.02","90","","2506.9","1.1","293","2","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","6-(cyclohexylmethylene)salicylic acid","","- C14 H18 O3 -","- C14 H18 O3 -","- C112 H144 O24 -","8","1","QA0126","Bourne, Susan A; Green, Ivan R; Tocoli, Felismino E","Analogues of anacardic acids: 6-(cyclohexylmethyl)salicylic acid and 6-(2-cyclohexylethyl)salicylic acid","Acta Crystallographica Section C","1999","55","6","IUC9900063","","10.1107/S0108270199099278","","","0.7107","MoKα","","","0.0513","","","","0.1741","","","","","","1.056","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008624","12.2361","0.0008","17.152","0.002","6.4725","0.0006","90","","97.01","0.004","90","","1348.3","0.2","293","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6-(2'-cyclohexylethylene)salicylic acid","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","QA0126","Bourne, Susan A; Green, Ivan R; Tocoli, Felismino E","Analogues of anacardic acids: 6-(cyclohexylmethyl)salicylic acid and 6-(2-cyclohexylethyl)salicylic acid","Acta Crystallographica Section C","1999","55","6","IUC9900063","","10.1107/S0108270199099278","","","0.7107","MoKα","","","0.0628","","","","0.2205","","","","","","1.075","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008625","11.9149","0.0005","16.8717","0.0006","18.1365","0.0004","90","","106.193","0.006","90","","3501.2","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Triquinolinium hexanitratolanthate(III) monohydrate","","- C27 H26 La N9 O19 -","- C27 H26 La N9 O19 -","- C108 H104 La4 N36 O76 -","4","1","QA0127","Yong Cui; Fakun Zheng; Jiutong Chen; Jinshun Huang","Triquinolinium hexanitratolanthate(III) monohydrate","Acta Crystallographica Section C","1999","55","6","IUC9900065","","10.1107/S0108270199099333","","","0.71073","MoKα","","0.036","0.029","","0.066","","0.064","","","1.153","","","1.171","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008626","5.91","0.001","11.21","0.002","15.961","0.002","90","","90","","90","","1057.4","0.3","292","2","292","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 O2 P -","- C11 H15 O2 P -","- C44 H60 O8 P4 -","4","1","QB0096","Deng, Jingen; He, Ze; Yu, Kaibai; Mi, Aiqiao; Jiang, Yaozhong","(2<i>R</i>,<i>S</i>~P~)-2-Hydroxymethyl-1-phenylphospholane 1-oxide","Acta Crystallographica Section C","1999","55","6","IUC9900060","","10.1107/S0108270199099266","","","0.71073","MoKα","","0.035","0.03","","0.075","0.074","","","","0.984","1.035","1.035","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008627","12.193","0.001","17.562","0.002","21.84","0.003","90","","97.71","0.01","90","","4634.4","0.9","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-poly[triphenyltin-μ-(N,N-dimethylthiocarbamoylacetato)-O:O']}","","- C23 H23 N O3 S Sn -","- C23 H23 N O3 S Sn -","- C184 H184 N8 O24 S8 Sn8 -","8","2","SK1236","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng","Triphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate, triphenyltin <i>N</i>,<i>N</i>-pentamethylenecarbamoylthioacetate and cyclopentyldiphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate","Acta Crystallographica Section C","1999","55","6","889","894","10.1107/S0108270199001286","","","0.71073","MoKα","","0.068","0.042","","","","0.108","","","","","","1.018","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008628","27.404","0.001","17.855","0.001","21.682","0.001","90","","98.11","0.01","90","","10502.9","0.9","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-poly[triphenyltin-μ-(N,N-pentamethylenecarbamoylthioacetato)-O:O']}","","- C26 H27 N O3 S Sn -","- C26 H27 N O3 S Sn -","- C416 H432 N16 O48 S16 Sn16 -","16","2","SK1236","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng","Triphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate, triphenyltin <i>N</i>,<i>N</i>-pentamethylenecarbamoylthioacetate and cyclopentyldiphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate","Acta Crystallographica Section C","1999","55","6","889","894","10.1107/S0108270199001286","","","0.71073","MoKα","","0.104","0.057","","","","0.169","","","","","","1.095","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008629","12.307","0.002","17.528","0.002","21.781","0.004","90","","97.77","0.01","90","","4655.4","1.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Sn(C5H9)(C6H5)2(C5H8NO3S)]","catena-poly[cyclopentyldiphenyltin-μ-(N,N-dimethylthiocarbamoylacetato)-O:O']}","","- C22 H27 N O3 S Sn -","- C22 H27 N O3 S Sn -","- C176 H216 N8 O24 S8 Sn8 -","8","2","SK1236","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng","Triphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate, triphenyltin <i>N</i>,<i>N</i>-pentamethylenecarbamoylthioacetate and cyclopentyldiphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate","Acta Crystallographica Section C","1999","55","6","889","894","10.1107/S0108270199001286","","","0.71073","MoKα","","0.138","0.062","","","","0.185","","","","","","1.049","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008630","8.9654","0.0003","9.6447","0.0003","20.0666","0.0005","78.475","0.001","81.518","0.001","83.786","0.001","1675.99","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","{4,4'-Dimethyl-6,6'-bis(1-morpholiniomethyl)-2,2'-[1,2- ethanediylbis(nitrilomethylidene-N)]diphenolato-O,O'}copper(II) diperchlorate monohydrate","","- C28 H40 Cl2 Cu N4 O13 -","- C28 H40 Cl2 Cu N4 O13 -","- C56 H80 Cl4 Cu2 N8 O26 -","2","1","SK1242","S. Shanmuga Sundara Raj; R. Thirumurugan; G. Shanmugam; Hoong-Kun Fun; J. Manonmani; M. Kandaswamy","{4,4'-Dimethyl-6,6'-bis(1-morpholiniomethyl)-2,2'-[1,2-ethanediylbis(nitrilomethylidene-<i>N</i>)]diphenolato-<i>O</i>,<i>O</i>'}copper(II) diperchlorate monohydrate","Acta Crystallographica Section C","1999","55","6","894","896","10.1107/S0108270199001298","","","0.71073","MoKα","","0.106","0.068","","","","0.182","","","","","","1.117","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008631","7.3215","0.0001","17.3709","0.0002","13.3435","0.0002","90","","90","","90","","1697.04","0.04","173","","173","","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C14 H18 Cl4 N2 Ti -","- C14 H18 Cl4 N2 Ti -","- C56 H72 Cl16 N8 Ti4 -","4","","SK1252","Hensen, Karl; Lemke, Alexander; Bolte, Michael","Addition compounds of titanium tetrachloride with aromatic nitrogen bases","Acta Crystallographica Section C","1999","55","6","863","867","10.1107/S0108270199000554","","","0.71073","MoKα","","0.0351","0.029","","0.068","0.0651","0.068","","","1.108","","","1.108","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008632","7.184","0.001","8.014","0.002","14.151","0.003","90","","90","","90","","814.7","0.3","173","","173","","","","","","","","","5","P m n a","-P 2ac 2","53","","","","- C12 H14 Cl4 N2 Ti -","- C12 H14 Cl4 N2 Ti -","- C24 H28 Cl8 N4 Ti2 -","2","0.25","SK1252","Hensen, Karl; Lemke, Alexander; Bolte, Michael","Addition compounds of titanium tetrachloride with aromatic nitrogen bases","Acta Crystallographica Section C","1999","55","6","863","867","10.1107/S0108270199000554","","","0.71073","MoKα","","0.0556","0.0471","","0.1086","0.1062","0.1086","","","1.31","","","1.31","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008633","7.8998","0.0002","9.9722","0.0003","16.0448","0.0005","107.54","0.001","93.784","0.001","99.551","0.001","1179.43","0.06","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H40 Cl16 N12 Ti3 -","- C24 H40 Cl16 N12 Ti3 -","- C24 H40 Cl16 N12 Ti3 -","1","0.5","SK1252","Hensen, Karl; Lemke, Alexander; Bolte, Michael","Addition compounds of titanium tetrachloride with aromatic nitrogen bases","Acta Crystallographica Section C","1999","55","6","863","867","10.1107/S0108270199000554","","","0.71073","MoKα","","0.0829","0.0463","","0.0933","0.0823","0.0933","","","1.039","","","1.039","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2008634","7.888","0.001","8.643","0.001","29.832","0.001","90","","90","","90","","2033.8","0.4","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3R,6S,1'R)-3-(1-Naphth-1-yl-2-nitro-ethyl)-6-isopropyl-2,5- dimethoxy-3,6-dihydro-pyrazine","","- C21 H25 N3 O4 -","- C21 H25 N3 O4 -","- C84 H100 N12 O16 -","4","1","SK1254","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 1. Compounds derived from <i>cyclo</i>(Gly-<small>L</small>-Val)","Acta Crystallographica Section C","1999","55","6","964","968","10.1107/S0108270199001304","","","1.5418","CuKα","","0.0358","0.0352","","","","0.113","","","","","","0.968","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008635","8.88","0.002","6.748","0.002","17.73","0.004","90","","100.42","0.03","90","","1044.9","0.5","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H27 N3 O6 -","- C19 H27 N3 O6 -","- C38 H54 N6 O12 -","2","1","SK1254","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 1. Compounds derived from <i>cyclo</i>(Gly-<small>L</small>-Val)","Acta Crystallographica Section C","1999","55","6","964","968","10.1107/S0108270199001304","","","0.71069","MoKα","","0.1453","0.0694","","","","0.1701","","","","","","1.126","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008636","8.514","0.001","9.301","0.001","20.119","0.002","90","","90","","90","","1593.2","0.3","293","","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H24 N2 O4 -","- C14 H24 N2 O4 -","- C56 H96 N8 O16 -","4","1","SK1254","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 1. Compounds derived from <i>cyclo</i>(Gly-<small>L</small>-Val)","Acta Crystallographica Section C","1999","55","6","964","968","10.1107/S0108270199001304","","","0.71069","MoKα","","0.0481","0.0436","","","","0.121","","","","","","1.049","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008637","8.211","0.001","9.254","0.001","20.861","0.002","90","","90","","90","","1585.1","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3R,6S)-3-[(R)-Hydroxy-phenyl-methyl]-6-isopropyl-2,5-dimethoxy- 3,6-dihydro-pyrazine","","- C16 H22 N2 O3 -","- C16 H22 N2 O3 -","- C64 H88 N8 O12 -","4","1","SK1254","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 1. Compounds derived from <i>cyclo</i>(Gly-<small>L</small>-Val)","Acta Crystallographica Section C","1999","55","6","964","968","10.1107/S0108270199001304","","","0.71069","MoKα","","0.0518","0.0432","","0.1213","0.1147","","","","1.136","1.18","1.18","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008638","5.803","0.001","10.486","0.001","14.762","0.001","90","","90.05","0.01","90","","898.27","0.19","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(3RS,6SR)-3,6-Dibenzyl-2,5-dimethoxy-3,6-dihydro-pyrazine","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C40 H44 N4 O4 -","2","0.5","SK1255","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds","Acta Crystallographica Section C","1999","55","6","968","973","10.1107/S010827019801645X","","","0.71069","MoKα","","0.0426","0.0369","","0.1076","0.1025","","","","1.041","1.088","1.088","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008639","10.998","0.001","11.513","0.001","14.464","0.001","90","","90","","90","","1831.4","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3S,6S)-3,6-Dibenzyl-2,5-dimethoxy-3,6-dihydro-pyrazine","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C80 H88 N8 O8 -","4","1","SK1255","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds","Acta Crystallographica Section C","1999","55","6","968","973","10.1107/S010827019801645X","","","0.71069","MoKα","","0.0514","0.0418","","0.1032","0.0971","","","","1.08","1.121","1.121","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008640","5.88","0.001","7.449","0.001","11.197","0.001","98.41","0.01","90.13","0.01","91.97","0.01","484.86","0.11","293","","293","","","","","","","","","5","P 1","P 1","1","","(3R,6S)-3-Benzyl-6-pentafluorophenyl-methyl-2,5-dimethoxy- 3,6-dihydro-pyrazine","","- C20 H17 F5 N2 O2 -","- C20 H17 F5 N2 O2 -","- C20 H17 F5 N2 O2 -","1","1","SK1255","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds","Acta Crystallographica Section C","1999","55","6","968","973","10.1107/S010827019801645X","","","1.5418","CuKα","","0.0386","0.0371","","0.1137","0.1107","","","","1.05","1.056","1.056","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008641","6.441","0.001","9.036","0.001","32.996","0.004","90","","90","","90","","1920.4","0.4","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3R,6S)-3-Benzyl-6-(cyclohexyl-methyl)-2,5-dimethoxy- 3,6-dihydro-pyrazine","","- C20 H28 N2 O2 -","- C20 H28 N2 O2 -","- C80 H112 N8 O8 -","4","1","SK1255","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds","Acta Crystallographica Section C","1999","55","6","968","973","10.1107/S010827019801645X","","","0.71069","MoKα","","0.1064","0.0626","","0.1584","0.1344","","","","1.046","1.167","1.167","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008642","6.86","0.001","16.461","0.001","20.386","0.002","90","","90","","90","","2302","0.4","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H30 N2 O4 -","- C24 H30 N2 O4 -","- C96 H120 N8 O16 -","4","1","SK1255","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds","Acta Crystallographica Section C","1999","55","6","968","973","10.1107/S010827019801645X","","","0.71069","MoKα","","0.0637","0.0429","","0.1078","0.0964","","","","1.032","1.112","1.112","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008643","5.7445","0.0008","5.7445","0.0008","17.235","0.005","90","","90","","120","","492.55","0.17","293","2","293","2","","","","","","","","5","P -3 c 1","-P 3 2""c","165","Bi nitro aluminate","Tetracalcium dialuminium hydroxide binitrate tetrahydrate","","- Al2 Ca4 H20 N2 O22 -","- Al2 Ca4 H12 N2.0004 O22.0016 -","- Al2 Ca4 H12 N2.0004 O22.0016 -","1","0.0833333","SK1257","Renaudin, Guillaume; François, Michel","The lamellar double-hydroxide (LDH) compound with composition 3CaO^.^Al~2~O~3~^.^Ca(NO~3~)~2~^.^10H~2~O","Acta Crystallographica Section C","1999","55","6","835","838","10.1107/S0108270199003066","","","0.71073","MoKα","","0.039","0.036","","","","0.1","","","","","","1.164","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008644","13.492","0.0002","9.6317","0.0001","16.9975","0.0003","90","","90","","90","","2208.84","0.06","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","Diazidobis-1,10-phenanthroline manganese(II)","","- C24 H16 Mn N10 -","- C24 H16 Mn N10 -","- C96 H64 Mn4 N40 -","4","0.5","SK1267","Shen, Zhen; Zuo, Jing-Lin; Chinnakali, Kandasamy; Fun, Hoong-Kun; You, Xiao-Zeng","Diazidobis(1,10-phenanthroline-<i>N</i>,<i>N</i>')manganese(II)","Acta Crystallographica Section C","1999","55","6","901","903","10.1107/S010827019900181X","","","0.71073","MoKα","","0.048","0.037","","","","0.118","","","","","","1.063","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008645","11.6166","0.0009","8.2634","0.0008","18.2929","0.0018","90","","98.856","0.007","90","","1735","0.3","295","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Cl2 Cu N2 O2 Zn -","- C17 H16 Cl2 Cu N2 O2 Zn -","- C68 H64 Cl8 Cu4 N8 O8 Zn4 -","4","1","SK1278","Tatar, Leyla; Atakol, Orhan; Ülkü, Dinçer; Aksu, Mecit","{[μ-Bis(salicylidene)-1,3-propanediaminato]-copper(II)}dichlorozinc(II)","Acta Crystallographica Section C","1999","55","6","923","925","10.1107/S0108270199003091","","","0.71073","MoKα","","","0.031","","","","0.038","","","","","","0.99","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008646","16.4555","0.0009","16.4555","0.0009","44.178","0.005","90","","90","","120","","10360","1.4","296","2","296","2","","","","","","","","7","R 3 c :H","R 3 -2""c","161","","μ~3~-iodine-2:3:4κ^3^I-sulfido-1κS-tri-μ~3~-sulfido-1:2:3κ^3^S; 1:2:4κ^3^S;-1:3:4κ^3^S-tris(triphenylphosphine)-2κP;3κP;4κP","","- C72 H60 Ag3 I P4 S5 W -","- C72 H60 Ag3 I P4 S5 W -","- C432 H360 Ag18 I6 P24 S30 W6 -","6","0.333333","TA1221","Jin, Qiong-Hua; Xin, Xiu-Lan; Deng, Yu-Heng; Yu, Kai-Bei","μ~3~-Iodo-2:3:4κ^3^<i>I</i>-tri-μ~3~-sulfido-1:2:3κ^3^<i>S</i>;1:2:4κ^3^<i>S</i>;1:3:4κ^3^<i>S</i>-sulfido-1κ<i>S</i>-tris(triphenylphosphine)-2κ<i>P</i>,3κ<i>P</i>,4κ<i>P</i>-trisilvertungsten‒triphenylphosphine sulfide (1/1)","Acta Crystallographica Section C","1999","55","6","860","863","10.1107/S0108270199002978","","","0.71073","MoKα","","","0.029","","","","0.071","","","","","","1.007","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008647","7.552","0.002","18.013","0.003","8.057","0.002","90","","105.02","0.02","90","","1058.6","0.4","296.2","","296.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 Cl4 Ru2 -","- C19.992 H18.624 Cl4 Ru2 -","- C39.984 H37.248 Cl8 Ru4 -","2","0.5","TA1223","Mark Bown; Martin A. Bennett","Di-μ-chloro-bis{chloro[(4a,5,6,7,8,8a-η^6^)-1,2,3,4-tetrahydronaphthalene]ruthenium(II)}","Acta Crystallographica Section C","1999","55","6","852","854","10.1107/S0108270199002589","","","0.7107","MoKα","","0.038","0.027","","0.036","","0.035","","","1.792","","","1.916","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008648","6.264","0.002","9.035","0.004","22.362","0.009","90","","90","","90","","1265.6","0.9","152","2","152","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-D-3,4-anhydro-1,2:5,6-di-O-isopropylidene-allo-inositol","","- C12 H18 O5 -","- C12 H18 O5 -","- C48 H72 O20 -","4","1","TA1231","Falshaw, Andrew; Gainsford, Graeme J.; Lensink, Cornelis","1-<small>D</small>-3,4-Anhydro-1,2:5,6-di-<i>O</i>-isopropylidene-<i>allo</i>-inositol","Acta Crystallographica Section C","1999","55","6","958","960","10.1107/S0108270199002607","","","0.71073","MoKα","","0.095","0.051","","0.093","0.081","","","","1.042","1.128","1.128","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008649","6.411","0.002","20.092","0.002","8.93","0.002","90","","103.24","0.02","90","","1119.7","0.5","248","","248","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H17 N O2 -","- C12 H17 N O2 -","- C48 H68 N4 O8 -","4","1","TA1232","Yoshihara, Ryouko; Hosomi, Hiroyuki; Aoyama, Hiromu; Ohba, Shigeru","<i>N</i>-(Isopropyl)norbornane-<i>endo</i>-2,3-dicarboximide","Acta Crystallographica Section C","1999","55","6","960","962","10.1107/S0108270199002619","","","1.54184","CuKα","","","0.065","","","","0.151","","","","","","1.96","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008650","9.0204","0.0001","13.9921","0.0002","15.898","0.0001","106.022","0.001","90.673","0.001","98.479","0.001","1904.63","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(μ-hydrido)(μ-2-hydroxyethoxy)decacarbonyltriosmium","","- C12 H6 O12 Os3 -","- C12 H6 O12 Os3 -","- C48 H24 O48 Os12 -","4","2","TA1235","Leong, Weng Kee; Lum, Mien Wei","Decacarbonyl(μ-hydrido)(μ-2-hydroxyethoxy)triosmium","Acta Crystallographica Section C","1999","55","6","881","882","10.1107/S0108270199002620","","","0.71073","MoKα","","0.075","0.051","","","","0.141","","","","","","1.006","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008651","9.656","0.001","5.592","0.001","15.788","0.001","90","","102.68","0.01","90","","831.7","0.18","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","1,2:3,4:5,6-Tri-O-isopropylidene-D-manitol","","- C15 H26 O6 -","- C15 H26 O6 -","- C30 H52 O12 -","2","1","BK1441","Ping Liu; Ting-Bin Wen; Jian-Kai Cheng","1,2:3,4:5,6-Tri-<i>O</i>-isopropylidene-<small>D</small>-mannitol","Acta Crystallographica Section C","1999","55","7","1179","1181","10.1107/S0108270199002759","","","0.71073","MoKα","","0.044","0.04","","0.099","0.098","","","","1.058","1.091","1.091","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008652","8.0857","0.0009","8.5118","0.0005","10.4161","0.0007","88.788","0.007","73.155","0.008","77.352","0.007","668.78","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(4-carboxyl-2,6-dichlorophenylimino)imidazolidine dihydrate","","- C10 H13 Cl2 N3 O4 -","- C10 H13 Cl2 N3 O4 -","- C20 H26 Cl4 N6 O8 -","2","1","BK1445","E.M.Elssfah; K.Chinnakali; H.K.Fun; I.W.Mathison; E.K.Gan; M.Zubaid; T.W.Sam; C.Y.Tan","3,5-Dichloro-4-(imidazolidin-2-ylideneammonio)benzoate dihydrate","Acta Crystallographica Section C","1999","55","7","1115","1117","10.1107/S0108270199003832","","","0.71073","MoKα","","0.053","0.0383","","0.1104","0.1049","","","","1.045","1.162","1.162","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008653","7.5453","0.0003","12.0114","0.0005","13.5984","0.0005","109.342","0.001","99.98","0.001","98.593","0.001","1116.54","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H11 N3 O S -","- C11 H11 N3 O S -","- C44 H44 N12 O4 S4 -","4","2","BK1448","Puviarasan, K.; Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Jayanthi, G.; Hoong-Kun Fun","3-Cyclopropyl-1,2,4-triazolo[3,4-<i>b</i>]benzothiazole monohydrate","Acta Crystallographica Section C","1999","55","7","1119","1121","10.1107/S0108270199004448","","","0.71073","MoKα","","0.0421","0.0362","","","","0.1032","","","","","","1.052","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008654","17.1543","0.0008","10.7312","0.0005","20.6138","0.001","90","","101.618","0.001","90","","3717","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H45 Cl P2 Ru -","- C46 H45 Cl P2 Ru -","- C184 H180 Cl4 P8 Ru4 -","4","1","BK1451","Ilia A. Guzei; M. Angeles Paz-Sandoval; Román Torres-Lubian; Patricia Juarez-Saavedra","Chloro(pentamethyl-η^5^-cyclopentadienyl)bis(triphenylphosphine)ruthenium(II)","Acta Crystallographica Section C","1999","55","7","1090","1092","10.1107/S010827019900253X","","","0.71073","MoKα","","0.0485","0.0301","","","","0.0649","","","","","","1.038","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008655","5.275","0.003","9.747","0.004","11.451","0.005","96.44","0.03","84.11","0.03","78.88","0.04","569.4","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","aziridinyl","Bis(2,2-dimethylaziridinyl)phosphinic amide","","- C8 H18 N3 O P -","- C8 H18 N3 O P -","- C16 H36 N6 O2 P2 -","2","1","BK1457","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","Bis(2,2-dimethylaziridinyl)phosphinic amide","Acta Crystallographica Section C","1999","55","7","1173","1175","10.1107/S0108270199003248","","","1.54178","CuKα","","0.045","0.042","","","","0.116","","","","","","1.08","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008656","18.409","0.002","7.2898","0.0006","5.6649","0.0004","90","","94.96","0.01","90","","757.37","0.12","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(1H-1,2,4-triazol-1-yl)phenol","","- C8 H7 N3 O -","- C8 H7 N3 O -","- C32 H28 N12 O4 -","4","1","BM1323","Foces-Foces, C.; Cabildo, P.; Claramunt, R. M.; Elguero, J.","4-(1<i>H</i>-1,2,4-Triazol-1-yl)phenol","Acta Crystallographica Section C","1999","55","7","1160","1163","10.1107/S0108270199003558","","","1.5418","CuKα","","0.061","0.051","","0.044","0.039","","","","0.903","0.895","0.895","","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2008657","8.41","0.002","11.116","0.002","12.122","0.002","95.24","0.03","108.29","0.03","93.24","0.03","1067.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-phenylacetato-O:O')bis[(quinoline-N)cobalt(II)]","","- C50 H42 Co2 N2 O8 -","- C50 H42 Co2 N2 O8 -","- C50 H42 Co2 N2 O8 -","1","0.5","BM1324","Yong Cui; Fakun Zheng; Jinshun Huang","Tetrakis(μ-phenylacetato-<i>O</i>:<i>O</i>')bis[(quinoline-<i>N</i>)cobalt(II)]","Acta Crystallographica Section C","1999","55","7","1067","1069","10.1107/S0108270199004321","","","0.71073","MoKα","","0.056","0.047","","0.12","","0.116","","","1.041","","","1.084","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008658","20.412","0.003","20.412","0.003","10.482","0.002","90","","90","","90","","4367.3","1.2","120","","120","","","","","","","","","5","P 42/n :2","-P 4bc","86","","{μ-2,6-Bis(N-tert-butyliminomethylene)pyridine}rhodium(I) phenoxide","","- C21 H28 N3 O Rh -","- C21 H28 N3 O Rh -","- C168 H224 N24 O8 Rh8 -","8","1","BM1325","Kooijman, Huub; Kaagman, Jan Willem; Mach, Karel; Spek, Anthony L.; Schreurs, Antoine M.M.; Haarman, Hendrikus F.; Vrieze, Kees; Elsevier, Cornelis J.","[2,6-Bis(<i>N</i>-<i>tert</i>-butyliminomethyl)pyridine-κ^3^<i>N</i>](phenolato-κ<i>O</i>)rhodium(I)","Acta Crystallographica Section C","1999","55","7","1052","1054","10.1107/S0108270199003868","","","0.71073","MoKα","","0.06","0.057","","","","0.123","","","","","","1.454","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008659","10.581","0.001","10.089","0.001","5.8151","0.0008","90","","103.894","0.002","90","","602.61","0.12","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- K Na O6 V2 -","- K Na O6 V2 -","- K4 Na4 O24 V8 -","4","0.5","BR1213","Yongkui Shan; Songping D. Huang","A potassium sodium double salt of metavanadate, KNa(VO~3~)~2~","Acta Crystallographica Section C","1999","55","7","1048","1050","10.1107/S0108270198017995","","","0.7107","MoKα","","0.035","0.025","","0.044","","0.037","","","0.87","","","0.831","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008660","17.749","0.003","9.021","0.003","9.059","0.002","90","","90","","90","","1450.5","0.6","293","2","293","2","","","","","","","","2","C m c a","-C 2ac 2","64","","pentabarium tetraantimonide","","- Ba5 Sb4 -","- Ba5 Sb4 -","- Ba20 Sb16 -","4","","BR1235","Derrien, Gaelle; Monconduit, Laure; Tillard, Monique; Belin, Claude","Pentabarium tetraantimonide, β-Ba~5~Sb~4~: a more symmetrical arrangement for the Ba~5~Sb~4~ compound","Acta Crystallographica Section C","1999","55","7","1044","1046","10.1107/S0108270199003984","","","0.71069","MoKα","","0.111","0.043","","","","0.102","","","","","","0.926","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008661","9.684","0.003","9.479","0.003","8.156","0.003","90","","95.33","0.02","90","","745.4","0.4","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,12-Diaza-6,9-diazoniadispiro[5.2.5.2]hexadecane dichloride","","- C12 H26 Cl2 N4 -","- C12 H26 Cl2 N4 -","- C24 H52 Cl4 N8 -","2","0.5","BR1236","Chernyshev, Vladimir V.; Yatsenko, Alexandr V.; Tafeenko, Victor A.; Makarov, Vadim A.; Sonneveld, Eduard J.; Schenk, Hendrik","3,12-Diaza-6,9-diazoniadispiro[5.2.5.2]hexadecane dichloride from X-ray powder data","Acta Crystallographica Section C","1999","55","7","1099","1101","10.1107/S0108270199004138","","","1.54059","CuKα~1~","","","","","","","","","","2.33","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008662","9.198","0.001","10.559","0.001","10.593","0.001","68.94","0.01","79.01","0.01","67.41","0.01","884.8","0.2","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H26 N2 O2 -","- C19 H26 N2 O2 -","- C38 H52 N4 O4 -","2","1","","Sievert, Mark; Nagel, Norbert; Bock, Hans; Dienelt, Rüdiger","Diisopropylammonium diphenylmethylnitronate at 200 K","Acta Crystallographica Section C","1999","55","","1149","1152","","","","","","","","0.0448","","","0.0965","","","","","","","","","","","has coordinates","31976","2020-10-21","18:00:00",""
"2008663","7.2665","0.0003","10.9212","0.0004","13.2862","0.0004","90","","96.477","0.001","90","","1047.65","0.07","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2-hydroxyethyl)diisopropylammonium chloride","","- C8 H20 Cl N O -","- C8 H20 Cl N O -","- C32 H80 Cl4 N4 O4 -","4","1","DE1104","Mahmoudkhani, Amir Hossein; Langer, Vratislav","(2-Hydroxyethyl)diisopropylammonium chloride and its derivatives","Acta Crystallographica Section C","1999","55","7","1163","1167","10.1107/S010827019900356X","","","0.71073","MoKα","","0.078","0.047","","","","0.124","","","","","","1.031","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008664","8.9772","0.0002","8.069","0.0001","15.3032","0.0002","90","","95.937","0.001","90","","1102.57","0.03","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2-chloroethyl)diisopropylammonium chloride","","- C8 H19 Cl2 N -","- C8 H19 Cl2 N -","- C32 H76 Cl8 N4 -","4","1","DE1104","Mahmoudkhani, Amir Hossein; Langer, Vratislav","(2-Hydroxyethyl)diisopropylammonium chloride and its derivatives","Acta Crystallographica Section C","1999","55","7","1163","1167","10.1107/S010827019900356X","","","0.71073","MoKα","","0.043","0.03","","","","0.08","","","","","","1.062","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008665","25.091","0.0006","6.7447","0.0002","13.3049","0.0002","90","","90","","90","","2251.61","0.09","297","2","297","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","diisopropyl(2-mercaptoethyl)ammonium chloride","","- C8 H20 Cl N S -","- C8 H20 Cl N S -","- C64 H160 Cl8 N8 S8 -","8","2","DE1104","Mahmoudkhani, Amir Hossein; Langer, Vratislav","(2-Hydroxyethyl)diisopropylammonium chloride and its derivatives","Acta Crystallographica Section C","1999","55","7","1163","1167","10.1107/S010827019900356X","","","0.71073","MoKα","","0.039","0.032","","","","0.079","","","","","","1.09","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008666","10.003","0.001","14.744","0.001","17.242","0.002","90","","92.14","0.01","90","","2541.1","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaquabis(2,2'-bipyridine)nickel (II) Diperchlorate","","- C20 H20 Cl2 N4 Ni O10 -","- C20 H20 Cl2 N4 Ni O10 -","- C80 H80 Cl8 N16 Ni4 O40 -","4","1","FG1527","Rodríguez-Martín, Yolanda; González-Platas, Javier; Ruiz-Pérez, Catalina","Diaquabis(2,2'-bipyridine-<i>N</i>,<i>N</i>')nickel(II) diperchlorate","Acta Crystallographica Section C","1999","55","7","1087","1090","10.1107/S0108270199003881","","","0.71073","MoKα","","0.085","0.045","","","","0.143","","","","","","1.012","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008667","9.573","0.001","10.19","0.001","19.213","0.002","90","","90.32","0.01","90","","1874.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(5,6-Dimethyl-1,10-phenanthroline-N,N')(nitrato-O)(salicylaldehydato-O,O) copper(II)","","- C21 H17 Cu N3 O5 -","- C21 H17 Cu N3 O5 -","- C84 H68 Cu4 N12 O20 -","4","1","FR1120","Gasque, Laura; Moreno-Esparza, Rafael; Ruiz-Ramírez, Lena; Medina-Dickinson, Gerardo","(5,6-Dimethyl-1,10-phenanthroline)(nitrato)(salicylaldehydato)copper(II)","Acta Crystallographica Section C","1999","55","7","1063","1065","10.1107/S0108270199001018","","","0.71073","MoKα","","0.083","0.045","","","0.103","0.118","","","","","","1.056","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008668","10.67","0.001","11.752","0.001","12.099","0.001","83.93","0.01","72.21","0.01","74.02","0.01","1388.4","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aqua(4,7-diphenyl-1,10-phenanthroline)(salicylaldehydato)copper(II) nitrate monohydrate","","- C31 H25 Cu N3 O7 -","- C31 H25 Cu N3 O7 -","- C62 H50 Cu2 N6 O14 -","2","1","FR1122","Gasque, Laura; Moreno-Esparza, Rafael; Ruiz-Ramírez, Lena; Medina-Dickinson, Gerardo","Aqua(4,7-diphenyl-1,10-phenanthroline)(salicylaldehydato)copper(II) nitrate monohydrate","Acta Crystallographica Section C","1999","55","7","1065","1067","10.1107/S0108270199001572","","","0.71073","MoKα","","0.078","0.051","","","0.127","0.144","","","","","","1.019","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008669","17.432","0.004","17.339","0.004","11.538","0.004","90","","124.49","0.02","90","","2874.4","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1,4-bis(2'-formylphenyl)-1,4-dioxabutane bisthiosemicarbazone","2,2'-ethylenedioxydibenzaldehyde bis(thiosemicarbazone) bis(dimethyl sulfoxide)","","- C22 H32 N6 O4 S4 -","- C22 H32 N6 O4 S4 -","- C88 H128 N24 O16 S16 -","4","0.5","FR1153","Xu-Hui Zhu; Xiao-Feng Chen; Yong-Jiang Liu; Cun-Ying Duan; Xiao-Zeng You; Yu-Peng Tian; Fu-Xing Xie","2,2'-Ethylenedioxydibenzaldehyde bis(thiosemicarbazone) bis(dimethyl sulfoxide)","Acta Crystallographica Section C","1999","55","7","1175","1176","10.1107/S0108270199002334","","","0.71073","MoKα","","0.056","0.04","","0.111","0.102","","","","1.024","1.064","1.064","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008670","10.6433","0.0012","20.6568","0.0013","8.5187","0.0011","90","","91.762","0.002","90","","1872","0.3","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H38 Cd3 N4 O8 -","- C38 H38 Cd3 N4 O8 -","- C76 H76 Cd6 N8 O16 -","2","0.5","FR1176","Atakol, Orhan; Aksu, Mecit; Ercan, Filiz; Arici, Cengiz; Tahir, M. Nawaz; Ülkü, Dinçer","A linear trinuclear Cd^II^‒Cd^II^‒Cd^II^ complex with a μ-acetato bridge: bis{(μ-acetato)[μ-bis(salicylidene)-1,3-propanediaminato]cadmium(II)}cadmium(II)","Acta Crystallographica Section C","1999","55","7","1072","1075","10.1107/S0108270199004333","","","0.71073","MoKα","","","0.028","","","0.037","","","","","0.9","0.9","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008671","17.0422","0.0003","13.5414","0.0002","13.1573","0.0002","90","","109.06","0.001","90","","2869.92","0.08","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Benzylpiperidin-1-yl)glyoxal doixime","","- C14 H19 N3 O2 -","- C14 H19 N3 O2 -","- C112 H152 N24 O16 -","8","2","FR1184","Sema Öztürk; Şamil Işık; Mustafa Macit; Hoong-Kun Fun","1-(4-Benzylpiperidin-1-yl)glyoxal dioxime","Acta Crystallographica Section C","1999","55","7","1132","1134","10.1107/S0108270199004242","","","0.71073","MoKα","","0.059","0.044","","","","0.122","","","","","","1.028","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008672","7.691","0.001","9.1327","0.0008","10.982","0.001","75.815","0.008","71.109","0.008","89.304","0.01","705.67","0.14","296","","296","","","","","","","","","3","P -1","-P 1","2","2,2'-dihydroxy-5,5'-dimethoxybiphenyl-3,3'-dicarboxaldehyde","","","- C16 H14 O6 -","- C16 H14 O6 -","- C32 H28 O12 -","2","1","FR1197","Gerkin, Roger E.","Hydrogen bonding and C—H···O interactions in 2,2'-dihydroxy-5,5'-dimethoxybiphenyl-3,3'-dicarbaldehyde","Acta Crystallographica Section C","1999","55","7","1176","1179","10.1107/S010827019900445X","","","0.71073","MoKα","","","0.047","","","0.08","","","","","1.98","1.98","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008673","7.547","0.002","8.035","0.001","10.24","0.001","77.78","0.01","86.62","0.01","65.46","0.01","551.77","0.18","296","","296","","","","","","","","","4","P -1","-P 1","2","quinolinium-4-carboxylate trihydrate","","","- C10 H13 N O5 -","- C10 H13 N O5 -","- C20 H26 N2 O10 -","2","1","FR1203","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding in quinolinium-4-carboxylate trihydrate","Acta Crystallographica Section C","1999","55","7","1192","1195","10.1107/S0108270199004849","","","0.71073","MoKα","","","0.049","","","","0.078","","","","","","1.27","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008674","8.376","0.001","9.7236","0.0009","12.325","0.001","90","","96.9","0.01","90","","996.54","0.17","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(isopropylthio)benzoic acid","","","- C10 H12 O2 S -","- C10 H12 O2 S -","- C40 H48 O8 S4 -","4","1","FR1205","Gerkin, Roger E.","2-(Isopropylthio)benzoic acid","Acta Crystallographica Section C","1999","55","7","1190","1192","10.1107/S0108270199005582","","","0.71073","MoKα","","","0.046","","","","0.068","","","","","","1.66","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008675","11.568","0.001","14.356","0.002","16.243","0.001","90","","98.3","0.01","90","","2669.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","tetra(ethyl)ammonium tetraiodo(diethyldithiocarbamato)tellurate(IV)","tetra(ethyl)ammonium tetraiodo(diethyldithiocarbamato)tellurate(IV)","","- C13 H30 I4 N2 S2 Te -","- C13 H30 I4 N2 S2 Te -","- C52 H120 I16 N8 S8 Te4 -","4","1","GD1007","R. Krishna Kumar; G. Aravamudan; Kandasamy Sivakumar; Hoong-Kun Fun","Tetraethylammonium (<i>N</i>,<i>N</i>-diethyldithiocarbamato-<i>S</i>,<i>S</i>')tetraiodotellurate(IV)","Acta Crystallographica Section C","1999","55","7","1121","1123","10.1107/S0108270199003261","","","0.71073","MoKα","","0.059","0.037","","","","0.096","","","","","","0.934","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008676","17","0.002","14.369","0.002","13.485","0.002","90","","91.32","0.01","90","","3293.1","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Ni(t-salpd)","","","- C18 H18 N2 Ni O0.5 S2 -","- C18 H18 N2 Ni O0.5 S2 -","- C144 H144 N16 Ni8 O4 S16 -","8","2","GD1011","Gomes, Ligia; Pereira, Eulalia; de Castro, Baltazar","A nickel complex with a tetradentate N~2~S~2~ Schiff base ligand","Acta Crystallographica Section C","1999","55","7","1061","1063","10.1107/S0108270199004163","","","0.71073","MoKα","","0.067","0.043","","0.121","0.099","","","","1.215","1.217","1.217","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008677","9.968","0.003","4.475","0.002","14.906","0.002","90","","93.52","0.02","90","","663.7","0.4","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H8 N2 O3 -","- C5 H8 N2 O3 -","- C20 H32 N8 O12 -","4","1","GD1019","Okabe, Nobuo; Hayashi,Tomomi","Imidazole-4-acetic acid monohydrate","Acta Crystallographica Section C","1999","55","7","1142","1144","10.1107/S0108270199004023","","","0.71069","MoKα","","","0.072","","","","0.112","","","","","","1.21","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008678","15.5486","0.001","7.7295","0.0005","25.647","0.003","90","","96.005","0.006","90","","3065.4","0.5","290","1","290","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Di-2-(pyrrolyl)methylferrocene","Di-2-(pyrrolyl)methylferrocene","","- C19 H18 Fe N2 -","- C19 H18 Fe N2 -","- C152 H144 Fe8 N16 -","8","2","GD1024","Gallagher, John F.; Moriarty, Elena","Intermolecular (pyrrole)N—H···π(pyrrole) interactions in bis(2-pyrrolyl)methylferrocene, an organometallic porphyrin precursor","Acta Crystallographica Section C","1999","55","7","1079","1082","10.1107/S0108270199003625","","","0.7107","MoKα","","0.1019","0.0405","","","","0.0764","","","","","","0.932","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008679","6.842","0.002","12.156","0.003","14.184","0.003","90","","92.32","0.03","90","","1178.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-(2-Nitroprop-2-yl)quinoline-5-carbonitrile","","- C13 H11 N3 O2 -","- C13 H11 N3 O2 -","- C52 H44 N12 O8 -","4","1","GS1022","Ján Lokaj; Viktor Kettmann; Vladimír Macháček; Aleš Halama","6-(2-Nitroprop-2-yl)quinoline-5-carbonitrile","Acta Crystallographica Section C","1999","55","7","1101","1103","10.1107/S0108270199002772","","","0.71073","MoKα","","0.108","0.047","","0.122","0.094","","","","0.908","1.125","1.125","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008680","8.067","0.003","9.699","0.004","12.191","0.004","90","","100.19","0.03","90","","938.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,6,7,8,8a,9-hexahydrothieno[2,3-f]indolizine-6,9-dione","","- C10 H9 N O2 S -","- C10 H9 N O2 S -","- C40 H36 N4 O8 S4 -","4","1","GS1027","Ján Lokaj; Viktor Kettmann; Stephan Marchalin","4,6,7,8,8a,9-Hexahydrothieno[3,2-<i>f</i>]indolizine-6,9-dione","Acta Crystallographica Section C","1999","55","7","1103","1105","10.1107/S0108270199001055","","","0.71073","MoKα","","0.088","0.048","","0.134","0.091","","","","0.968","1.105","1.105","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008681","6.6557","0.0008","20.988","0.003","9.5188","0.0015","90","","95.473","0.014","90","","1323.6","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","7-Iodo-3-isopropylamino-4H-1,2,4-benzothiadiazine 1,1-dioxide","","- C10 H12 I N3 O2 S -","- C10 H12 I N3 O2 S -","- C40 H48 I4 N12 O8 S4 -","4","1","GS1034","Dupont, Léon; Pirotte, Bernard; de Tullio, Pascal","7-Iodo-3-isopropylamino-4<i>H</i>-1,2,4-benzothiadiazine 1,1-dioxide","Acta Crystallographica Section C","1999","55","7","1152","1154","10.1107/S0108270199000669","","","1.5418","CuKα","","0.0864","0.0512","","","","0.1406","","","","","","0.926","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008682","8.5295","0.0004","11.4017","0.0005","11.5115","0.0005","85.406","0.001","72.81","0.001","80.316","0.001","1053.71","0.08","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,2-Di(2-methoxyphenyl)-4-methyl[2H]benzo[h]chromene","","- C28 H24 O3 -","- C28 H24 O3 -","- C56 H48 O6 -","2","1","HA1251","Kandasamy Chinnakali; Kamaraj Sriraghavan; Hoong-Kun Fun; Vayalakkavoor T.Ramakrishnan","2,2-Bis(2-methoxyphenyl)-4-methyl-2<i>H</i>-benzo[<i>h</i>]chromene","Acta Crystallographica Section C","1999","55","7","1123","1125","10.1107/S0108270199001845","","","0.71073","MoKα","","0.068","0.048","","","","0.141","","","","","","1.027","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008683","6.421","0.0002","16.6897","0.0003","11.7575","0.0003","90","","98.738","0.001","90","","1245.36","0.06","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","9a-propargyl-1,2,3,10-tetrahydrofluorene-3,9-dione","","- C16 H12 O2 -","- C16 H12 O2 -","- C64 H48 O8 -","4","1","HA1252","Kandasamy Chinnakali; Hoong-Kun Fun; Desikan Rajagopal; Sambasivam Swaminathan; Kamaraj Sriraghavan","9a-Propargyl-1,2,3,9-tetrahydrofluorene-3,9-dione","Acta Crystallographica Section C","1999","55","7","1135","1136","10.1107/S0108270199001857","","","0.71073","MoKα","","0.082","0.056","","","","0.135","","","","","","1.119","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008684","22.8032","0.001","7.639","0.002","16.986","0.002","90","","106.29","0.01","90","","2840.1","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N,N'-Diphenylguanidinium dihydrogen phosphate","","- C13 H16 N3 O4 P -","- C13 H16 N3 O4 P -","- C104 H128 N24 O32 P8 -","8","1","HA1254","Pereira Silva, P. S.; Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.","<i>N</i>,<i>N</i>'-Diphenylguanidinium dihydrogen phosphate","Acta Crystallographica Section C","1999","55","7","1096","1099","10.1107/S0108270199004084","","","0.71073","MoKα","","0.042","0.027","","","","0.08","","","","","","1.035","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008685","7.887","0.009","8.358","0.004","13.98","0.01","90","0.06","103.49","","90","","896.1","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-bis(acetato-O)bis(2-amino-6-methylpyridine-N)copper(II)","","- C16 H22 Cu N4 O4 -","- C16 H22 Cu N4 O4 -","- C32 H44 Cu2 N8 O8 -","2","0.5","HA1255","Lah, Nina; Golič, Ljubo; Šegedin, Primož; Leban, Ivan","<i>trans</i>-Bis(acetato-<i>O</i>)bis(2-amino-6-methylpyridine-<i>N</i>)copper(II)","Acta Crystallographica Section C","1999","55","7","1056","1058","10.1107/S0108270199004345","","","0.71073","MoKα","","0.073","0.034","","","","0.086","","","","","","1.035","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008686","11.507","0.002","15.225","0.005","24.573","0.009","90","","90","","90","","4305","2","110","1","110","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1S,2R)-1-Amino-2-methoxycyclohexane-1-carboxamide hydrochloride 0.25 hydrate","","- C8 H17.5 Cl N2 O2.25 -","- C8 H17.5 Cl N2 O2.25 -","- C128 H280 Cl16 N32 O36 -","16","4","JZ1343","Pai Fondekar, Kamalesh; Volk, Franz-Josef; Weckert, Edgar; Frahm, August W.","(1<i>S</i>,2<i>R</i>)-1-Amino-2-methoxycyclohexane-1-carboxamide hydrochloride 0.25-hydrate","Acta Crystallographica Section C","1999","55","7","1167","1170","10.1107/S0108270199003522","","","0.71069","MoKα","","0.025","0.024","","","","0.063","","","","","","1.056","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008687","16.185","0.007","9.11","0.003","17.535","0.008","90","","116.85","0.02","90","","2306.7","1.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","pentacarbonyl-cyclopentadiene-(μ-dicylclohexylphosphanido)manganese-rhodium","","- C22 H27 Mn O5 P Rh -","- C22 H27 Mn O5 P Rh -","- C88 H108 Mn4 O20 P4 Rh4 -","4","1","JZ1346","Flörke, Ulrich; Haupt, Hans-Jürgen","Pentacarbonyl-1κ^4^<i>C</i>,2κ<i>C</i>-[2(η^5^)-cyclopentadienyl]-μ-dicyclohexylphosphido-1:2κ^2^<i>P</i>-manganeserhodium(<i>Mn</i>—<i>Rh</i>)","Acta Crystallographica Section C","1999","55","7","1051","1052","10.1107/S0108270199004175","","","0.71073","MoKα","","0.094","0.047","","0.1","","0.083","","","1.025","","","1.072","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008688","13.73","0.005","11.334","0.003","13.848","0.005","90","","109.15","0.02","90","","2035.7","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","tripropargylammonium chloride","","","- C9 H10 Cl N -","- C9 H10 Cl N -","- C72 H80 Cl8 N8 -","8","2","","Steiner, Thomas; Schreurs, Antoine M. M.; Kroon, Jan","Tris(prop-2-ynyl)ammonium chloride","Acta Crystallographica Section C","1999","55","","1156","1168","","","","","","","","","","","","","","","","","","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008689","10.516","0.007","11.484","0.006","11.705","0.007","113.89","0.04","112.11","0.04","95.83","0.04","1142.3","1.4","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H70 Fe2 Na2 O8 S6 -","- C24 H70 Fe2 Na2 O8 S6 -","- C24 H70 Fe2 Na2 O8 S6 -","1","0.5","KA1304","Ralf Hauptmann; Jörg Lackmann; Changneng Chen; Gerald Henkel","Di-μ-aqua-bis[(trimethanol-<i>O</i>)sodium] <i>anti</i>-bis(μ-2-propanethiolato-<i>S</i>:<i>S</i>)bis[bis(2-propanethiolato-<i>S</i>)iron(II)] and bis(benzyltrimethylammonium) <i>anti</i>-bis(μ-2-propaneselenolato-<i>Se</i>:<i>Se</i>)bis[bis(2-propaneselenolato-<i>Se</i>)iron(II)]","Acta Crystallographica Section C","1999","55","7","1084","1087","10.1107/S0108270199003704","","","0.71073","MoKα","","","0.0451","","","","0.1201","","","","1.04","1.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008690","10.322","0.008","10.482","0.007","13.259","0.008","97.64","0.005","103.98","0.05","115.43","0.005","1210.5","1.5","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H74 Fe2 N2 Se6 -","- C38 H74 Fe2 N2 Se6 -","- C38 H74 Fe2 N2 Se6 -","1","0.5","KA1304","Ralf Hauptmann; Jörg Lackmann; Changneng Chen; Gerald Henkel","Di-μ-aqua-bis[(trimethanol-<i>O</i>)sodium] <i>anti</i>-bis(μ-2-propanethiolato-<i>S</i>:<i>S</i>)bis[bis(2-propanethiolato-<i>S</i>)iron(II)] and bis(benzyltrimethylammonium) <i>anti</i>-bis(μ-2-propaneselenolato-<i>Se</i>:<i>Se</i>)bis[bis(2-propaneselenolato-<i>Se</i>)iron(II)]","Acta Crystallographica Section C","1999","55","7","1084","1087","10.1107/S0108270199003704","","","0.71073","MoKα","","","0.0341","","","","0.0827","","","","1.016","1.016","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008691","11.356","0.001","9.843","0.001","14.452","0.002","90","","91.56","0.01","90","","1614.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Chloro-1-(α-chloroacetyl)-1,2,3,4-tetrahydro-4-methylquinoline-2- spirocyclohexane","","- C17 H21 Cl2 N O -","- C17 H21 Cl2 N O -","- C68 H84 Cl8 N4 O4 -","4","1","KA1310","Henao-Martínez, José Antonio; Palma, Alirio R.; Kouznetsov, Vladimir V.; Aguirre-Hernández, Gerardo; Fernando-Ortega, Chicote; Soriano-García, Manuel","6-Chloro-1-(α-chloroacetyl)-1,2,3,4-tetrahydro-4-methylquinoline-2-spirocyclohexane","Acta Crystallographica Section C","1999","55","7","1181","1183","10.1107/S0108270199003376","","","0.71073","MoKα","","0.109","0.053","","0.177","0.133","","","","1.157","1.257","1.257","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008692","9.485","0.0013","11.769","0.002","14.596","0.002","104.889","0.012","96.663","0.012","90.451","0.009","1562.8","0.4","135","","","","","","","","","","","4","P -1","-P 1","2","","(±)-(3'aα,4'β,6'aα)-1',3',3'a,6'a-Tetrahydro-5,5,N,N- tetramethyl-spiro[1,3-dioxane-2,2'(1'H)-pentalene]-4'- acetamide","","- C17 H27 N O3 -","- C17 H27 N O3 -","- C68 H108 N4 O12 -","4","2","KA1316","Jan W. Bats; Öhlinger, Stefan H.; Mulzer, Johann","(+/-)-(3'aα,4'α,6'aα)-3',3'a,4',6'a-Tetrahydro-5,5,<i>N</i>,<i>N</i>-tetramethylspiro[1,3-dioxane-2,2'(1'<i>H</i>)-pentalene]-4'-acetamide, a triclinic crystal structure with local monoclinic pseudosymmetry","Acta Crystallographica Section C","1999","55","7","1158","1160","10.1107/S0108270199003765","","","0.71073","MoKα","","","0.056","","","0.052","","","","","1.07","1.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008693","9.2544","0.0001","14.5543","0.0004","9.6994","0.0002","90","","105.435","0.001","90","","1259.31","0.05","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-(4-methylphenyl)-3-phenyl-4H-1,2,4-triazole","","- C15 H13 N3 -","- C15 H13 N3 -","- C60 H52 N12 -","4","1","LN1079","Kandasamy Chinnakali; Hoong-Kun Fun; Annamalai Senthilvelan; Kamaraj Sriraghavan; Vayalakkavoor T. Ramakrishnan","4-(4-Methylphenyl)-3-phenyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","1999","55","7","1136","1138","10.1107/S0108270199002693","","","0.71073","MoKα","","0.074","0.046","","","","0.12","","","","","","1.043","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008694","11.944","0.0002","16.541","0.0003","24.4068","0.0004","71.432","0.001","78.541","0.001","74.63","0.001","4372.89","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Trimethyl (5SR,6SR)-1,3-dichloro-8-(diethylamino)-5,6-dihydro-5- hydroxyisoquinoline-5,6,7-tricarboxylate","","- C19 H22 Cl2 N2 O7 -","- C19 H22 Cl2 N2 O7 -","- C152 H176 Cl16 N16 O56 -","8","4","LN1080","Tarun Kumar Sarkar; Sunil Kumar Ghosh; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun","Trimethyl (5<i>SR</i>,6<i>SR</i>)-1,3-dichloro-8-diethylamino-5,6-dihydro-5-hydroxyisoquinoline-5,6,7-tricarboxylate","Acta Crystallographica Section C","1999","55","7","1140","1142","10.1107/S010827019900311X","","","0.71073","MoKα","","0.121","0.055","","","","0.168","","","","","","1.006","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008695","11.7954","0.0005","7.6537","0.0003","46.732","0.002","90","","90","","90","","4218.9","0.3","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(2RS,5RS)-2,5-bis[3-(4-methylphenyl)-3-oxopropyl]cyclopentan-1-one","","- C25 H28 O3 -","- C25 H28 O3 -","- C200 H224 O24 -","8","1","LN1083","H. Surya Prakash Rao; S. P. Senthilkumar; Kandasamy Chinnakali; Hoong-Kun Fun","(2<i>RS</i>,5<i>RS</i>)-2,5-Bis[3-(4-methylphenyl)-3-oxopropyl]cyclopentan-1-one","Acta Crystallographica Section C","1999","55","7","1130","1132","10.1107/S0108270199004151","","","0.71073","MoKα","","0.107","0.068","","","","0.148","","","","","","1.14","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008696","11.67","0.003","8.538","0.002","34.208","0.01","90","","92.58","0.02","90","","3405","1.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaqua-[2-(2,6-dichloroanilino)phenyl]acetate magnesium","","- C28 H36 Cl4 Mg N2 O12 -","- C28 H36 Cl4 Mg N2 O12 -","- C112 H144 Cl16 Mg4 N8 O48 -","4","1","NA1405","Castellari, Carlo; Comelli, Fabio; Ottani, Stefano","A hydrated diclofenac salt of the hexaaquamagnesium ion","Acta Crystallographica Section C","1999","55","7","1054","1056","10.1107/S0108270199004096","","","0.71069","MoKα","","0.207","0.047","","","","0.158","","","","","","0.931","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008697","5.474","0.003","5.51","0.003","36.15","0.01","90","0.009","90","0.009","90","0.009","1090.3","0.9","293","","293","","","","","","","","","4","B b 21 m","B -2 -2b","36","","dicalcium disodium tetraniobium tridecaoxide","","- Ca2 Na2 Nb4 O13 -","- Ca2.01 Na1.99 Nb4 O13 -","- Ca8.04 Na7.96 Nb16 O52 -","4","0.5","OA1080","Chiba, Koji; Ishizawa, Nobuo; Oishi, Shuji","A Ruddlesden‒Popper-type layered perovskite, Na~2~Ca~2~Nb~4~O~13~","Acta Crystallographica Section C","1999","55","7","1041","1044","10.1107/S0108270199001134","","","0.7107","MoKα","","0.044","0.044","","0.026","0.026","","","","1.993","1.993","1.993","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2008698","9.563","0.001","9.657","0.001","6.935","0.002","100.89","0.02","102.54","0.02","90.26","0.01","613.2","0.2","299","","299","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H9 Cl2 N O5 -","- C11 H9 Cl2 N O5 -","- C22 H18 Cl4 N2 O10 -","2","1","OA1082","Ishida, Hiroyuki; Kashino, Setsuo","Pyridinium and 1,2-diazinium salts of chloranilic acid","Acta Crystallographica Section C","1999","55","7","1149","1152","10.1107/S0108270199003777","","","0.71073","MoKα","","0.08","0.055","","0.058","","0.049","","","1.33","","","1.33","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008699","3.799","0.001","20.292","0.005","9.675","0.002","90","","99.69","0.02","90","","735.2","0.3","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 Cl2 N4 O4 -","- C14 H10 Cl2 N4 O4 -","- C28 H20 Cl4 N8 O8 -","2","0.5","OA1082","Ishida, Hiroyuki; Kashino, Setsuo","Pyridinium and 1,2-diazinium salts of chloranilic acid","Acta Crystallographica Section C","1999","55","7","1149","1152","10.1107/S0108270199003777","","","0.71073","MoKα","","0.06","0.048","","0.078","","0.061","","","1.55","","","1.55","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008700","10.796","0.003","7.755","0.002","19.315","0.002","90","","90.8","0.01","90","","1617","0.6","297","","273.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","exo-[(RS,SR)-N,N'-Bis(salicylidene)-2,3-butanediaminato]oxovanadium(IV)","","","- C18 H18 N2 O3 V -","- C18 H18 N2 O3 V -","- C72 H72 N8 O12 V4 -","4","1","OA1084","Hoshina, Gakuse; Tsuchimoto, Masanobu; Ohba, Shigeru","<i>exo</i>-[(<i>RS</i>,<i>SR</i>)-<i>N</i>,<i>N</i>'-Bis(salicylidene)-2,3-butanediaminato]oxovanadium(IV)","Acta Crystallographica Section C","1999","55","7","1082","1084","10.1107/S0108270199004187","","","0.71073","MoKα","","0.061","0.036","","","","0.064","","","","","","1.262","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008701","16.014","0.002","16.097","0.001","9.7547","0.0007","95.827","0.006","104.757","0.007","84.81","0.008","2413.6","0.4","248.2","","248","","","","","","","","","3","P -1","-P 1","2","2,2,8,8-tetramethoxy-1a,9-bis(methylacrylato)- 1,4-etheno-octahydronaphthalene-6-ene-3,7-dione","dimethyl 8,8-dimethoxy-7-oxo-1,4-(1,1-dimethoxy-2-oxoethano)- 1,4,4a,7,8,8a-hexahydronaphthalene-2,4a-diyldiacrylate","","- C24 H28 O10 -","- C24 H27.5 O10 -","- C96 H110 O40 -","4","2","OA1086","Yoshihara, Ryouko; Mori, Kazuki; Nishiyama, Shigeru; Yamamura, Syousuke; Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","An asatone-type neolignan and its photocage product","Acta Crystallographica Section C","1999","55","7","1144","1147","10.1107/S0108270199004205","","","1.54184","CuKα","","","0.05","","","","0.102","","","","","","1.62","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008702","15.356","0.003","8.659","0.003","17.271","0.004","90","","94.31","0.02","90","","2290","1.1","248","","248","","","","","",""